#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ofr n THR 3 N -0.18 0.00 -4.15 0.00 -2.24 -1.26 -4.98 114.28 101.47 2ofr n THR 3 Ca 0.05 -0.26 -0.34 0.00 -2.27 0.00 0.00 64.05 61.23 2ofr n THR 3 Cb 0.52 1.13 -0.12 0.00 -2.10 0.00 0.00 70.33 69.77 2ofr n THR 3 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ofr s LYS 4 N -0.37 3.74 -0.89 -0.78 -0.14 -1.26 -5.02 119.74 115.01 2ofr s LYS 4 Ca 0.00 -0.47 -0.18 0.00 -1.36 0.00 0.00 55.97 53.97 2ofr s LYS 4 Cb 0.00 -3.08 0.15 0.00 -1.68 0.00 0.00 37.83 33.21 2ofr s LYS 4 CO 0.00 0.15 1.04 1.21 -0.76 0.00 0.00 175.35 176.99 2ofr s ASN 5 N 0.65 6.62 0.30 2.83 3.84 -1.26 -5.04 114.94 122.88 2ofr s ASN 5 Ca 0.00 -2.11 -0.29 0.00 0.21 0.00 0.00 52.86 50.67 2ofr s ASN 5 Cb -0.14 -2.36 -0.10 0.00 -0.55 0.00 0.00 41.25 38.10 2ofr s ASN 5 CO 0.02 -0.98 1.23 0.00 -2.79 0.00 0.00 177.10 174.58 2ofr s ALA 6 N 2.24 3.47 -0.18 1.71 0.00 -1.26 -4.99 121.76 122.74 2ofr s ALA 6 Ca 0.29 1.11 -0.15 0.00 0.00 0.00 0.00 51.96 53.21 2ofr s ALA 6 Cb -0.07 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 2ofr s ALA 6 CO -0.08 -0.46 0.38 0.42 0.00 0.00 0.00 175.76 176.02 2ofr s ILE 7 N -1.00 5.23 0.62 0.00 -1.09 -1.26 -5.01 121.20 118.68 2ofr s ILE 7 Ca 0.48 0.68 -0.16 0.00 -2.23 0.00 0.00 60.65 59.43 2ofr s ILE 7 Cb -0.37 -3.71 -0.02 0.00 -1.58 0.00 0.00 42.46 36.78 2ofr s ILE 7 CO 0.47 0.29 1.09 0.00 -1.23 0.00 0.00 174.94 175.56 2ofr s ALA 8 N 1.03 2.61 0.22 9.38 0.00 -1.26 -4.34 121.76 129.39 2ofr s ALA 8 Ca 0.19 0.52 -0.32 0.00 0.00 0.00 0.00 51.96 52.34 2ofr s ALA 8 Cb -0.14 -3.29 -0.14 0.00 0.00 0.00 0.00 23.12 19.56 2ofr s ALA 8 CO 0.07 -1.01 1.46 0.94 0.00 0.00 0.00 175.76 177.22 2ofr n GLN 9 N -2.11 2.08 -1.92 0.00 7.27 -0.04 -4.91 117.38 117.74 2ofr n GLN 9 Ca 0.10 0.74 -0.42 0.00 0.07 0.00 0.00 57.00 57.49 2ofr n GLN 9 Cb 0.52 -2.44 -0.03 0.00 2.41 0.00 0.00 30.24 30.70 2ofr n GLN 9 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 2ofr s THR 10 N 0.24 2.60 -0.85 1.69 2.01 -1.26 -2.30 115.64 117.77 2ofr s THR 10 Ca 0.71 0.42 0.00 0.00 0.31 0.00 0.00 61.69 63.14 2ofr s THR 10 Cb -0.66 -3.27 0.00 0.00 0.01 0.00 0.00 72.50 68.58 2ofr s THR 10 CO 0.46 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 175.03 2ofr n GLY 11 N 3.78 0.67 3.61 4.40 0.00 -1.26 -4.95 105.19 111.44 2ofr n GLY 11 Ca 0.14 -0.61 -0.48 0.00 0.00 0.00 0.00 46.02 45.08 2ofr n GLY 11 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2ofr n PHE 12 N -3.21 1.57 -3.37 1.61 7.35 -0.97 -4.91 117.46 115.52 2ofr n PHE 12 Ca -0.09 0.60 -0.45 0.00 -0.76 0.00 0.00 57.45 56.75 2ofr n PHE 12 Cb 0.39 -2.34 -0.04 0.00 0.35 0.00 0.00 39.48 37.84 2ofr n PHE 12 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 2ofr s ASN 13 N 0.10 6.34 0.10 -2.13 3.84 -1.26 -4.95 114.94 116.99 2ofr s ASN 13 Ca 0.72 -2.30 -0.18 0.00 0.21 0.00 0.00 52.86 51.30 2ofr s ASN 13 Cb -0.79 -2.16 -0.06 0.00 -0.55 0.00 0.00 41.25 37.68 2ofr s ASN 13 CO 0.51 -0.67 1.61 0.50 -2.79 0.00 0.00 177.10 176.26 2ofr h LYS 14 N 8.19 0.42 -0.40 0.43 3.64 -2.00 -2.50 116.57 124.35 2ofr h LYS 14 Ca -0.08 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.18 2ofr h LYS 14 Cb 1.06 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.80 2ofr h LYS 14 CO 0.86 0.49 0.12 -0.44 -2.27 0.00 0.00 179.45 178.21 2ofr h ASP 15 N 0.27 0.53 -0.40 4.20 3.32 -1.92 0.12 116.42 122.53 2ofr h ASP 15 Ca 0.09 -0.07 -0.10 0.00 0.02 0.00 0.00 57.03 56.97 2ofr h ASP 15 Cb 0.25 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2ofr h ASP 15 CO -0.00 0.51 -0.14 0.11 -1.72 0.00 0.00 179.24 178.00 2ofr h LYS 16 N 0.57 0.81 -0.12 3.56 1.57 -1.95 -3.15 116.57 117.86 2ofr h LYS 16 Ca 0.14 -0.33 -0.04 0.00 -1.87 0.00 0.00 60.65 58.55 2ofr h LYS 16 Cb 0.18 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 2ofr h LYS 16 CO -0.01 0.96 -0.08 -0.92 -0.57 0.00 0.00 179.45 178.83 2ofr h TYR 17 N 0.62 0.31 -1.40 -1.35 3.20 -0.93 -3.29 116.97 114.14 2ofr h TYR 17 Ca 0.10 -0.08 -0.75 0.00 3.14 0.00 0.00 58.73 61.14 2ofr h TYR 17 Cb 0.69 -0.07 -0.16 0.00 1.54 0.00 0.00 36.73 38.73 2ofr h TYR 17 CO 0.05 0.63 2.04 1.19 -1.64 0.00 0.00 178.16 180.43 2ofr n PHE 18 N -4.67 2.60 0.58 -3.82 3.72 0.36 -4.63 117.46 111.60 2ofr n PHE 18 Ca -0.06 -2.73 0.12 0.00 -0.05 0.00 0.00 57.45 54.72 2ofr n PHE 18 Cb 0.30 -1.67 0.16 0.00 -0.94 0.00 0.00 39.48 37.33 2ofr n PHE 18 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 2ofr n ASN 19 N 1.28 3.25 0.00 4.37 6.94 -1.11 -3.77 115.26 126.21 2ofr n ASN 19 Ca 0.59 -1.98 0.00 0.00 -0.02 0.00 0.00 54.58 53.16 2ofr n ASN 19 Cb 0.26 -0.14 0.00 0.00 -2.36 0.00 0.00 39.78 37.53 2ofr n ASN 19 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2ofr n GLY 20 N 1.41 0.82 4.00 4.83 0.00 0.48 -4.96 105.19 111.78 2ofr n GLY 20 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 2ofr n GLY 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ofr s ASP 21 N -2.91 4.57 -0.02 1.61 2.15 -1.24 -4.68 116.67 116.14 2ofr s ASP 21 Ca 0.00 -0.43 -0.09 0.00 0.43 0.00 0.00 52.55 52.46 2ofr s ASP 21 Cb 0.00 -0.03 -0.05 0.00 -0.30 0.00 0.00 42.92 42.54 2ofr s ASP 21 CO 0.00 -1.70 0.28 -0.69 -0.17 0.00 0.00 175.17 172.89 2ofr s VAL 22 N -3.02 5.27 -0.08 1.11 1.01 -1.26 -2.60 120.40 120.83 2ofr s VAL 22 Ca 0.65 0.39 0.04 0.00 0.00 0.00 0.00 61.98 63.05 2ofr s VAL 22 Cb -0.06 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 2ofr s VAL 22 CO 0.43 0.49 -0.21 0.26 0.00 0.00 0.00 175.10 176.07 2ofr s TRP 23 N -1.17 2.57 -0.12 5.22 0.52 0.41 -4.63 118.94 121.75 2ofr s TRP 23 Ca 0.23 -0.67 -0.05 0.00 0.02 0.00 0.00 56.10 55.64 2ofr s TRP 23 Cb -0.14 -1.67 -0.04 0.00 -1.15 0.00 0.00 33.47 30.48 2ofr s TRP 23 CO 0.12 -0.19 0.06 0.71 0.02 0.00 0.00 176.95 177.68 2ofr s TYR 24 N -0.07 3.34 -0.22 -1.98 2.02 -0.23 -0.94 117.35 119.27 2ofr s TYR 24 Ca -0.05 0.30 -0.29 0.00 -0.37 0.00 0.00 57.07 56.65 2ofr s TYR 24 Cb -0.14 -1.90 0.00 0.00 -0.40 0.00 0.00 41.96 39.52 2ofr s TYR 24 CO 0.04 0.51 1.14 0.08 -1.57 0.00 0.00 175.55 175.76 2ofr s VAL 25 N -0.71 4.48 -0.13 0.71 1.01 -0.42 -1.16 120.40 124.17 2ofr s VAL 25 Ca 0.12 1.77 0.19 0.00 0.00 0.00 0.00 61.98 64.06 2ofr s VAL 25 Cb -0.12 -4.20 -0.27 0.00 0.00 0.00 0.00 36.38 31.80 2ofr s VAL 25 CO 0.03 -0.22 0.29 0.35 0.00 0.00 0.00 175.10 175.55 2ofr n THR 26 N 5.46 0.88 -3.72 3.92 -2.24 -0.05 -4.65 114.28 113.88 2ofr n THR 26 Ca 0.13 -0.71 -0.14 0.00 -2.27 0.00 0.00 64.05 61.05 2ofr n THR 26 Cb 0.46 -0.33 -0.08 0.00 -2.10 0.00 0.00 70.33 68.28 2ofr n THR 26 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2ofr s ASP 27 N -5.17 -0.30 0.02 3.42 1.11 -1.19 -0.84 116.67 113.72 2ofr s ASP 27 Ca -0.09 0.29 -0.07 0.00 0.18 0.00 0.00 52.55 52.87 2ofr s ASP 27 Cb 0.09 0.43 -0.00 0.00 1.07 0.00 0.00 42.92 44.51 2ofr s ASP 27 CO 0.86 -0.42 0.12 -0.72 1.18 0.00 0.00 175.17 176.19 2ofr s TYR 28 N -1.06 0.12 -0.20 4.23 1.13 0.36 -0.70 117.35 121.24 2ofr s TYR 28 Ca -0.11 -0.33 -0.02 0.00 -1.41 0.00 0.00 57.07 55.20 2ofr s TYR 28 Cb -0.04 -0.09 0.06 0.00 -1.10 0.00 0.00 41.96 40.78 2ofr s TYR 28 CO 0.04 -0.34 0.02 -1.17 -2.51 0.00 0.00 175.55 171.59 2ofr s LEU 29 N -1.81 1.41 -0.32 -3.49 2.96 0.10 -0.40 118.68 117.12 2ofr s LEU 29 Ca -0.09 -0.85 -0.09 0.00 -0.22 0.00 0.00 54.13 52.88 2ofr s LEU 29 Cb -0.04 -0.70 0.00 0.00 0.50 0.00 0.00 46.19 45.96 2ofr s LEU 29 CO -0.02 -0.29 0.15 -0.62 -1.32 0.00 0.00 176.35 174.25 2ofr s ASP 30 N 1.78 5.51 0.49 3.68 -1.08 -1.26 -0.71 116.67 125.07 2ofr s ASP 30 Ca -0.01 -0.66 0.28 0.00 -0.52 0.00 0.00 52.55 51.63 2ofr s ASP 30 Cb -0.17 -1.98 0.80 0.00 -1.46 0.00 0.00 42.92 40.10 2ofr s ASP 30 CO -0.08 -0.23 1.78 -0.07 0.52 0.00 0.00 175.17 177.09 2ofr h LEU 31 N 8.34 0.00 -9.50 -1.34 3.38 -1.40 -3.43 115.31 111.37 2ofr h LEU 31 Ca -0.31 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.13 2ofr h LEU 31 Cb 1.13 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.90 2ofr h LEU 31 CO 0.62 0.00 0.74 -0.70 0.09 0.00 0.00 178.44 179.19 2ofr s GLU 32 N -3.41 4.32 0.24 1.13 2.12 -1.26 -4.97 118.70 116.87 2ofr s GLU 32 Ca 0.04 2.02 -0.30 0.00 0.36 0.00 0.00 54.97 57.09 2ofr s GLU 32 Cb 0.07 -3.35 -0.10 0.00 0.26 0.00 0.00 34.13 31.01 2ofr s GLU 32 CO 0.61 -0.45 1.46 -1.25 -0.54 0.00 0.00 175.26 175.09 2ofr s PRO 33 N 1.44 4.25 -0.99 4.30 0.04 -1.26 -3.50 135.00 139.28 2ofr s PRO 33 Ca 0.64 2.33 -0.12 0.00 0.04 0.00 0.00 61.00 63.88 2ofr s PRO 33 Cb -0.35 -3.11 -0.00 0.00 0.04 0.00 0.00 34.50 31.08 2ofr s PRO 33 CO 0.29 -0.45 0.73 -0.25 0.04 0.00 0.00 177.00 177.36 2ofr n ASP 34 N 2.46 -5.70 -0.01 6.66 9.92 -1.26 -4.89 116.55 123.72 2ofr n ASP 34 Ca 0.07 -0.83 -0.01 0.00 -0.53 0.00 0.00 54.79 53.50 2ofr n ASP 34 Cb 0.40 -3.34 -0.02 0.00 -0.64 0.00 0.00 41.12 37.51 2ofr n ASP 34 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 2ofr n ASP 35 N -2.47 4.31 -4.14 -2.24 2.03 -1.23 -5.06 116.55 107.76 2ofr n ASP 35 Ca -0.13 -0.00 -0.26 0.00 0.52 0.00 0.00 54.79 54.92 2ofr n ASP 35 Cb 0.60 0.53 -0.16 0.00 -0.72 0.00 0.00 41.12 41.37 2ofr n ASP 35 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ofr s ALA 36 N -2.06 1.53 1.14 -1.67 0.00 -1.26 -5.10 121.76 114.33 2ofr s ALA 36 Ca -0.02 -0.69 -0.15 0.00 0.00 0.00 0.00 51.96 51.10 2ofr s ALA 36 Cb 0.01 -0.50 0.20 0.00 0.00 0.00 0.00 23.12 22.83 2ofr s ALA 36 CO 0.11 0.28 0.60 -2.30 0.00 0.00 0.00 175.76 174.44 2ofr n PRO 37 N 3.13 -1.97 0.14 0.00 -0.02 -1.26 -4.91 135.00 130.10 2ofr n PRO 37 Ca -0.18 -0.55 0.02 0.00 -2.02 0.00 0.00 63.50 60.77 2ofr n PRO 37 Cb 0.53 -1.98 0.02 0.00 -0.02 0.00 0.00 33.50 32.05 2ofr n PRO 37 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2ofr h LYS 38 N -2.38 0.00 -6.56 -0.52 6.56 -2.02 -3.43 116.57 108.23 2ofr h LYS 38 Ca -0.57 0.00 -0.69 0.00 -1.06 0.00 0.00 60.65 58.33 2ofr h LYS 38 Cb 1.34 0.00 -0.30 0.00 -0.57 0.00 0.00 32.23 32.70 2ofr h LYS 38 CO 0.44 0.51 -0.89 1.03 -2.06 0.00 0.00 179.45 178.48 2ofr s ARG 39 N -2.95 2.05 0.00 3.15 1.81 -1.26 -4.96 118.95 116.79 2ofr s ARG 39 Ca 0.04 -0.92 0.00 0.00 -1.72 0.00 0.00 55.73 53.13 2ofr s ARG 39 Cb 0.08 -2.00 0.00 0.00 -0.45 0.00 0.00 34.95 32.58 2ofr s ARG 39 CO 0.75 0.55 0.00 0.98 -0.68 0.00 0.00 175.30 176.89 2ofr n TYR 40 N 2.42 0.00 -3.90 -0.53 9.36 -1.26 -4.72 117.16 118.53 2ofr n TYR 40 Ca -0.16 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 60.96 2ofr n TYR 40 Cb 0.51 0.00 -0.10 0.00 -0.63 0.00 0.00 39.34 39.13 2ofr n TYR 40 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2ofr s ALA 42 N -1.95 -1.94 0.20 0.00 0.00 -1.26 -1.81 121.76 115.00 2ofr s ALA 42 Ca -0.10 1.62 -0.16 0.00 0.00 0.00 0.00 51.96 53.32 2ofr s ALA 42 Cb -0.05 -0.79 0.02 0.00 0.00 0.00 0.00 23.12 22.30 2ofr s ALA 42 CO -0.01 -0.30 0.49 0.00 0.00 0.00 0.00 175.76 175.94 2ofr s ALA 43 N -1.00 -0.72 0.14 0.00 0.00 -0.69 -1.30 121.76 118.18 2ofr s ALA 43 Ca -0.01 -0.41 -0.10 0.00 0.00 0.00 0.00 51.96 51.44 2ofr s ALA 43 Cb -0.01 0.88 -0.00 0.00 0.00 0.00 0.00 23.12 23.99 2ofr s ALA 43 CO 0.01 -0.80 0.27 -0.48 0.00 0.00 0.00 175.76 174.76 2ofr s LEU 44 N -2.91 1.03 0.14 0.00 2.34 -0.11 -1.00 118.68 118.17 2ofr s LEU 44 Ca 0.12 -0.76 0.09 0.00 0.06 0.00 0.00 54.13 53.65 2ofr s LEU 44 Cb -0.01 1.22 -0.04 0.00 -0.56 0.00 0.00 46.19 46.80 2ofr s LEU 44 CO -0.00 -0.85 -0.16 0.00 -1.06 0.00 0.00 176.35 174.28 2ofr s ALA 45 N -3.92 2.74 -0.07 1.48 0.00 0.32 -0.44 121.76 121.87 2ofr s ALA 45 Ca 0.12 -1.42 -0.03 0.00 0.00 0.00 0.00 51.96 50.63 2ofr s ALA 45 Cb 0.04 -0.63 0.04 0.00 0.00 0.00 0.00 23.12 22.56 2ofr s ALA 45 CO -0.04 0.54 0.14 0.00 0.00 0.00 0.00 175.76 176.40 2ofr s ALA 46 N -1.37 -0.22 0.02 0.00 0.00 -1.07 -1.18 121.76 117.94 2ofr s ALA 46 Ca 0.20 0.63 -0.29 0.00 0.00 0.00 0.00 51.96 52.50 2ofr s ALA 46 Cb -0.10 -0.52 0.11 0.00 0.00 0.00 0.00 23.12 22.60 2ofr s ALA 46 CO 0.11 -0.25 1.18 0.20 0.00 0.00 0.00 175.76 177.01 2ofr s GLY 47 N 1.42 -0.36 -0.13 0.00 0.00 -0.63 -0.39 107.32 107.23 2ofr s GLY 47 Ca -0.06 0.60 -0.14 0.00 0.00 0.00 0.00 44.72 45.11 2ofr s GLY 47 CO -0.06 0.12 0.32 -1.59 0.00 0.00 0.00 173.10 171.90 2ofr s THR 48 N -2.69 5.27 -0.18 0.90 2.01 -1.25 -0.75 115.64 118.95 2ofr s THR 48 Ca 0.13 0.62 0.00 0.00 0.31 0.00 0.00 61.69 62.76 2ofr s THR 48 Cb 0.03 -3.65 0.04 0.00 0.01 0.00 0.00 72.50 68.92 2ofr s THR 48 CO -0.02 0.42 -0.11 0.00 -0.69 0.00 0.00 174.62 174.22 2ofr s ALA 49 N 0.20 1.87 -1.42 7.40 0.00 0.02 -4.76 121.76 125.06 2ofr s ALA 49 Ca 0.19 -1.05 -0.01 0.00 0.00 0.00 0.00 51.96 51.09 2ofr s ALA 49 Cb -0.14 -1.18 0.01 0.00 0.00 0.00 0.00 23.12 21.81 2ofr s ALA 49 CO 0.06 -0.67 0.41 0.43 0.00 0.00 0.00 175.76 175.99 2ofr n SER 50 N 4.74 -0.37 0.00 0.00 7.64 -1.26 -1.26 113.62 123.11 2ofr n SER 50 Ca -0.15 -1.02 0.00 0.00 1.01 0.00 0.00 58.87 58.71 2ofr n SER 50 Cb 0.48 -2.99 0.00 0.00 -1.01 0.00 0.00 64.21 60.69 2ofr n SER 50 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ofr n GLY 51 N -1.99 0.88 3.57 0.23 0.00 -1.26 -5.01 105.19 101.61 2ofr n GLY 51 Ca -0.30 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 2ofr n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ofr s LYS 52 N -0.13 3.36 -0.13 1.61 -0.14 -0.39 -5.08 119.74 118.84 2ofr s LYS 52 Ca 0.00 -0.48 -0.29 0.00 -1.36 0.00 0.00 55.97 53.83 2ofr s LYS 52 Cb 0.00 -2.85 -0.01 0.00 -1.68 0.00 0.00 37.83 33.29 2ofr s LYS 52 CO 0.00 0.44 1.02 -1.17 -0.76 0.00 0.00 175.35 174.88 2ofr s LEU 53 N -0.16 4.22 0.08 3.17 2.96 -1.26 -0.80 118.68 126.88 2ofr s LEU 53 Ca 0.04 1.52 0.04 0.00 -0.22 0.00 0.00 54.13 55.50 2ofr s LEU 53 Cb -0.13 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 2ofr s LEU 53 CO 0.02 -0.49 -0.11 -0.54 -1.32 0.00 0.00 176.35 173.91 2ofr s LYS 54 N 2.23 0.78 -0.00 1.98 -0.14 0.07 -1.14 119.74 123.52 2ofr s LYS 54 Ca 0.48 -1.02 0.01 0.00 -1.36 0.00 0.00 55.97 54.08 2ofr s LYS 54 Cb -0.18 -0.58 -0.00 0.00 -1.68 0.00 0.00 37.83 35.39 2ofr s LYS 54 CO 0.16 0.11 -0.03 -1.21 -0.76 0.00 0.00 175.35 173.62 2ofr s GLU 55 N -2.23 0.22 -0.11 1.68 2.02 -0.77 -1.61 118.70 117.90 2ofr s GLU 55 Ca 0.00 -0.11 0.01 0.00 0.02 0.00 0.00 54.97 54.89 2ofr s GLU 55 Cb -0.06 -0.21 -0.01 0.00 0.10 0.00 0.00 34.13 33.94 2ofr s GLU 55 CO 0.01 0.06 -0.15 0.00 0.02 0.00 0.00 175.26 175.19 2ofr s ALA 56 N -0.09 2.55 0.15 5.21 0.00 -0.33 -0.68 121.76 128.57 2ofr s ALA 56 Ca 0.01 -0.92 0.09 0.00 0.00 0.00 0.00 51.96 51.14 2ofr s ALA 56 Cb -0.01 -1.10 -0.04 0.00 0.00 0.00 0.00 23.12 21.97 2ofr s ALA 56 CO -0.00 0.31 -0.14 -0.51 0.00 0.00 0.00 175.76 175.42 2ofr s LEU 57 N 0.15 2.84 -0.04 0.00 1.43 0.29 -0.52 118.68 122.84 2ofr s LEU 57 Ca -0.08 -0.56 0.01 0.00 -1.03 0.00 0.00 54.13 52.47 2ofr s LEU 57 Cb -0.15 -1.61 0.02 0.00 0.03 0.00 0.00 46.19 44.48 2ofr s LEU 57 CO 0.05 0.14 -0.04 -0.47 0.23 0.00 0.00 176.35 176.26 2ofr s TYR 58 N -1.42 0.69 -0.00 0.29 5.04 -0.17 -1.53 117.35 120.25 2ofr s TYR 58 Ca 0.21 -0.18 0.06 0.00 -2.44 0.00 0.00 57.07 54.73 2ofr s TYR 58 Cb -0.10 -0.60 -0.02 0.00 0.35 0.00 0.00 41.96 41.59 2ofr s TYR 58 CO 0.13 -0.16 -0.18 -1.01 -1.34 0.00 0.00 175.55 172.98 2ofr s HIS 59 N 0.77 1.63 -0.18 4.97 3.76 -0.35 -1.71 115.29 124.18 2ofr s HIS 59 Ca -0.10 -0.32 -0.05 0.00 -0.15 0.00 0.00 55.06 54.44 2ofr s HIS 59 Cb -0.13 -1.03 0.09 0.00 1.11 0.00 0.00 32.58 32.61 2ofr s HIS 59 CO 0.00 -0.00 0.34 -0.47 -0.85 0.00 0.00 174.74 173.76 2ofr s TYR 60 N -0.51 -0.63 -0.39 1.40 5.04 -0.75 -1.66 117.35 119.85 2ofr s TYR 60 Ca 0.07 1.17 -0.20 0.00 -2.44 0.00 0.00 57.07 55.66 2ofr s TYR 60 Cb -0.07 0.11 0.01 0.00 0.35 0.00 0.00 41.96 42.35 2ofr s TYR 60 CO -0.00 -0.47 0.62 0.34 -1.34 0.00 0.00 175.55 174.70 2ofr s ASP 61 N 2.52 6.36 0.13 4.32 -1.08 -0.22 -2.04 116.67 126.67 2ofr s ASP 61 Ca 0.02 -0.08 0.21 0.00 -0.52 0.00 0.00 52.55 52.17 2ofr s ASP 61 Cb -0.13 -2.31 0.84 0.00 -1.46 0.00 0.00 42.92 39.86 2ofr s ASP 61 CO -0.11 -0.65 1.63 -0.81 0.52 0.00 0.00 175.17 175.75 2ofr n PRO 62 N 6.08 0.11 -0.04 4.34 -0.04 -1.26 -0.18 135.00 143.99 2ofr n PRO 62 Ca -0.02 0.30 -0.21 0.00 -0.04 0.00 0.00 63.50 63.54 2ofr n PRO 62 Cb 0.48 -1.69 -0.13 0.00 -0.04 0.00 0.00 33.50 32.12 2ofr n PRO 62 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2ofr n LYS 63 N -1.89 0.71 0.12 0.54 5.02 -1.26 -4.47 118.16 116.94 2ofr n LYS 63 Ca 0.03 0.25 0.10 0.00 -2.02 0.00 0.00 58.31 56.68 2ofr n LYS 63 Cb 0.23 -1.65 0.02 0.00 -0.02 0.00 0.00 35.03 33.61 2ofr n LYS 63 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 2ofr h THR 64 N -0.06 0.06 0.00 -0.18 1.35 -1.97 -3.48 112.91 108.64 2ofr h THR 64 Ca -0.47 -1.11 0.00 0.00 -0.55 0.00 0.00 66.41 64.28 2ofr h THR 64 Cb 1.94 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 70.00 2ofr h THR 64 CO 0.00 0.03 0.00 0.00 -0.25 0.00 0.00 175.52 175.31 2ofr n GLN 65 N -2.78 -0.78 -1.71 4.72 6.02 0.74 -5.00 117.38 118.59 2ofr n GLN 65 Ca -0.00 0.20 -0.43 0.00 -0.01 0.00 0.00 57.00 56.76 2ofr n GLN 65 Cb 0.58 -3.80 -0.03 0.00 1.02 0.00 0.00 30.24 28.00 2ofr n GLN 65 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2ofr n ASP 66 N -0.39 3.92 -3.89 1.08 2.03 -1.24 -4.76 116.55 113.30 2ofr n ASP 66 Ca 0.00 1.05 -0.16 0.00 0.52 0.00 0.00 54.79 56.20 2ofr n ASP 66 Cb 0.20 -1.56 -0.15 0.00 -0.72 0.00 0.00 41.12 38.89 2ofr n ASP 66 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2ofr s THR 67 N 1.43 0.30 -0.07 5.18 2.01 -1.26 -1.06 115.64 122.17 2ofr s THR 67 Ca 0.77 -0.07 -0.25 0.00 0.31 0.00 0.00 61.69 62.44 2ofr s THR 67 Cb -0.52 -0.31 0.06 0.00 0.01 0.00 0.00 72.50 71.73 2ofr s THR 67 CO 0.34 0.13 0.58 0.72 -0.69 0.00 0.00 174.62 175.70 2ofr s PHE 68 N 0.46 -0.55 0.16 4.92 -0.71 -0.67 -5.02 117.98 116.57 2ofr s PHE 68 Ca -0.05 1.02 0.08 0.00 -1.04 0.00 0.00 56.93 56.94 2ofr s PHE 68 Cb -0.08 0.30 -0.04 0.00 -1.21 0.00 0.00 43.02 41.99 2ofr s PHE 68 CO -0.01 -0.51 -0.06 0.71 -1.34 0.00 0.00 175.22 174.02 2ofr s TYR 69 N -0.95 2.76 0.01 3.49 1.51 -1.24 -1.21 117.35 121.72 2ofr s TYR 69 Ca -0.10 -0.16 -0.01 0.00 -1.01 0.00 0.00 57.07 55.79 2ofr s TYR 69 Cb -0.02 -1.37 -0.01 0.00 -0.11 0.00 0.00 41.96 40.45 2ofr s TYR 69 CO 0.07 0.49 -0.00 -0.51 -1.11 0.00 0.00 175.55 174.49 2ofr s ASP 70 N -2.70 0.16 -0.05 2.29 1.11 -0.58 -1.44 116.67 115.46 2ofr s ASP 70 Ca 0.25 -0.36 0.03 0.00 0.18 0.00 0.00 52.55 52.65 2ofr s ASP 70 Cb -0.10 0.10 -0.03 0.00 1.07 0.00 0.00 42.92 43.96 2ofr s ASP 70 CO 0.16 -0.25 -0.11 -0.69 1.18 0.00 0.00 175.17 175.46 2ofr s VAL 71 N -1.15 3.33 0.02 -1.27 1.01 -0.51 -0.55 120.40 121.28 2ofr s VAL 71 Ca -0.13 -0.66 -0.03 0.00 0.00 0.00 0.00 61.98 61.17 2ofr s VAL 71 Cb -0.08 -2.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 2ofr s VAL 71 CO -0.01 0.57 0.04 -0.44 0.00 0.00 0.00 175.10 175.27 2ofr s SER 72 N -0.84 0.19 -0.34 3.32 0.01 0.15 -1.00 113.70 115.18 2ofr s SER 72 Ca 0.12 -0.46 -0.14 0.00 1.31 0.00 0.00 55.95 56.78 2ofr s SER 72 Cb -0.11 0.16 -0.01 0.00 0.21 0.00 0.00 66.02 66.27 2ofr s SER 72 CO 0.02 -0.38 0.31 -0.70 0.41 0.00 0.00 173.24 172.90 2ofr s GLU 73 N -1.83 3.53 0.18 12.44 2.12 -1.26 -1.84 118.70 132.05 2ofr s GLU 73 Ca -0.12 -0.51 -0.30 0.00 0.36 0.00 0.00 54.97 54.40 2ofr s GLU 73 Cb -0.06 -3.81 -0.08 0.00 0.26 0.00 0.00 34.13 30.44 2ofr s GLU 73 CO -0.02 -0.49 1.13 -0.51 -0.54 0.00 0.00 175.26 174.83 2ofr s LEU 74 N 1.90 4.48 -0.04 2.70 1.02 -0.29 -4.46 118.68 123.98 2ofr s LEU 74 Ca 0.09 2.15 -0.02 0.00 0.02 0.00 0.00 54.13 56.37 2ofr s LEU 74 Cb -0.17 -3.61 -0.04 0.00 0.02 0.00 0.00 46.19 42.40 2ofr s LEU 74 CO 0.11 -0.27 0.09 -1.10 0.02 0.00 0.00 176.35 175.20 2ofr s GLN 75 N -0.37 3.16 -0.10 1.70 -1.52 0.03 -4.60 119.66 117.96 2ofr s GLN 75 Ca 0.50 -0.38 -0.24 0.00 -1.95 0.00 0.00 55.36 53.30 2ofr s GLN 75 Cb -0.31 -2.94 -0.03 0.00 -0.22 0.00 0.00 33.01 29.51 2ofr s GLN 75 CO 0.36 0.69 0.72 0.08 -0.25 0.00 0.00 175.29 176.88 2ofr s VAL 76 N -1.12 5.01 -0.22 1.09 1.01 -1.26 -1.29 120.40 123.63 2ofr s VAL 76 Ca 0.20 1.45 -0.01 0.00 0.00 0.00 0.00 61.98 63.63 2ofr s VAL 76 Cb -0.12 -4.05 -0.20 0.00 0.00 0.00 0.00 36.38 32.01 2ofr s VAL 76 CO 0.10 0.19 -0.04 -0.62 0.00 0.00 0.00 175.10 174.73 2ofr n GLU 77 N 4.19 0.68 -3.72 2.72 -0.58 0.03 -4.94 120.64 119.02 2ofr n GLU 77 Ca -0.00 0.19 -0.03 0.00 -0.42 0.00 0.00 57.16 56.90 2ofr n GLU 77 Cb 0.51 -1.58 -0.01 0.00 -0.57 0.00 0.00 31.44 29.78 2ofr n GLU 77 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2ofr s SER 78 N -6.69 -0.16 0.12 1.62 1.04 -1.06 -5.02 113.70 103.55 2ofr s SER 78 Ca -0.31 -0.34 -0.31 0.00 0.48 0.00 0.00 55.95 55.47 2ofr s SER 78 Cb 0.08 0.42 -0.10 0.00 0.10 0.00 0.00 66.02 66.52 2ofr s SER 78 CO 0.65 -0.77 1.84 -0.22 0.98 0.00 0.00 173.24 175.72 2ofr s LEU 79 N -2.93 4.40 0.00 2.42 2.96 -1.26 -1.33 118.68 122.94 2ofr s LEU 79 Ca 0.12 2.76 0.00 0.00 -0.22 0.00 0.00 54.13 56.79 2ofr s LEU 79 Cb -0.00 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.12 2ofr s LEU 79 CO 0.01 -1.01 0.00 0.61 -1.32 0.00 0.00 176.35 174.64 2ofr n GLY 80 N 4.25 0.55 2.91 7.98 0.00 -1.26 -4.78 105.19 114.84 2ofr n GLY 80 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 2ofr n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ofr s LYS 81 N -0.12 1.38 0.10 1.61 1.02 -0.44 -1.00 119.74 122.28 2ofr s LYS 81 Ca 0.00 -0.23 0.03 0.00 0.02 0.00 0.00 55.97 55.79 2ofr s LYS 81 Cb 0.00 -1.40 -0.04 0.00 -0.52 0.00 0.00 37.83 35.87 2ofr s LYS 81 CO 0.00 -0.19 -0.08 0.71 -0.92 0.00 0.00 175.35 174.87 2ofr s TYR 82 N 1.45 0.98 -0.12 3.18 2.02 -0.07 -0.79 117.35 123.99 2ofr s TYR 82 Ca -0.01 -0.80 0.03 0.00 -0.37 0.00 0.00 57.07 55.93 2ofr s TYR 82 Cb -0.13 -0.54 0.01 0.00 -0.40 0.00 0.00 41.96 40.89 2ofr s TYR 82 CO -0.05 -0.07 -0.21 0.99 -1.57 0.00 0.00 175.55 174.64 2ofr s THR 83 N -3.13 1.95 -0.30 -0.71 2.01 -0.41 -1.11 115.64 113.94 2ofr s THR 83 Ca 0.10 -0.93 0.03 0.00 0.31 0.00 0.00 61.69 61.20 2ofr s THR 83 Cb 0.02 -1.71 0.08 0.00 0.01 0.00 0.00 72.50 70.90 2ofr s THR 83 CO -0.02 0.53 -0.01 0.00 -0.69 0.00 0.00 174.62 174.43 2ofr s ALA 84 N 0.65 2.63 -0.23 7.40 0.00 0.51 -0.79 121.76 131.94 2ofr s ALA 84 Ca -0.12 -2.13 -0.29 0.00 0.00 0.00 0.00 51.96 49.42 2ofr s ALA 84 Cb -0.16 -1.77 -0.00 0.00 0.00 0.00 0.00 23.12 21.18 2ofr s ALA 84 CO 0.02 -1.48 1.24 -0.80 0.00 0.00 0.00 175.76 174.75 2ofr s ASN 85 N 1.05 6.86 0.26 0.00 0.01 -1.26 -0.87 114.94 120.99 2ofr s ASN 85 Ca 0.03 1.45 0.05 0.00 -0.71 0.00 0.00 52.86 53.68 2ofr s ASN 85 Cb -0.19 -2.54 -0.03 0.00 0.41 0.00 0.00 41.25 38.90 2ofr s ASN 85 CO -0.08 -0.87 0.38 0.72 -1.51 0.00 0.00 177.10 175.74 2ofr s PHE 86 N 3.80 3.39 -0.11 2.20 -0.12 -1.18 -4.33 117.98 121.62 2ofr s PHE 86 Ca 0.54 -0.06 -0.01 0.00 -0.05 0.00 0.00 56.93 57.35 2ofr s PHE 86 Cb -0.19 -1.65 0.03 0.00 -0.63 0.00 0.00 43.02 40.58 2ofr s PHE 86 CO 0.17 0.35 -0.07 0.21 -0.05 0.00 0.00 175.22 175.83 2ofr s LYS 87 N -4.02 1.44 0.16 1.99 2.20 -0.17 -4.17 119.74 117.18 2ofr s LYS 87 Ca 0.36 -0.23 -0.30 0.00 -0.36 0.00 0.00 55.97 55.44 2ofr s LYS 87 Cb -0.09 -1.55 -0.08 0.00 -1.51 0.00 0.00 37.83 34.60 2ofr s LYS 87 CO 0.29 -0.28 1.21 0.21 -0.36 0.00 0.00 175.35 176.42 2ofr s LYS 88 N 1.73 4.47 0.09 4.03 2.20 -0.56 -1.42 119.74 130.28 2ofr s LYS 88 Ca 0.05 1.87 0.02 0.00 -0.36 0.00 0.00 55.97 57.54 2ofr s LYS 88 Cb -0.13 -3.26 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 2ofr s LYS 88 CO -0.08 -0.13 -0.07 0.14 -0.36 0.00 0.00 175.35 174.85 2ofr s VAL 89 N 0.18 0.68 1.06 4.02 -7.23 -0.52 -0.69 120.40 117.90 2ofr s VAL 89 Ca 0.54 -1.86 -0.17 0.00 -1.81 0.00 0.00 61.98 58.68 2ofr s VAL 89 Cb -0.32 -1.59 0.24 0.00 0.56 0.00 0.00 36.38 35.26 2ofr s VAL 89 CO 0.35 -0.83 1.24 1.51 -0.31 0.00 0.00 175.10 177.06 2ofr s ASP 90 N -2.92 2.20 0.56 4.85 1.47 -0.28 -3.67 116.67 118.89 2ofr s ASP 90 Ca 0.10 0.41 0.25 0.00 1.18 0.00 0.00 52.55 54.49 2ofr s ASP 90 Cb 0.04 -0.54 1.59 0.00 -0.34 0.00 0.00 42.92 43.67 2ofr s ASP 90 CO -0.04 -3.31 2.17 0.07 0.68 0.00 0.00 175.17 174.73 2ofr h LYS 91 N -2.03 0.00 -0.16 2.11 2.10 -1.95 -0.85 116.57 115.78 2ofr h LYS 91 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 2ofr h LYS 91 Cb 1.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 2ofr h LYS 91 CO 0.36 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.90 2ofr n ASN 92 N -4.08 1.82 0.00 7.07 3.02 -1.26 -4.75 115.26 117.08 2ofr n ASN 92 Ca -0.01 -1.71 0.00 0.00 -0.03 0.00 0.00 54.58 52.83 2ofr n ASN 92 Cb 0.18 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 2ofr n ASN 92 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ofr n GLY 93 N 1.17 0.74 3.72 7.41 0.00 -0.32 -5.00 105.19 112.90 2ofr n GLY 93 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2ofr n GLY 93 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ofr s ASN 94 N -2.27 7.17 0.01 1.61 0.01 -1.26 -4.79 114.94 115.42 2ofr s ASN 94 Ca 0.00 2.04 -0.30 0.00 -0.71 0.00 0.00 52.86 53.89 2ofr s ASN 94 Cb 0.00 -2.59 -0.05 0.00 0.41 0.00 0.00 41.25 39.02 2ofr s ASN 94 CO 0.00 -0.35 1.27 -0.69 -1.51 0.00 0.00 177.10 175.82 2ofr s VAL 95 N 0.45 3.97 -0.25 1.60 1.01 -1.26 -1.12 120.40 124.79 2ofr s VAL 95 Ca 0.54 1.36 0.01 0.00 0.00 0.00 0.00 61.98 63.89 2ofr s VAL 95 Cb -0.29 -3.87 -0.16 0.00 0.00 0.00 0.00 36.38 32.05 2ofr s VAL 95 CO 0.32 0.04 -0.23 0.29 0.00 0.00 0.00 175.10 175.52 2ofr n LYS 96 N 4.77 0.63 -3.68 2.72 5.02 0.13 -4.93 118.16 122.83 2ofr n LYS 96 Ca 0.11 0.15 -0.23 0.00 -2.02 0.00 0.00 58.31 56.32 2ofr n LYS 96 Cb 0.45 -1.50 -0.17 0.00 -0.02 0.00 0.00 35.03 33.78 2ofr n LYS 96 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2ofr s VAL 97 N -2.51 0.08 0.84 -0.18 1.01 -0.88 -4.98 120.40 113.78 2ofr s VAL 97 Ca -0.34 0.08 -0.10 0.00 0.00 0.00 0.00 61.98 61.61 2ofr s VAL 97 Cb 0.09 -0.46 0.10 0.00 0.00 0.00 0.00 36.38 36.11 2ofr s VAL 97 CO 0.58 0.02 1.11 0.00 0.00 0.00 0.00 175.10 176.81 2ofr s ALA 98 N 2.08 1.86 0.31 5.51 0.00 -1.26 -1.50 121.76 128.77 2ofr s ALA 98 Ca 0.03 0.37 -0.28 0.00 0.00 0.00 0.00 51.96 52.08 2ofr s ALA 98 Cb -0.14 -3.34 -0.13 0.00 0.00 0.00 0.00 23.12 19.51 2ofr s ALA 98 CO -0.06 -2.22 1.15 0.28 0.00 0.00 0.00 175.76 174.91 2ofr n VAL 99 N -3.84 1.98 -3.92 0.00 0.31 -1.26 -4.80 118.33 106.79 2ofr n VAL 99 Ca 0.10 -0.50 -0.10 0.00 -0.01 0.00 0.00 64.34 63.83 2ofr n VAL 99 Cb 0.53 -1.29 -0.11 0.00 -0.91 0.00 0.00 33.84 32.05 2ofr n VAL 99 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2ofr s THR 100 N -1.06 0.07 0.28 2.52 -4.23 -1.26 -5.07 115.64 106.89 2ofr s THR 100 Ca 0.57 -0.62 0.01 0.00 -1.18 0.00 0.00 61.69 60.47 2ofr s THR 100 Cb -0.63 -0.25 0.27 0.00 1.34 0.00 0.00 72.50 73.23 2ofr s THR 100 CO 0.61 -0.34 1.81 0.00 -0.54 0.00 0.00 174.62 176.16 2ofr h ALA 101 N 4.95 1.44 0.00 3.99 0.00 -1.99 -2.06 119.26 125.60 2ofr h ALA 101 Ca -0.30 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2ofr h ALA 101 Cb 1.21 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2ofr h ALA 101 CO 0.43 0.12 0.00 0.78 0.00 0.00 0.00 179.25 180.58 2ofr h GLY 102 N 0.87 0.00 -7.21 0.00 0.00 -1.97 -3.41 103.07 91.35 2ofr h GLY 102 Ca 0.49 0.00 -0.75 0.00 0.00 0.00 0.00 47.33 47.06 2ofr h GLY 102 CO -0.29 0.00 -0.23 -1.31 0.00 0.00 0.00 176.54 174.71 2ofr s ASN 103 N -4.73 6.12 0.13 0.19 -0.87 -0.78 -3.51 114.94 111.49 2ofr s ASN 103 Ca 0.04 -1.92 -0.16 0.00 -1.57 0.00 0.00 52.86 49.25 2ofr s ASN 103 Cb 0.09 -2.16 0.03 0.00 -0.02 0.00 0.00 41.25 39.20 2ofr s ASN 103 CO 0.46 -0.79 0.40 -0.72 -2.57 0.00 0.00 177.10 173.88 2ofr s TYR 104 N 1.39 -0.19 0.08 2.20 1.13 -0.53 -3.08 117.35 118.34 2ofr s TYR 104 Ca 0.05 -0.13 0.07 0.00 -1.41 0.00 0.00 57.07 55.65 2ofr s TYR 104 Cb -0.27 0.26 -0.03 0.00 -1.10 0.00 0.00 41.96 40.82 2ofr s TYR 104 CO 0.01 -0.71 -0.19 1.52 -2.51 0.00 0.00 175.55 173.67 2ofr s TYR 105 N -3.81 1.62 0.39 -3.49 1.13 -0.05 -0.52 117.35 112.63 2ofr s TYR 105 Ca 0.03 -0.41 -0.06 0.00 -1.41 0.00 0.00 57.07 55.23 2ofr s TYR 105 Cb 0.02 -0.92 -0.05 0.00 -1.10 0.00 0.00 41.96 39.91 2ofr s TYR 105 CO -0.12 0.13 0.69 0.95 -2.51 0.00 0.00 175.55 174.70 2ofr s THR 106 N -1.06 4.93 -0.14 -3.49 -4.23 -0.52 -0.36 115.64 110.77 2ofr s THR 106 Ca 0.05 0.19 -0.05 0.00 -1.18 0.00 0.00 61.69 60.69 2ofr s THR 106 Cb -0.09 -3.80 0.07 0.00 1.34 0.00 0.00 72.50 70.02 2ofr s THR 106 CO 0.03 -0.59 0.29 0.12 -0.54 0.00 0.00 174.62 173.93 2ofr s PHE 107 N -2.42 -0.49 -0.10 3.99 5.36 -0.26 -2.68 117.98 121.38 2ofr s PHE 107 Ca 0.47 1.08 0.01 0.00 -0.96 0.00 0.00 56.93 57.53 2ofr s PHE 107 Cb -0.10 0.04 0.02 0.00 -0.34 0.00 0.00 43.02 42.63 2ofr s PHE 107 CO 0.36 -0.37 -0.14 0.99 -1.46 0.00 0.00 175.22 174.60 2ofr s THR 108 N 2.38 1.37 -0.54 0.12 2.01 -0.14 -0.89 115.64 119.95 2ofr s THR 108 Ca -0.00 -0.57 -0.20 0.00 0.31 0.00 0.00 61.69 61.23 2ofr s THR 108 Cb -0.12 -1.27 0.06 0.00 0.01 0.00 0.00 72.50 71.18 2ofr s THR 108 CO -0.09 0.42 0.73 -0.69 -0.69 0.00 0.00 174.62 174.30 2ofr s VAL 109 N 1.03 4.71 -0.33 3.82 1.01 -0.17 -1.20 120.40 129.26 2ofr s VAL 109 Ca -0.06 -0.39 0.20 0.00 0.00 0.00 0.00 61.98 61.73 2ofr s VAL 109 Cb -0.15 -4.41 0.22 0.00 0.00 0.00 0.00 36.38 32.05 2ofr s VAL 109 CO -0.02 -0.98 1.51 0.24 0.00 0.00 0.00 175.10 175.85 2ofr h MET 110 N 9.14 0.00 -1.60 2.72 2.86 -1.12 -0.08 114.93 126.84 2ofr h MET 110 Ca -0.28 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.43 2ofr h MET 110 Cb 1.09 0.00 -0.26 0.00 0.06 0.00 0.00 31.60 32.49 2ofr h MET 110 CO 1.03 0.16 0.44 -0.47 1.06 0.00 0.00 176.91 179.13 2ofr s TYR 111 N -3.14 -0.50 0.04 -0.22 5.04 -1.10 -3.06 117.35 114.42 2ofr s TYR 111 Ca 0.05 1.18 -0.20 0.00 -2.44 0.00 0.00 57.07 55.66 2ofr s TYR 111 Cb 0.06 0.36 0.04 0.00 0.35 0.00 0.00 41.96 42.78 2ofr s TYR 111 CO 0.70 -0.24 0.45 0.00 -1.34 0.00 0.00 175.55 175.12 2ofr s ALA 112 N 0.37 -1.11 0.00 3.97 0.00 -1.26 -0.67 121.76 123.06 2ofr s ALA 112 Ca 0.02 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.40 2ofr s ALA 112 Cb -0.05 0.33 0.00 0.00 0.00 0.00 0.00 23.12 23.40 2ofr s ALA 112 CO -0.07 -0.46 0.00 -0.40 0.00 0.00 0.00 175.76 174.83 2ofr n ASP 113 N 0.53 0.00 0.00 0.00 5.75 -0.09 -4.96 116.55 117.77 2ofr n ASP 113 Ca -0.19 -0.52 0.15 0.00 -0.01 0.00 0.00 54.79 54.23 2ofr n ASP 113 Cb 0.60 0.00 0.85 0.00 -1.03 0.00 0.00 41.12 41.54 2ofr n ASP 113 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2ofr n ASP 114 N -1.18 0.00 0.00 -1.12 8.00 -1.26 -3.79 116.55 117.20 2ofr n ASP 114 Ca 0.00 -0.69 0.00 0.00 0.71 0.00 0.00 54.79 54.81 2ofr n ASP 114 Cb 0.00 -0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 2ofr n ASP 114 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2ofr n SER 115 N -1.09 2.53 -3.78 -2.24 3.41 -1.26 -4.87 113.62 106.31 2ofr n SER 115 Ca 0.20 -0.15 -0.10 0.00 -0.26 0.00 0.00 58.87 58.57 2ofr n SER 115 Cb 0.15 0.80 -0.06 0.00 -0.26 0.00 0.00 64.21 64.83 2ofr n SER 115 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2ofr s SER 116 N -1.31 -0.01 0.14 4.04 1.04 -1.25 -1.21 113.70 115.14 2ofr s SER 116 Ca 0.00 -0.51 -0.23 0.00 0.48 0.00 0.00 55.95 55.69 2ofr s SER 116 Cb 0.00 0.38 0.07 0.00 0.10 0.00 0.00 66.02 66.57 2ofr s SER 116 CO 0.00 -0.76 0.59 0.00 0.98 0.00 0.00 173.24 174.05 2ofr s ALA 117 N -3.72 -1.55 -0.11 5.32 0.00 -0.79 -0.92 121.76 119.99 2ofr s ALA 117 Ca 0.03 0.52 0.02 0.00 0.00 0.00 0.00 51.96 52.53 2ofr s ALA 117 Cb 0.03 0.79 0.02 0.00 0.00 0.00 0.00 23.12 23.96 2ofr s ALA 117 CO -0.11 -0.72 -0.15 -1.17 0.00 0.00 0.00 175.76 173.61 2ofr s LEU 118 N -2.60 1.71 0.26 0.00 2.96 0.15 -0.47 118.68 120.69 2ofr s LEU 118 Ca -0.00 -0.43 0.09 0.00 -0.22 0.00 0.00 54.13 53.56 2ofr s LEU 118 Cb -0.01 -1.10 -0.05 0.00 0.50 0.00 0.00 46.19 45.53 2ofr s LEU 118 CO -0.11 0.01 -0.13 0.27 -1.32 0.00 0.00 176.35 175.07 2ofr s ILE 119 N 1.06 1.95 -0.01 6.68 -4.36 -0.31 -0.73 121.20 125.48 2ofr s ILE 119 Ca -0.05 -2.24 0.07 0.00 -0.26 0.00 0.00 60.65 58.17 2ofr s ILE 119 Cb -0.15 -2.28 -0.02 0.00 1.25 0.00 0.00 42.46 41.26 2ofr s ILE 119 CO -0.03 -0.42 -0.22 -2.28 0.24 0.00 0.00 174.94 172.23 2ofr s HIS 120 N -2.83 1.98 0.12 1.37 5.65 -0.34 -1.39 115.29 119.84 2ofr s HIS 120 Ca 0.27 -0.38 0.06 0.00 0.25 0.00 0.00 55.06 55.27 2ofr s HIS 120 Cb -0.00 -1.27 -0.04 0.00 -1.18 0.00 0.00 32.58 30.09 2ofr s HIS 120 CO 0.11 -0.02 -0.15 0.95 -0.65 0.00 0.00 174.74 174.98 2ofr s THR 121 N -0.54 1.40 -0.21 0.89 -4.23 0.22 -0.97 115.64 112.19 2ofr s THR 121 Ca 0.09 -1.66 -0.00 0.00 -1.18 0.00 0.00 61.69 58.93 2ofr s THR 121 Cb -0.09 -1.51 0.06 0.00 1.34 0.00 0.00 72.50 72.30 2ofr s THR 121 CO -0.01 -0.34 -0.03 0.00 -0.54 0.00 0.00 174.62 173.71 2ofr s LEU 123 N 1.56 4.23 -0.22 0.00 2.96 -1.26 -1.43 118.68 124.52 2ofr s LEU 123 Ca -0.04 0.87 -0.02 0.00 -0.22 0.00 0.00 54.13 54.72 2ofr s LEU 123 Cb -0.18 -2.82 0.01 0.00 0.50 0.00 0.00 46.19 43.71 2ofr s LEU 123 CO -0.07 -0.11 -0.09 -1.00 -1.32 0.00 0.00 176.35 173.76 2ofr s HIS 124 N 1.12 2.94 -0.32 5.38 3.76 0.32 -4.42 115.29 124.07 2ofr s HIS 124 Ca 0.28 -1.30 -0.01 0.00 -0.15 0.00 0.00 55.06 53.89 2ofr s HIS 124 Cb -0.16 -2.04 0.10 0.00 1.11 0.00 0.00 32.58 31.59 2ofr s HIS 124 CO 0.12 -0.67 0.12 0.21 -0.85 0.00 0.00 174.74 173.67 2ofr s LYS 125 N 1.39 0.70 7.54 1.40 2.20 -1.26 -1.46 119.74 130.24 2ofr s LYS 125 Ca 0.04 -1.11 0.00 0.00 -0.36 0.00 0.00 55.97 54.54 2ofr s LYS 125 Cb -0.15 -1.90 0.00 0.00 -1.51 0.00 0.00 37.83 34.28 2ofr s LYS 125 CO -0.06 -1.02 0.00 0.41 -0.36 0.00 0.00 175.35 174.32 2ofr n GLY 126 N 4.74 3.57 1.40 5.54 0.00 -1.23 -2.07 105.19 117.15 2ofr n GLY 126 Ca -0.01 -0.09 0.09 0.00 0.00 0.00 0.00 46.02 46.01 2ofr n GLY 126 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ofr n ASN 127 N 4.85 4.12 -4.80 1.61 0.23 -1.26 -4.97 115.26 115.03 2ofr n ASN 127 Ca 0.00 -2.30 -0.36 0.00 -0.53 0.00 0.00 54.58 51.39 2ofr n ASN 127 Cb 0.00 -0.52 -0.06 0.00 -2.08 0.00 0.00 39.78 37.12 2ofr n ASN 127 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 2ofr s LYS 128 N -1.66 4.36 0.15 -3.83 2.20 -0.88 -5.04 119.74 115.04 2ofr s LYS 128 Ca 0.45 1.05 -0.31 0.00 -0.36 0.00 0.00 55.97 56.80 2ofr s LYS 128 Cb 0.28 -2.76 -0.10 0.00 -1.51 0.00 0.00 37.83 33.75 2ofr s LYS 128 CO 0.24 0.30 1.57 0.00 -0.36 0.00 0.00 175.35 177.10 2ofr s ALA 129 N -1.65 3.75 0.23 3.13 0.00 -1.26 -4.45 121.76 121.51 2ofr s ALA 129 Ca 0.48 1.33 -0.10 0.00 0.00 0.00 0.00 51.96 53.67 2ofr s ALA 129 Cb -0.16 -3.63 -0.07 0.00 0.00 0.00 0.00 23.12 19.26 2ofr s ALA 129 CO 0.21 -0.82 0.56 0.00 0.00 0.00 0.00 175.76 175.71 2ofr s ALA 130 N 1.38 3.56 0.06 0.00 0.00 -1.26 -4.85 121.76 120.65 2ofr s ALA 130 Ca 0.70 -0.25 -0.11 0.00 0.00 0.00 0.00 51.96 52.30 2ofr s ALA 130 Cb -0.43 -2.45 0.01 0.00 0.00 0.00 0.00 23.12 20.25 2ofr s ALA 130 CO 0.31 0.50 0.24 0.20 0.00 0.00 0.00 175.76 177.01 2ofr s GLY 131 N -2.32 -0.01 0.11 0.00 0.00 -1.26 0.82 107.32 104.64 2ofr s GLY 131 Ca 0.47 -0.30 -0.31 0.00 0.00 0.00 0.00 44.72 44.58 2ofr s GLY 131 CO 0.21 -0.50 1.41 0.99 0.00 0.00 0.00 173.10 175.21 2ofr s ASP 132 N -2.40 6.81 -0.10 1.64 1.01 -1.26 -4.40 116.67 117.97 2ofr s ASP 132 Ca -0.01 2.33 -0.00 0.00 0.71 0.00 0.00 52.55 55.57 2ofr s ASP 132 Cb 0.01 -2.58 0.02 0.00 1.01 0.00 0.00 42.92 41.38 2ofr s ASP 132 CO -0.07 -0.68 -0.06 -0.22 0.21 0.00 0.00 175.17 174.35 2ofr s LEU 133 N 1.27 1.11 -0.02 1.23 0.20 -0.69 -0.99 118.68 120.79 2ofr s LEU 133 Ca 0.65 -0.25 -0.03 0.00 0.69 0.00 0.00 54.13 55.19 2ofr s LEU 133 Cb -0.37 -0.74 -0.04 0.00 -0.43 0.00 0.00 46.19 44.61 2ofr s LEU 133 CO 0.30 -0.12 0.16 -0.31 -0.29 0.00 0.00 176.35 176.09 2ofr s TYR 134 N 1.64 3.50 -0.02 5.38 2.02 0.11 -0.61 117.35 129.37 2ofr s TYR 134 Ca 0.03 0.34 0.00 0.00 -0.37 0.00 0.00 57.07 57.07 2ofr s TYR 134 Cb -0.13 -1.82 0.02 0.00 -0.40 0.00 0.00 41.96 39.63 2ofr s TYR 134 CO -0.06 0.63 0.01 0.00 -1.57 0.00 0.00 175.55 174.56 2ofr s ALA 135 N -1.28 0.15 -0.13 3.71 0.00 -0.49 -0.72 121.76 123.01 2ofr s ALA 135 Ca 0.26 0.13 -0.19 0.00 0.00 0.00 0.00 51.96 52.16 2ofr s ALA 135 Cb -0.12 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 2ofr s ALA 135 CO 0.17 -0.05 0.53 0.08 0.00 0.00 0.00 175.76 176.49 2ofr s VAL 136 N 0.64 5.14 0.16 0.00 1.01 0.12 -1.16 120.40 126.31 2ofr s VAL 136 Ca -0.06 1.05 0.08 0.00 0.00 0.00 0.00 61.98 63.06 2ofr s VAL 136 Cb -0.08 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 2ofr s VAL 136 CO -0.02 0.28 -0.09 -0.76 0.00 0.00 0.00 175.10 174.51 2ofr s LEU 137 N 0.89 3.00 0.02 3.92 1.43 0.38 -0.87 118.68 127.44 2ofr s LEU 137 Ca 0.28 -0.52 -0.05 0.00 -1.03 0.00 0.00 54.13 52.81 2ofr s LEU 137 Cb -0.16 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.34 2ofr s LEU 137 CO 0.11 0.12 0.09 0.21 0.23 0.00 0.00 176.35 177.11 2ofr s ASN 138 N -2.66 0.14 0.46 2.29 3.84 -0.31 -1.89 114.94 116.81 2ofr s ASN 138 Ca 0.24 -0.41 0.25 0.00 0.21 0.00 0.00 52.86 53.15 2ofr s ASN 138 Cb -0.09 0.19 1.02 0.00 -0.55 0.00 0.00 41.25 41.82 2ofr s ASN 138 CO 0.15 -0.42 1.87 0.03 -2.79 0.00 0.00 177.10 175.94 2ofr h ARG 139 N 4.07 0.00 -5.00 0.43 2.47 -1.42 -0.60 114.38 114.33 2ofr h ARG 139 Ca -0.32 0.00 -0.65 0.00 -1.26 0.00 0.00 59.98 57.75 2ofr h ARG 139 Cb 1.19 0.00 -0.24 0.00 -1.65 0.00 0.00 29.97 29.27 2ofr h ARG 139 CO 0.45 0.20 -0.66 1.21 0.56 0.00 0.00 179.97 181.73 2ofr s ASN 140 N -6.15 4.81 0.61 7.04 3.84 -1.26 -4.82 114.94 119.01 2ofr s ASN 140 Ca 0.00 -0.26 0.36 0.00 0.21 0.00 0.00 52.86 53.17 2ofr s ASN 140 Cb 0.10 -1.84 1.98 0.00 -0.55 0.00 0.00 41.25 40.94 2ofr s ASN 140 CO 0.62 -0.01 2.25 0.07 -2.79 0.00 0.00 177.10 177.24 2ofr h LYS 141 N 8.03 0.00 -0.20 0.43 2.10 -1.95 -2.24 116.57 122.75 2ofr h LYS 141 Ca -0.39 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.26 2ofr h LYS 141 Cb 1.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 2ofr h LYS 141 CO 0.59 0.02 0.00 -0.25 -2.00 0.00 0.00 179.45 177.82 2ofr n ASP 142 N -3.41 2.96 -4.71 7.07 8.00 -1.26 -4.93 116.55 120.27 2ofr n ASP 142 Ca -0.02 -1.88 -0.42 0.00 0.71 0.00 0.00 54.79 53.17 2ofr n ASP 142 Cb 0.13 -0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 41.08 2ofr n ASP 142 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ofr s ALA 143 N -1.48 3.72 0.43 2.24 0.00 -0.84 -4.99 121.76 120.83 2ofr s ALA 143 Ca 0.29 1.28 -0.25 0.00 0.00 0.00 0.00 51.96 53.28 2ofr s ALA 143 Cb 0.18 -3.61 -0.08 0.00 0.00 0.00 0.00 23.12 19.61 2ofr s ALA 143 CO 0.26 -0.78 1.26 0.00 0.00 0.00 0.00 175.76 176.50 2ofr s ALA 144 N 1.33 3.13 0.13 0.00 0.00 -1.26 -4.95 121.76 120.15 2ofr s ALA 144 Ca 0.69 1.14 -0.31 0.00 0.00 0.00 0.00 51.96 53.48 2ofr s ALA 144 Cb -0.41 -3.46 -0.10 0.00 0.00 0.00 0.00 23.12 19.15 2ofr s ALA 144 CO 0.31 -0.80 1.67 0.00 0.00 0.00 0.00 175.76 176.94 2ofr s ALA 145 N -1.35 3.77 0.44 0.00 0.00 -1.26 -4.98 121.76 118.37 2ofr s ALA 145 Ca 0.60 1.37 -0.02 0.00 0.00 0.00 0.00 51.96 53.91 2ofr s ALA 145 Cb -0.35 -3.69 -0.03 0.00 0.00 0.00 0.00 23.12 19.06 2ofr s ALA 145 CO 0.44 -1.00 0.69 0.20 0.00 0.00 0.00 175.76 176.09 2ofr s GLY 146 N 1.87 1.46 0.66 0.00 0.00 -1.26 -4.87 107.32 105.17 2ofr s GLY 146 Ca 0.74 -0.75 0.40 0.00 0.00 0.00 0.00 44.72 45.11 2ofr s GLY 146 CO 0.33 -0.61 2.27 -0.55 0.00 0.00 0.00 173.10 174.53 2ofr h ASP 147 N 0.41 0.00 0.32 1.64 3.32 -1.97 -0.95 116.42 119.19 2ofr h ASP 147 Ca -0.48 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.56 2ofr h ASP 147 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2ofr h ASP 147 CO 0.61 0.00 -0.15 0.50 -1.72 0.00 0.00 179.24 178.47 2ofr h LYS 148 N 0.00 -0.42 -0.46 3.56 3.64 -1.98 0.70 116.57 121.60 2ofr h LYS 148 Ca 0.01 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2ofr h LYS 148 Cb 0.15 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 2ofr h LYS 148 CO -0.00 -0.09 0.20 -0.24 -2.27 0.00 0.00 179.45 177.05 2ofr h VAL 149 N -0.90 1.17 -0.34 2.00 3.04 -1.92 -1.42 116.25 117.88 2ofr h VAL 149 Ca -0.04 -0.52 -0.08 0.00 -1.01 0.00 0.00 66.70 65.05 2ofr h VAL 149 Cb 0.52 0.61 -0.02 0.00 -2.01 0.00 0.00 31.29 30.39 2ofr h VAL 149 CO 0.07 0.20 -0.13 0.11 -1.01 0.00 0.00 177.57 176.81 2ofr h LYS 150 N 0.66 0.60 -0.71 4.17 1.57 -1.07 -1.07 116.57 120.72 2ofr h LYS 150 Ca 0.16 -0.19 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 2ofr h LYS 150 Cb 0.12 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 2ofr h LYS 150 CO -0.02 0.72 0.26 0.77 -0.57 0.00 0.00 179.45 180.61 2ofr h SER 151 N 0.55 1.00 -0.59 0.86 0.02 0.10 -1.58 113.55 113.91 2ofr h SER 151 Ca 0.10 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.84 2ofr h SER 151 Cb 0.55 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.80 2ofr h SER 151 CO 0.03 0.92 0.31 0.00 -1.14 0.00 0.00 176.83 176.95 2ofr h ALA 152 N 1.12 1.39 -0.19 3.77 0.00 -0.64 0.13 119.26 124.84 2ofr h ALA 152 Ca 0.23 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2ofr h ALA 152 Cb 0.25 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2ofr h ALA 152 CO -0.01 0.49 0.12 0.28 0.00 0.00 0.00 179.25 180.12 2ofr h VAL 153 N 0.86 1.08 -0.47 0.00 2.07 -0.69 -1.46 116.25 117.64 2ofr h VAL 153 Ca 0.22 -0.18 0.09 0.00 0.82 0.00 0.00 66.70 67.64 2ofr h VAL 153 Cb 0.07 0.85 -0.07 0.00 -1.52 0.00 0.00 31.29 30.61 2ofr h VAL 153 CO -0.03 0.07 0.03 0.28 0.02 0.00 0.00 177.57 177.94 2ofr h SER 154 N 0.24 -0.14 0.55 0.57 0.02 -0.69 -2.14 113.55 111.96 2ofr h SER 154 Ca 0.07 0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 2ofr h SER 154 Cb 0.02 0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.72 2ofr h SER 154 CO -0.01 -0.04 -0.10 0.00 -1.14 0.00 0.00 176.83 175.54 2ofr h ALA 155 N 1.40 1.14 -0.12 3.77 0.00 -0.28 0.26 119.26 125.44 2ofr h ALA 155 Ca 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2ofr h ALA 155 Cb 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2ofr h ALA 155 CO -0.36 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.01 2ofr n ALA 156 N -2.21 2.51 -3.62 0.00 0.00 -0.59 -4.91 120.51 111.69 2ofr n ALA 156 Ca -0.01 -0.27 -0.22 0.00 0.00 0.00 0.00 53.44 52.94 2ofr n ALA 156 Cb 0.27 -1.07 0.06 0.00 0.00 0.00 0.00 19.45 18.71 2ofr n ALA 156 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2ofr n THR 157 N -0.16 -4.20 -4.44 0.00 -1.04 0.93 -5.02 114.28 100.34 2ofr n THR 157 Ca 0.09 -0.29 -0.23 0.00 -2.04 0.00 0.00 64.05 61.57 2ofr n THR 157 Cb 0.14 -4.09 -0.10 0.00 -1.82 0.00 0.00 70.33 64.47 2ofr n THR 157 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2ofr s LEU 158 N -6.83 2.56 -0.27 -4.42 1.43 -0.85 -5.04 118.68 105.26 2ofr s LEU 158 Ca 0.26 -1.01 -0.08 0.00 -1.03 0.00 0.00 54.13 52.27 2ofr s LEU 158 Cb -0.12 -1.01 -0.02 0.00 0.03 0.00 0.00 46.19 45.07 2ofr s LEU 158 CO 0.77 0.00 0.10 -1.61 0.23 0.00 0.00 176.35 175.84 2ofr s GLU 159 N -3.44 3.56 0.50 1.70 2.02 -1.26 -3.77 118.70 118.01 2ofr s GLU 159 Ca 0.27 -0.55 0.16 0.00 0.02 0.00 0.00 54.97 54.87 2ofr s GLU 159 Cb -0.04 -3.42 1.19 0.00 0.10 0.00 0.00 34.13 31.96 2ofr s GLU 159 CO 0.13 -0.26 2.09 0.35 0.02 0.00 0.00 175.26 177.59 2ofr h PHE 160 N 8.28 0.00 -0.02 1.61 3.57 -1.91 -1.38 116.94 127.09 2ofr h PHE 160 Ca -0.36 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.15 2ofr h PHE 160 Cb 1.17 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.90 2ofr h PHE 160 CO 0.67 0.07 0.10 0.66 -2.23 0.00 0.00 178.31 177.58 2ofr h SER 161 N 0.00 0.00 1.53 0.41 4.64 -2.02 -0.64 113.55 117.48 2ofr h SER 161 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ofr h SER 161 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 2ofr h SER 161 CO 0.01 0.00 -0.38 0.11 -0.87 0.00 0.00 176.83 175.70 2ofr h LYS 162 N 0.00 0.00 -6.99 4.77 1.79 -1.67 -3.46 116.57 111.01 2ofr h LYS 162 Ca 0.01 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.96 2ofr h LYS 162 Cb 0.20 0.00 0.08 0.00 -1.58 0.00 0.00 32.23 30.93 2ofr h LYS 162 CO -0.00 0.00 0.53 -0.06 -1.08 0.00 0.00 179.45 178.84 2ofr s PHE 163 N -3.25 2.79 -0.17 -1.35 0.40 -0.25 -4.90 117.98 111.25 2ofr s PHE 163 Ca 0.05 1.49 -0.12 0.00 -0.60 0.00 0.00 56.93 57.74 2ofr s PHE 163 Cb 0.08 -3.51 -0.05 0.00 0.51 0.00 0.00 43.02 40.05 2ofr s PHE 163 CO 0.71 -1.82 0.24 0.42 0.70 0.00 0.00 175.22 175.46 2ofr s ILE 164 N -1.43 5.34 0.38 0.64 1.01 0.46 -4.83 121.20 122.77 2ofr s ILE 164 Ca 0.63 0.43 -0.23 0.00 0.00 0.00 0.00 60.65 61.48 2ofr s ILE 164 Cb -0.33 -3.58 -0.10 0.00 0.01 0.00 0.00 42.46 38.46 2ofr s ILE 164 CO 0.40 0.41 0.93 -0.55 0.00 0.00 0.00 174.94 176.14 2ofr s SER 165 N 0.37 7.10 0.00 3.58 0.15 -1.26 -0.49 113.70 123.14 2ofr s SER 165 Ca 0.14 1.73 0.25 0.00 0.70 0.00 0.00 55.95 58.77 2ofr s SER 165 Cb -0.12 -2.55 0.59 0.00 -1.71 0.00 0.00 66.02 62.23 2ofr s SER 165 CO 0.02 -0.23 1.48 0.35 1.20 0.00 0.00 173.24 176.07 2ofr n THR 166 N -0.12 0.08 0.32 6.45 -2.24 -0.02 -4.65 114.28 114.12 2ofr n THR 166 Ca 0.05 -0.42 0.15 0.00 -2.27 0.00 0.00 64.05 61.56 2ofr n THR 166 Cb 0.52 0.95 0.58 0.00 -2.10 0.00 0.00 70.33 70.28 2ofr n THR 166 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2ofr h LYS 167 N 3.55 0.00 -0.57 -0.78 2.10 -1.92 -3.00 116.57 115.95 2ofr h LYS 167 Ca 0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.63 2ofr h LYS 167 Cb 0.76 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.08 2ofr h LYS 167 CO 0.00 0.00 0.03 0.39 -2.00 0.00 0.00 179.45 177.87 2ofr n GLU 168 N -2.82 4.60 -0.20 0.07 1.02 -1.26 -4.47 120.64 117.59 2ofr n GLU 168 Ca 0.02 -3.14 0.09 0.00 -0.02 0.00 0.00 57.16 54.11 2ofr n GLU 168 Cb 0.31 -2.23 0.20 0.00 -0.02 0.00 0.00 31.44 29.70 2ofr n GLU 168 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2ofr n ASN 169 N 0.42 3.22 -1.82 1.62 3.02 -1.13 -4.98 115.26 115.61 2ofr n ASN 169 Ca 0.29 -1.93 -0.18 0.00 -0.03 0.00 0.00 54.58 52.73 2ofr n ASN 169 Cb 1.20 -0.26 -0.03 0.00 -0.61 0.00 0.00 39.78 40.08 2ofr n ASN 169 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2ofr n ASN 170 N 1.14 -5.21 -4.76 6.41 5.03 -1.26 -4.92 115.26 111.69 2ofr n ASN 170 Ca 0.17 0.14 -0.40 0.00 0.87 0.00 0.00 54.58 55.35 2ofr n ASN 170 Cb 0.52 -4.29 -0.04 0.00 -1.02 0.00 0.00 39.78 34.95 2ofr n ASN 170 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2ofr s ALA 172 N -1.02 1.67 0.15 0.00 0.00 -1.26 -5.14 121.76 116.17 2ofr s ALA 172 Ca 0.46 -0.79 0.11 0.00 0.00 0.00 0.00 51.96 51.74 2ofr s ALA 172 Cb -0.33 -0.52 -0.04 0.00 0.00 0.00 0.00 23.12 22.23 2ofr s ALA 172 CO 0.42 0.33 -0.26 0.71 0.00 0.00 0.00 175.76 176.95 2ofr s TYR 173 N -0.09 2.31 -0.86 0.00 1.51 -1.26 -5.07 117.35 113.89 2ofr s TYR 173 Ca -0.02 -0.37 -0.12 0.00 -1.01 0.00 0.00 57.07 55.55 2ofr s TYR 173 Cb -0.11 -1.21 0.22 0.00 -0.11 0.00 0.00 41.96 40.75 2ofr s TYR 173 CO 0.02 0.40 0.80 0.34 -1.11 0.00 0.00 175.55 176.00 2ofr s ASP 174 N -2.28 6.72 0.35 2.29 -1.08 -1.26 -4.91 116.67 116.51 2ofr s ASP 174 Ca 0.16 -2.88 0.05 0.00 -0.52 0.00 0.00 52.55 49.37 2ofr s ASP 174 Cb -0.09 -2.18 0.66 0.00 -1.46 0.00 0.00 42.92 39.86 2ofr s ASP 174 CO 0.07 -0.50 1.91 0.78 0.52 0.00 0.00 175.17 177.95 2ofr h ASN 175 N 7.49 0.46 -0.42 -0.34 -0.26 -2.00 -2.38 115.58 118.14 2ofr h ASN 175 Ca 0.11 -0.07 -0.02 0.00 -0.56 0.00 0.00 56.30 55.76 2ofr h ASN 175 Cb 1.00 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 38.12 2ofr h ASN 175 CO 0.79 0.51 0.18 0.44 -1.06 0.00 0.00 177.43 178.29 2ofr h ASP 176 N 0.48 0.56 -0.16 5.81 3.32 -2.00 -1.59 116.42 122.85 2ofr h ASP 176 Ca 0.11 -0.15 0.03 0.00 0.02 0.00 0.00 57.03 57.03 2ofr h ASP 176 Cb 0.27 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 2ofr h ASP 176 CO 0.00 0.56 -0.03 -1.28 -1.72 0.00 0.00 179.24 176.78 2ofr h SER 177 N 0.53 -0.12 -0.67 6.45 0.87 -1.79 -1.37 113.55 117.45 2ofr h SER 177 Ca 0.14 0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.75 2ofr h SER 177 Cb 0.16 0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.18 2ofr h SER 177 CO -0.01 -0.04 0.45 -0.07 -0.53 0.00 0.00 176.83 176.62 2ofr h LEU 178 N 0.02 0.77 -0.50 2.23 3.38 -1.20 0.43 115.31 120.44 2ofr h LEU 178 Ca 0.08 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 2ofr h LEU 178 Cb 0.11 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2ofr h LEU 178 CO -0.15 0.56 0.05 0.11 0.09 0.00 0.00 178.44 179.09 2ofr h LYS 179 N 0.91 0.84 -0.50 1.13 1.57 -1.17 -3.02 116.57 116.34 2ofr h LYS 179 Ca 0.25 -0.24 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 2ofr h LYS 179 Cb -0.10 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.10 2ofr h LYS 179 CO -0.06 0.86 -0.06 1.03 -0.57 0.00 0.00 179.45 180.65 2ofr h SER 180 N 0.71 0.86 0.02 0.86 0.87 -0.74 -2.75 113.55 113.38 2ofr h SER 180 Ca 0.15 -0.25 -0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2ofr h SER 180 Cb 0.44 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 62.17 2ofr h SER 180 CO 0.02 0.96 -0.00 -0.07 -0.53 0.00 0.00 176.83 177.20 2ofr h LEU 181 N 0.80 0.00 -2.03 2.23 3.38 -0.79 -1.00 115.31 117.89 2ofr h LEU 181 Ca 0.14 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.23 2ofr h LEU 181 Cb 0.56 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 2ofr h LEU 181 CO 0.03 0.00 0.33 -0.07 0.09 0.00 0.00 178.44 178.83 2ofr h LEU 182 N 0.00 0.00 -0.16 1.67 3.38 -1.46 -1.28 115.31 117.45 2ofr h LEU 182 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ofr h LEU 182 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2ofr h LEU 182 CO 0.00 0.00 -0.20 0.35 0.09 0.00 0.00 178.44 178.68 2ofr n THR 183 N -4.21 0.00 1.04 0.22 -2.24 -0.38 -4.71 114.28 104.00 2ofr n THR 183 Ca 0.07 -0.04 0.12 0.00 -2.27 0.00 0.00 64.05 61.93 2ofr n THR 183 Cb 0.53 -0.03 0.14 0.00 -2.10 0.00 0.00 70.33 68.87 2ofr n THR 183 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79