#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dfy s TRP 20 N 0.00 2.42 0.42 7.33 0.23 -1.26 -5.03 118.94 123.05 2dfy s TRP 20 Ca 0.00 1.59 -0.19 0.00 -2.03 0.00 0.00 56.10 55.47 2dfy s TRP 20 Cb 0.00 -3.15 -0.10 0.00 0.03 0.00 0.00 33.47 30.25 2dfy s TRP 20 CO 0.00 -1.96 0.91 0.15 0.96 0.00 0.00 176.95 177.00 2dfy s LYS 21 N -4.57 4.14 0.13 4.98 -0.14 -1.26 -4.85 119.74 118.16 2dfy s LYS 21 Ca 0.64 0.99 -0.10 0.00 -1.36 0.00 0.00 55.97 56.15 2dfy s LYS 21 Cb -0.20 -2.23 -0.06 0.00 -1.68 0.00 0.00 37.83 33.66 2dfy s LYS 21 CO 0.51 -0.02 0.45 1.03 -0.76 0.00 0.00 175.35 176.56 2dfy s ARG 22 N -3.27 3.78 -0.02 1.68 0.52 -1.26 -0.52 118.95 119.86 2dfy s ARG 22 Ca 0.60 0.21 -0.28 0.00 -0.52 0.00 0.00 55.73 55.73 2dfy s ARG 22 Cb -0.09 -2.90 -0.03 0.00 0.52 0.00 0.00 34.95 32.44 2dfy s ARG 22 CO 0.17 0.49 0.90 0.00 0.02 0.00 0.00 175.30 176.88 2dfy h ALA 24 N 6.79 1.00 0.18 0.00 0.00 -1.58 0.70 119.26 126.35 2dfy h ALA 24 Ca -0.41 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.16 2dfy h ALA 24 Cb 1.21 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.01 2dfy h ALA 24 CO 0.75 0.00 -1.66 0.78 0.00 0.00 0.00 179.25 179.12 2dfy h GLY 25 N 1.80 0.43 0.00 0.00 0.00 -1.82 -3.41 103.07 100.07 2dfy h GLY 25 Ca 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 47.33 46.23 2dfy h GLY 25 CO 0.00 0.96 0.00 0.00 0.00 0.00 0.00 176.54 177.50 2dfy n GLY 27 N 0.58 0.61 3.88 0.00 0.00 0.24 -5.00 105.19 105.49 2dfy n GLY 27 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2dfy n GLY 27 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dfy s GLY 28 N -2.00 1.87 0.40 -0.02 0.00 -1.26 -4.59 107.32 101.72 2dfy s GLY 28 Ca 0.00 -0.24 -0.26 0.00 0.00 0.00 0.00 44.72 44.22 2dfy s GLY 28 CO 0.00 -0.05 1.28 0.54 0.00 0.00 0.00 173.10 174.87 2dfy s LYS 29 N -4.02 4.00 -0.47 2.90 1.02 -1.26 -0.94 119.74 120.97 2dfy s LYS 29 Ca 0.51 2.10 -0.15 0.00 0.02 0.00 0.00 55.97 58.45 2dfy s LYS 29 Cb -0.10 -2.76 0.07 0.00 -0.52 0.00 0.00 37.83 34.52 2dfy s LYS 29 CO 0.34 -0.45 0.38 0.42 -0.92 0.00 0.00 175.35 175.13 2dfy s ILE 30 N -1.28 5.13 -1.64 2.17 1.01 0.32 -4.86 121.20 122.05 2dfy s ILE 30 Ca 0.56 -1.09 0.23 0.00 0.00 0.00 0.00 60.65 60.36 2dfy s ILE 30 Cb -0.37 -4.07 0.01 0.00 0.01 0.00 0.00 42.46 38.04 2dfy s ILE 30 CO 0.47 -0.57 1.19 0.00 0.00 0.00 0.00 174.94 176.03 2dfy n ALA 31 N 5.17 3.72 -1.75 9.38 0.00 -1.26 -4.48 120.51 131.29 2dfy n ALA 31 Ca -0.12 -0.55 -0.38 0.00 0.00 0.00 0.00 53.44 52.38 2dfy n ALA 31 Cb 0.44 -0.90 0.03 0.00 0.00 0.00 0.00 19.45 19.02 2dfy n ALA 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2dfy s ASP 32 N -2.65 5.43 0.27 0.00 1.11 -1.26 -4.93 116.67 114.64 2dfy s ASP 32 Ca 0.17 2.72 -0.04 0.00 0.18 0.00 0.00 52.55 55.58 2dfy s ASP 32 Cb 0.18 -2.63 0.34 0.00 1.07 0.00 0.00 42.92 41.87 2dfy s ASP 32 CO 0.64 -1.46 1.89 -0.09 1.18 0.00 0.00 175.17 177.33 2dfy h ARG 33 N 1.60 1.10 -6.28 8.23 2.43 -1.95 -3.42 114.38 116.11 2dfy h ARG 33 Ca -0.51 -0.12 -0.69 0.00 -0.81 0.00 0.00 59.98 57.85 2dfy h ARG 33 Cb 1.29 -0.22 -0.30 0.00 -0.42 0.00 0.00 29.97 30.33 2dfy h ARG 33 CO 0.58 0.81 -0.87 -0.06 -1.51 0.00 0.00 179.97 178.92 2dfy s PHE 34 N -5.73 2.44 0.27 2.20 0.08 -1.26 0.47 117.98 116.44 2dfy s PHE 34 Ca -0.12 -0.53 -0.01 0.00 0.12 0.00 0.00 56.93 56.39 2dfy s PHE 34 Cb 0.17 -1.57 0.01 0.00 -0.57 0.00 0.00 43.02 41.06 2dfy s PHE 34 CO 0.81 -0.09 0.38 1.47 -0.10 0.00 0.00 175.22 177.69 2dfy n LEU 35 N 2.67 0.00 -4.30 -0.37 -0.00 -0.08 -4.68 117.00 110.24 2dfy n LEU 35 Ca -0.17 -2.20 -0.23 0.00 -0.00 0.00 0.00 56.01 53.41 2dfy n LEU 35 Cb 0.52 1.97 -0.12 0.00 -0.00 0.00 0.00 43.42 45.79 2dfy n LEU 35 CO 0.25 -0.51 -0.50 -0.76 -0.00 0.00 0.00 177.39 175.86 2dfy s LEU 36 N 0.00 2.34 -0.10 1.47 1.43 -0.61 -1.08 118.68 122.13 2dfy s LEU 36 Ca 0.22 -0.74 0.02 0.00 -1.03 0.00 0.00 54.13 52.61 2dfy s LEU 36 Cb -0.01 -0.86 0.01 0.00 0.03 0.00 0.00 46.19 45.36 2dfy s LEU 36 CO 0.16 0.03 -0.17 -0.47 0.23 0.00 0.00 176.35 176.13 2dfy s TYR 37 N -1.44 2.04 -0.11 0.29 5.04 0.08 -1.15 117.35 122.10 2dfy s TYR 37 Ca 0.09 -0.91 -0.30 0.00 -2.44 0.00 0.00 57.07 53.51 2dfy s TYR 37 Cb -0.09 -1.44 0.09 0.00 0.35 0.00 0.00 41.96 40.87 2dfy s TYR 37 CO 0.05 -0.44 0.80 0.00 -1.34 0.00 0.00 175.55 174.61 2dfy s ALA 38 N 0.80 -1.83 -1.45 3.97 0.00 -0.03 -1.07 121.76 122.15 2dfy s ALA 38 Ca -0.10 1.49 -0.08 0.00 0.00 0.00 0.00 51.96 53.27 2dfy s ALA 38 Cb -0.16 -0.39 0.04 0.00 0.00 0.00 0.00 23.12 22.61 2dfy s ALA 38 CO 0.01 -0.34 0.67 -1.33 0.00 0.00 0.00 175.76 174.77 2dfy n MET 39 N 1.07 -4.81 -1.05 0.00 2.81 -1.26 -1.12 117.12 112.76 2dfy n MET 39 Ca -0.16 0.73 -0.02 0.00 -1.81 0.00 0.00 57.70 56.45 2dfy n MET 39 Cb 0.57 -5.57 -0.01 0.00 -0.71 0.00 0.00 33.22 27.50 2dfy n MET 39 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2dfy n ASP 40 N -2.54 -4.29 -4.29 7.83 8.00 -1.26 -4.98 116.55 115.01 2dfy n ASP 40 Ca -0.05 0.04 -0.16 0.00 0.71 0.00 0.00 54.79 55.33 2dfy n ASP 40 Cb 0.58 -1.95 -0.10 0.00 -0.02 0.00 0.00 41.12 39.63 2dfy n ASP 40 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2dfy s SER 41 N -2.17 1.98 0.11 -2.24 0.01 -0.27 -5.16 113.70 105.96 2dfy s SER 41 Ca 0.00 -1.07 -0.00 0.00 1.31 0.00 0.00 55.95 56.19 2dfy s SER 41 Cb 0.00 -0.03 -0.04 0.00 0.21 0.00 0.00 66.02 66.16 2dfy s SER 41 CO 0.00 -0.35 0.27 -0.31 0.41 0.00 0.00 173.24 173.26 2dfy s TYR 42 N -3.28 3.50 -0.04 2.43 1.51 -1.26 -0.85 117.35 119.36 2dfy s TYR 42 Ca 0.21 0.27 -0.06 0.00 -1.01 0.00 0.00 57.07 56.48 2dfy s TYR 42 Cb 0.03 -1.78 0.01 0.00 -0.11 0.00 0.00 41.96 40.11 2dfy s TYR 42 CO 0.04 0.52 0.14 -1.58 -1.11 0.00 0.00 175.55 173.57 2dfy s TRP 43 N -1.64 -0.10 0.36 2.71 0.52 -0.30 -1.40 118.94 119.10 2dfy s TRP 43 Ca 0.36 0.24 -0.28 0.00 0.02 0.00 0.00 56.10 56.44 2dfy s TRP 43 Cb -0.12 0.02 -0.11 0.00 -1.15 0.00 0.00 33.47 32.11 2dfy s TRP 43 CO 0.28 -0.14 1.43 -1.01 0.02 0.00 0.00 176.95 177.53 2dfy s HIS 44 N -0.35 2.72 0.27 -1.98 3.76 -1.26 -1.57 115.29 116.88 2dfy s HIS 44 Ca -0.04 1.24 -0.01 0.00 -0.15 0.00 0.00 55.06 56.10 2dfy s HIS 44 Cb -0.03 -3.92 0.47 0.00 1.11 0.00 0.00 32.58 30.21 2dfy s HIS 44 CO 0.01 -2.66 1.86 1.03 -0.85 0.00 0.00 174.74 174.13 2dfy h SER 45 N 3.12 0.98 0.35 1.40 0.87 -1.91 -1.50 113.55 116.85 2dfy h SER 45 Ca -0.50 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2dfy h SER 45 Cb 1.24 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 63.02 2dfy h SER 45 CO 0.65 0.57 0.00 0.08 -0.53 0.00 0.00 176.83 177.60 2dfy h ARG 46 N 1.08 0.00 0.00 2.24 0.11 -1.98 -2.45 114.38 113.38 2dfy h ARG 46 Ca 0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.54 2dfy h ARG 46 Cb 0.32 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.40 2dfy h ARG 46 CO -0.22 0.00 -0.72 0.00 0.10 0.00 0.00 179.97 179.13 2dfy s LEU 48 N -3.34 6.16 0.07 0.00 2.96 -0.92 -4.63 118.68 118.98 2dfy s LEU 48 Ca 0.08 -2.06 0.06 0.00 -0.22 0.00 0.00 54.13 51.99 2dfy s LEU 48 Cb 0.16 -2.15 -0.03 0.00 0.50 0.00 0.00 46.19 44.67 2dfy s LEU 48 CO 0.75 -0.74 -0.16 -0.54 -1.32 0.00 0.00 176.35 174.34 2dfy s LYS 49 N 1.16 0.98 0.16 1.98 1.02 -1.26 -1.78 119.74 122.01 2dfy s LYS 49 Ca 0.07 -0.95 -0.31 0.00 0.02 0.00 0.00 55.97 54.80 2dfy s LYS 49 Cb -0.24 -1.06 -0.10 0.00 -0.52 0.00 0.00 37.83 35.91 2dfy s LYS 49 CO -0.01 0.25 1.54 0.00 -0.92 0.00 0.00 175.35 176.21 2dfy h SER 51 N 6.69 0.46 0.00 0.00 0.02 -0.56 0.04 113.55 120.20 2dfy h SER 51 Ca -0.43 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 60.43 2dfy h SER 51 Cb 1.21 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.63 2dfy h SER 51 CO 0.90 0.32 -0.49 -1.28 -1.14 0.00 0.00 176.83 175.14 2dfy h SER 52 N 0.53 0.00 -0.01 3.07 0.87 -1.91 -3.41 113.55 112.69 2dfy h SER 52 Ca 0.18 -0.74 0.00 0.00 -1.23 0.00 0.00 61.79 60.00 2dfy h SER 52 Cb 0.07 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.03 2dfy h SER 52 CO -0.04 1.16 -0.24 0.00 -0.53 0.00 0.00 176.83 177.17 2dfy n GLN 54 N -0.38 -1.01 -1.91 0.00 1.13 -0.00 -4.95 117.38 110.27 2dfy n GLN 54 Ca 0.04 0.54 -0.38 0.00 -1.94 0.00 0.00 57.00 55.26 2dfy n GLN 54 Cb 0.20 -4.45 0.03 0.00 0.11 0.00 0.00 30.24 26.13 2dfy n GLN 54 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2dfy s ALA 55 N -1.84 2.84 -0.75 -1.58 0.00 -1.26 -4.46 121.76 114.70 2dfy s ALA 55 Ca 0.00 1.22 -0.26 0.00 0.00 0.00 0.00 51.96 52.92 2dfy s ALA 55 Cb 0.00 -3.52 0.04 0.00 0.00 0.00 0.00 23.12 19.64 2dfy s ALA 55 CO 0.00 -1.20 1.25 -0.65 0.00 0.00 0.00 175.76 175.16 2dfy s GLN 56 N -2.88 3.21 0.30 0.00 -0.21 -1.26 -1.01 119.66 117.81 2dfy s GLN 56 Ca 0.70 -0.38 0.02 0.00 0.02 0.00 0.00 55.36 55.72 2dfy s GLN 56 Cb -0.37 -4.27 0.58 0.00 1.00 0.00 0.00 33.01 29.95 2dfy s GLN 56 CO 0.44 -2.11 1.88 -0.07 -2.12 0.00 0.00 175.29 173.31 2dfy h LEU 57 N 12.80 0.88 -1.54 2.90 3.38 -1.64 -1.48 115.31 130.60 2dfy h LEU 57 Ca -0.25 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2dfy h LEU 57 Cb 1.05 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2dfy h LEU 57 CO 1.28 0.52 0.00 1.23 0.09 0.00 0.00 178.44 181.56 2dfy h GLY 58 N 0.97 0.00 0.13 0.83 0.00 -1.81 -2.95 103.07 100.24 2dfy h GLY 58 Ca 0.43 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 47.38 2dfy h GLY 58 CO -0.19 0.00 -2.36 1.22 0.00 0.00 0.00 176.54 175.22 2dfy n ASP 59 N -2.90 1.48 0.13 0.19 8.00 -0.63 -4.62 116.55 118.20 2dfy n ASP 59 Ca 0.00 -0.03 -0.01 0.00 0.71 0.00 0.00 54.79 55.46 2dfy n ASP 59 Cb 0.25 -0.12 0.13 0.00 -0.02 0.00 0.00 41.12 41.35 2dfy n ASP 59 CO 0.00 0.00 0.00 0.16 -0.39 0.00 0.00 177.20 176.97 2dfy h ILE 60 N 0.01 1.31 -1.54 0.53 3.07 -1.33 -3.48 117.51 116.09 2dfy h ILE 60 Ca -0.54 -2.30 0.00 0.00 1.55 0.00 0.00 64.86 63.58 2dfy h ILE 60 Cb 2.01 2.29 0.00 0.00 -0.27 0.00 0.00 36.82 40.84 2dfy h ILE 60 CO -0.03 0.62 0.00 0.61 -1.05 0.00 0.00 178.15 178.31 2dfy n GLY 61 N 0.60 2.27 0.53 0.16 0.00 -1.12 -5.07 105.19 102.57 2dfy n GLY 61 Ca -0.00 -0.90 0.06 0.00 0.00 0.00 0.00 46.02 45.18 2dfy n GLY 61 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dfy n THR 62 N 0.00 0.31 -3.80 2.61 -2.24 -1.26 -4.58 114.28 105.32 2dfy n THR 62 Ca 0.00 -0.65 -0.10 0.00 -2.27 0.00 0.00 64.05 61.03 2dfy n THR 62 Cb 0.00 1.01 -0.05 0.00 -2.10 0.00 0.00 70.33 69.20 2dfy n THR 62 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2dfy s SER 63 N -0.98 -0.18 0.39 3.42 1.04 -1.26 -1.30 113.70 114.82 2dfy s SER 63 Ca 0.17 -0.59 0.08 0.00 0.48 0.00 0.00 55.95 56.09 2dfy s SER 63 Cb 0.11 0.54 -0.07 0.00 0.10 0.00 0.00 66.02 66.70 2dfy s SER 63 CO 0.15 -1.02 0.00 -0.94 0.98 0.00 0.00 173.24 172.42 2dfy s SER 64 N -2.90 3.94 -0.05 7.02 1.04 -0.23 -4.67 113.70 117.86 2dfy s SER 64 Ca 0.11 -1.26 0.04 0.00 0.48 0.00 0.00 55.95 55.33 2dfy s SER 64 Cb 0.00 -0.41 -0.00 0.00 0.10 0.00 0.00 66.02 65.71 2dfy s SER 64 CO -0.02 -0.38 -0.17 -0.31 0.98 0.00 0.00 173.24 173.35 2dfy s TYR 65 N -2.65 1.68 -0.16 5.02 1.51 -0.01 -0.32 117.35 122.41 2dfy s TYR 65 Ca 0.35 -0.50 -0.03 0.00 -1.01 0.00 0.00 57.07 55.88 2dfy s TYR 65 Cb 0.06 -1.14 -0.02 0.00 -0.11 0.00 0.00 41.96 40.75 2dfy s TYR 65 CO 0.18 -0.18 -0.06 0.95 -1.11 0.00 0.00 175.55 175.33 2dfy s THR 66 N 0.11 3.55 -0.29 -0.71 -4.23 -0.11 -0.59 115.64 113.38 2dfy s THR 66 Ca -0.05 -0.47 -0.21 0.00 -1.18 0.00 0.00 61.69 59.78 2dfy s THR 66 Cb -0.12 -2.56 0.13 0.00 1.34 0.00 0.00 72.50 71.30 2dfy s THR 66 CO 0.02 0.48 0.99 -0.75 -0.54 0.00 0.00 174.62 174.83 2dfy s LYS 67 N 0.62 0.46 -1.50 3.99 2.20 -0.98 -4.76 119.74 119.76 2dfy s LYS 67 Ca -0.04 0.65 -0.05 0.00 -0.36 0.00 0.00 55.97 56.17 2dfy s LYS 67 Cb -0.15 0.16 0.02 0.00 -1.51 0.00 0.00 37.83 36.36 2dfy s LYS 67 CO 0.03 -0.07 0.56 0.43 -0.36 0.00 0.00 175.35 175.94 2dfy n SER 68 N 2.97 -5.62 0.00 1.43 7.64 -1.26 -1.22 113.62 117.56 2dfy n SER 68 Ca -0.15 -0.29 0.00 0.00 1.01 0.00 0.00 58.87 59.43 2dfy n SER 68 Cb 0.57 -4.56 0.00 0.00 -1.01 0.00 0.00 64.21 59.21 2dfy n SER 68 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dfy n GLY 69 N -1.44 1.12 3.81 0.23 0.00 -1.26 -5.03 105.19 102.62 2dfy n GLY 69 Ca -0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.67 2dfy n GLY 69 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dfy s MET 70 N -0.22 2.92 -0.19 1.61 -1.94 -0.36 -5.11 119.30 116.02 2dfy s MET 70 Ca 0.00 -0.90 0.01 0.00 -1.71 0.00 0.00 55.69 53.10 2dfy s MET 70 Cb 0.00 -2.64 0.03 0.00 2.01 0.00 0.00 34.83 34.23 2dfy s MET 70 CO 0.00 0.47 -0.18 0.42 -0.01 0.00 0.00 175.02 175.71 2dfy s ILE 71 N -1.83 2.06 0.09 2.53 1.01 -1.26 -2.31 121.20 121.49 2dfy s ILE 71 Ca 0.31 -1.04 0.09 0.00 0.00 0.00 0.00 60.65 60.01 2dfy s ILE 71 Cb -0.10 -1.91 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 2dfy s ILE 71 CO 0.24 0.45 -0.24 -0.76 0.00 0.00 0.00 174.94 174.63 2dfy s LEU 72 N 1.27 2.25 0.87 2.97 1.43 0.24 0.26 118.68 127.98 2dfy s LEU 72 Ca 0.03 -0.65 -0.11 0.00 -1.03 0.00 0.00 54.13 52.37 2dfy s LEU 72 Cb -0.14 -1.08 0.11 0.00 0.03 0.00 0.00 46.19 45.11 2dfy s LEU 72 CO -0.12 0.16 1.09 0.00 0.23 0.00 0.00 176.35 177.71 2dfy h ARG 74 N -1.50 1.22 -0.59 0.00 2.43 -1.95 -0.32 114.38 113.67 2dfy h ARG 74 Ca -0.47 -0.12 -0.04 0.00 -0.81 0.00 0.00 59.98 58.54 2dfy h ARG 74 Cb 1.27 -0.25 -0.03 0.00 -0.42 0.00 0.00 29.97 30.54 2dfy h ARG 74 CO 0.52 0.86 0.23 -0.91 -1.51 0.00 0.00 179.97 179.16 2dfy h ASN 75 N 1.23 0.82 0.92 -3.80 2.35 -1.99 -0.13 115.58 114.98 2dfy h ASN 75 Ca 0.32 -0.17 -0.13 0.00 -0.55 0.00 0.00 56.30 55.76 2dfy h ASN 75 Cb -0.04 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.10 2dfy h ASN 75 CO -0.06 0.77 -0.63 0.44 -1.65 0.00 0.00 177.43 176.30 2dfy h ASP 76 N 0.82 0.00 -0.08 5.81 3.32 -1.87 -1.41 116.42 123.01 2dfy h ASP 76 Ca 0.20 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 2dfy h ASP 76 Cb 0.21 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 2dfy h ASP 76 CO -0.02 0.63 0.03 0.22 -1.72 0.00 0.00 179.24 178.39 2dfy h TYR 77 N 0.00 0.12 -0.35 4.55 3.20 -0.61 -0.66 116.97 123.22 2dfy h TYR 77 Ca -0.01 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.88 2dfy h TYR 77 Cb 1.26 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 39.47 2dfy h TYR 77 CO 0.00 0.23 0.17 0.82 -1.64 0.00 0.00 178.16 177.74 2dfy h ILE 78 N -0.02 0.98 -0.43 1.81 2.04 -0.95 -0.02 117.51 120.91 2dfy h ILE 78 Ca 0.03 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 2dfy h ILE 78 Cb 0.16 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 2dfy h ILE 78 CO -0.00 0.07 0.18 -0.09 0.00 0.00 0.00 178.15 178.30 2dfy h ARG 79 N 0.36 0.64 0.00 2.37 2.43 -1.13 0.66 114.38 119.71 2dfy h ARG 79 Ca 0.15 -0.11 -0.23 0.00 -0.81 0.00 0.00 59.98 58.98 2dfy h ARG 79 Cb 0.06 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.47 2dfy h ARG 79 CO -0.11 0.58 -1.21 -0.07 -1.51 0.00 0.00 179.97 177.65 2dfy h LEU 80 N 0.55 0.00 -0.14 3.80 3.38 -1.00 -3.40 115.31 118.51 2dfy h LEU 80 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2dfy h LEU 80 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2dfy h LEU 80 CO -0.01 0.94 0.00 0.49 0.09 0.00 0.00 178.44 179.94 2dfy n PHE 81 N -3.21 0.00 -1.32 1.13 3.72 -0.03 -5.07 117.46 112.67 2dfy n PHE 81 Ca -0.06 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.03 2dfy n PHE 81 Cb 0.95 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 39.58 2dfy n PHE 81 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2dfy s GLY 82 N -0.46 1.67 -0.60 1.37 0.00 0.23 -4.95 107.32 104.58 2dfy s GLY 82 Ca 0.00 0.20 -0.28 0.00 0.00 0.00 0.00 44.72 44.64 2dfy s GLY 82 CO 0.00 0.55 1.26 -1.31 0.00 0.00 0.00 173.10 173.60 2dfy s ASN 83 N -3.49 6.33 0.78 1.64 0.01 -1.26 -4.81 114.94 114.13 2dfy s ASN 83 Ca 0.61 0.05 -0.12 0.00 -0.71 0.00 0.00 52.86 52.69 2dfy s ASN 83 Cb -0.17 -2.55 0.06 0.00 0.41 0.00 0.00 41.25 39.00 2dfy s ASN 83 CO 0.56 -1.59 1.10 -0.94 -1.51 0.00 0.00 177.10 174.72 2dfy s SER 84 N 3.41 4.73 0.00 -1.22 1.04 -1.26 -3.29 113.70 117.12 2dfy s SER 84 Ca 0.44 1.20 0.00 0.00 0.48 0.00 0.00 55.95 58.07 2dfy s SER 84 Cb -0.08 -1.93 0.00 0.00 0.10 0.00 0.00 66.02 64.11 2dfy s SER 84 CO 0.24 -1.80 0.00 0.61 0.98 0.00 0.00 173.24 173.26 2dfy n GLY 85 N -2.46 5.54 3.14 7.32 0.00 -0.48 -4.93 105.19 113.33 2dfy n GLY 85 Ca 0.07 -1.65 -0.13 0.00 0.00 0.00 0.00 46.02 44.32 2dfy n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dfy s ALA 86 N -2.00 -0.60 -0.11 4.61 0.00 -1.26 -0.16 121.76 122.24 2dfy s ALA 86 Ca 0.00 0.57 -0.30 0.00 0.00 0.00 0.00 51.96 52.23 2dfy s ALA 86 Cb 0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 2dfy s ALA 86 CO 0.00 -0.14 1.05 0.00 0.00 0.00 0.00 175.76 176.67 2dfy h SER 88 N 7.22 0.00 0.07 0.00 0.02 -1.45 0.20 113.55 119.60 2dfy h SER 88 Ca -0.30 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2dfy h SER 88 Cb 1.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.68 2dfy h SER 88 CO 0.87 0.18 -0.03 0.00 -1.14 0.00 0.00 176.83 176.71 2dfy h ALA 89 N 1.82 -0.09 -0.00 3.77 0.00 -1.91 -3.40 119.26 119.44 2dfy h ALA 89 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2dfy h ALA 89 Cb 0.44 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2dfy h ALA 89 CO 0.02 -0.11 -0.84 0.00 0.00 0.00 0.00 179.25 178.33 2dfy n GLY 91 N 1.43 1.99 3.83 0.00 0.00 0.69 -5.00 105.19 108.13 2dfy n GLY 91 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 2dfy n GLY 91 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dfy s GLN 92 N -0.17 4.15 0.70 1.61 -1.52 -1.26 -4.58 119.66 118.59 2dfy s GLN 92 Ca 0.00 0.75 -0.17 0.00 -1.95 0.00 0.00 55.36 53.99 2dfy s GLN 92 Cb 0.00 -2.82 0.02 0.00 -0.22 0.00 0.00 33.01 29.98 2dfy s GLN 92 CO 0.00 0.38 1.26 -1.13 -0.25 0.00 0.00 175.29 175.55 2dfy n SER 93 N 0.57 1.75 -4.21 5.90 3.41 -1.26 -1.24 113.62 118.53 2dfy n SER 93 Ca -0.02 0.75 -0.32 0.00 -0.26 0.00 0.00 58.87 59.03 2dfy n SER 93 Cb 0.52 -1.54 -0.17 0.00 -0.26 0.00 0.00 64.21 62.75 2dfy n SER 93 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2dfy s ILE 94 N -1.61 2.00 0.57 -1.33 1.01 0.78 -4.77 121.20 117.84 2dfy s ILE 94 Ca 0.80 -0.99 -0.18 0.00 0.00 0.00 0.00 60.65 60.28 2dfy s ILE 94 Cb -0.35 -1.73 -0.05 0.00 0.01 0.00 0.00 42.46 40.34 2dfy s ILE 94 CO 0.43 0.55 1.09 -2.84 0.00 0.00 0.00 174.94 174.18 2dfy s PRO 95 N 0.35 3.30 0.61 2.79 0.02 -1.26 -1.38 135.00 139.43 2dfy s PRO 95 Ca -0.18 1.44 0.29 0.00 0.02 0.00 0.00 61.00 62.56 2dfy s PRO 95 Cb -0.18 -2.01 1.54 0.00 0.02 0.00 0.00 34.50 33.86 2dfy s PRO 95 CO 0.09 -0.86 1.92 0.00 -0.33 0.00 0.00 177.00 177.82 2dfy h ALA 96 N 0.85 1.88 0.00 -1.55 0.00 -1.86 -1.60 119.26 116.97 2dfy h ALA 96 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2dfy h ALA 96 Cb 1.24 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2dfy h ALA 96 CO 0.57 -0.55 -0.27 -1.13 0.00 0.00 0.00 179.25 177.86 2dfy n SER 97 N -3.47 0.37 -4.82 0.00 3.41 -1.26 -1.60 113.62 106.25 2dfy n SER 97 Ca 0.04 0.18 -0.36 0.00 -0.26 0.00 0.00 58.87 58.47 2dfy n SER 97 Cb 0.54 -0.17 -0.06 0.00 -0.26 0.00 0.00 64.21 64.27 2dfy n SER 97 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2dfy s GLU 98 N -3.04 4.16 0.33 4.33 2.12 -0.60 -4.85 118.70 121.15 2dfy s GLU 98 Ca 0.11 0.73 -0.27 0.00 0.36 0.00 0.00 54.97 55.90 2dfy s GLU 98 Cb 0.17 -2.96 -0.09 0.00 0.26 0.00 0.00 34.13 31.51 2dfy s GLU 98 CO 0.63 0.46 1.06 -0.51 -0.54 0.00 0.00 175.26 176.36 2dfy s LEU 99 N -1.82 4.37 0.07 2.70 1.43 -1.26 -1.60 118.68 122.56 2dfy s LEU 99 Ca 0.39 2.13 0.02 0.00 -1.03 0.00 0.00 54.13 55.64 2dfy s LEU 99 Cb -0.17 -3.89 -0.03 0.00 0.03 0.00 0.00 46.19 42.13 2dfy s LEU 99 CO 0.20 -0.28 -0.08 0.68 0.23 0.00 0.00 176.35 177.11 2dfy s VAL 100 N -1.40 0.66 0.18 -1.59 -7.23 0.12 -4.46 120.40 106.68 2dfy s VAL 100 Ca 0.50 -1.46 -0.07 0.00 -1.81 0.00 0.00 61.98 59.14 2dfy s VAL 100 Cb -0.27 -1.10 -0.06 0.00 0.56 0.00 0.00 36.38 35.51 2dfy s VAL 100 CO 0.34 -0.58 0.45 -0.04 -0.31 0.00 0.00 175.10 174.96 2dfy s MET 101 N -2.54 3.69 -0.02 4.82 -1.94 -0.47 -2.01 119.30 120.82 2dfy s MET 101 Ca -0.00 0.06 0.06 0.00 -1.71 0.00 0.00 55.69 54.10 2dfy s MET 101 Cb -0.04 -2.76 -0.02 0.00 2.01 0.00 0.00 34.83 34.03 2dfy s MET 101 CO -0.01 0.40 -0.21 1.03 -0.01 0.00 0.00 175.02 176.21 2dfy s ARG 102 N -2.74 1.79 -0.22 2.03 0.52 -1.26 -0.23 118.95 118.84 2dfy s ARG 102 Ca 0.44 -0.76 -0.14 0.00 -0.52 0.00 0.00 55.73 54.74 2dfy s ARG 102 Cb -0.12 -1.70 0.07 0.00 0.52 0.00 0.00 34.95 33.72 2dfy s ARG 102 CO 0.23 0.44 0.55 0.00 0.02 0.00 0.00 175.30 176.54 2dfy s ALA 103 N -0.45 -1.43 -1.67 2.13 0.00 -0.83 -4.79 121.76 114.72 2dfy s ALA 103 Ca 0.07 1.86 -0.18 0.00 0.00 0.00 0.00 51.96 53.71 2dfy s ALA 103 Cb -0.09 -1.10 0.15 0.00 0.00 0.00 0.00 23.12 22.08 2dfy s ALA 103 CO -0.00 -0.31 0.80 1.04 0.00 0.00 0.00 175.76 177.29 2dfy n GLN 104 N 3.92 -3.38 -1.00 0.00 1.13 -1.26 -0.22 117.38 116.58 2dfy n GLN 104 Ca -0.20 0.39 -0.00 0.00 -1.94 0.00 0.00 57.00 55.25 2dfy n GLN 104 Cb 0.57 -5.15 -0.00 0.00 0.11 0.00 0.00 30.24 25.77 2dfy n GLN 104 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2dfy n GLY 105 N -1.40 0.44 3.86 1.08 0.00 -1.26 -5.03 105.19 102.88 2dfy n GLY 105 Ca 0.08 -0.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 2dfy n GLY 105 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dfy s ASN 106 N -2.03 5.44 0.08 1.61 0.02 0.70 -5.14 114.94 115.63 2dfy s ASN 106 Ca 0.00 -0.38 0.09 0.00 -1.02 0.00 0.00 52.86 51.55 2dfy s ASN 106 Cb 0.00 -1.16 -0.03 0.00 0.02 0.00 0.00 41.25 40.08 2dfy s ASN 106 CO 0.00 -0.25 -0.23 0.68 0.02 0.00 0.00 177.10 177.32 2dfy s VAL 107 N -2.23 1.84 0.02 1.60 -7.23 -1.26 -1.96 120.40 111.18 2dfy s VAL 107 Ca 0.38 -1.45 0.01 0.00 -1.81 0.00 0.00 61.98 59.11 2dfy s VAL 107 Cb -0.07 -1.63 -0.01 0.00 0.56 0.00 0.00 36.38 35.23 2dfy s VAL 107 CO 0.26 0.10 -0.05 -0.31 -0.31 0.00 0.00 175.10 174.79 2dfy s TYR 108 N -0.99 0.46 0.51 2.82 1.51 0.68 -1.07 117.35 121.26 2dfy s TYR 108 Ca 0.09 -0.31 -0.23 0.00 -1.01 0.00 0.00 57.07 55.60 2dfy s TYR 108 Cb -0.10 -0.29 -0.07 0.00 -0.11 0.00 0.00 41.96 41.40 2dfy s TYR 108 CO 0.04 -0.07 1.31 0.72 -1.11 0.00 0.00 175.55 176.44 2dfy n HIS 109 N 2.15 2.18 -0.30 2.71 8.25 -1.26 -1.37 115.22 127.58 2dfy n HIS 109 Ca -0.19 0.45 0.05 0.00 -0.26 0.00 0.00 57.72 57.78 2dfy n HIS 109 Cb 0.56 -2.36 0.20 0.00 1.12 0.00 0.00 29.99 29.52 2dfy n HIS 109 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2dfy h LEU 110 N 1.62 0.61 -0.03 2.41 4.07 -1.94 0.48 115.31 122.53 2dfy h LEU 110 Ca -0.50 0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.53 2dfy h LEU 110 Cb 1.30 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 43.00 2dfy h LEU 110 CO 0.58 0.31 -0.01 0.29 -1.08 0.00 0.00 178.44 178.52 2dfy n LYS 111 N -4.80 0.59 0.00 1.13 5.02 -1.26 -2.48 118.16 116.36 2dfy n LYS 111 Ca 0.16 -0.03 0.11 0.00 -2.02 0.00 0.00 58.31 56.53 2dfy n LYS 111 Cb 0.36 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.92 2dfy n LYS 111 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dfy n PHE 113 N -1.45 4.23 -4.42 0.00 7.35 -0.97 -4.92 117.46 117.28 2dfy n PHE 113 Ca 0.05 -3.09 -0.21 0.00 -0.76 0.00 0.00 57.45 53.44 2dfy n PHE 113 Cb 0.34 -2.22 -0.10 0.00 0.35 0.00 0.00 39.48 37.84 2dfy n PHE 113 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2dfy s THR 114 N 1.77 2.07 0.02 -2.13 -4.23 -1.26 -1.12 115.64 110.75 2dfy s THR 114 Ca 0.44 -2.28 -0.30 0.00 -1.18 0.00 0.00 61.69 58.36 2dfy s THR 114 Cb 0.03 -2.23 -0.06 0.00 1.34 0.00 0.00 72.50 71.59 2dfy s THR 114 CO 0.01 -0.46 1.34 0.00 -0.54 0.00 0.00 174.62 174.97 2dfy h SER 116 N 7.49 0.00 0.00 0.00 0.02 0.14 -0.05 113.55 121.15 2dfy h SER 116 Ca -0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2dfy h SER 116 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2dfy h SER 116 CO 0.88 0.09 -0.36 0.74 -1.14 0.00 0.00 176.83 177.04 2dfy h THR 117 N 0.00 0.00 0.00 -2.27 2.02 -1.92 -3.43 112.91 107.31 2dfy h THR 117 Ca -0.00 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 66.44 2dfy h THR 117 Cb 0.27 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.68 2dfy h THR 117 CO 0.01 0.00 -0.99 0.00 0.37 0.00 0.00 175.52 174.91 2dfy n ARG 119 N -2.06 0.00 -1.74 0.00 1.74 -0.03 -4.99 116.66 109.59 2dfy n ARG 119 Ca 0.02 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.68 2dfy n ARG 119 Cb 0.45 -2.52 -0.00 0.00 -1.02 0.00 0.00 32.46 29.37 2dfy n ARG 119 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2dfy n ASN 120 N 0.00 3.27 -4.70 0.55 4.13 -1.26 -4.48 115.26 112.78 2dfy n ASN 120 Ca 0.00 1.21 -0.42 0.00 1.68 0.00 0.00 54.58 57.05 2dfy n ASN 120 Cb 0.00 -1.56 -0.03 0.00 -1.54 0.00 0.00 39.78 36.66 2dfy n ASN 120 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 2dfy s ARG 121 N -2.03 4.40 0.15 3.52 3.52 -1.26 -0.56 118.95 126.69 2dfy s ARG 121 Ca 0.55 1.68 -0.22 0.00 -0.13 0.00 0.00 55.73 57.61 2dfy s ARG 121 Cb -0.52 -3.48 -0.08 0.00 -1.56 0.00 0.00 34.95 29.32 2dfy s ARG 121 CO 0.63 -0.35 0.69 -0.51 -0.81 0.00 0.00 175.30 174.95 2dfy s LEU 122 N 1.71 4.50 0.11 -0.88 1.43 -0.27 -4.97 118.68 120.31 2dfy s LEU 122 Ca 0.56 1.45 0.02 0.00 -1.03 0.00 0.00 54.13 55.14 2dfy s LEU 122 Cb -0.26 -3.24 -0.04 0.00 0.03 0.00 0.00 46.19 42.67 2dfy s LEU 122 CO 0.25 0.18 -0.07 0.68 0.23 0.00 0.00 176.35 177.63 2dfy s VAL 123 N -1.24 0.76 0.22 -1.59 -7.23 -1.26 -4.92 120.40 105.15 2dfy s VAL 123 Ca 0.35 -1.96 -0.30 0.00 -1.81 0.00 0.00 61.98 58.26 2dfy s VAL 123 Cb -0.20 -1.74 -0.15 0.00 0.56 0.00 0.00 36.38 34.85 2dfy s VAL 123 CO 0.22 -0.83 1.02 -2.65 -0.31 0.00 0.00 175.10 172.56 2dfy n PRO 124 N -0.08 1.09 0.00 4.82 -0.02 -1.26 -1.41 135.00 138.14 2dfy n PRO 124 Ca -0.11 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2dfy n PRO 124 Cb 0.61 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 2dfy n PRO 124 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dfy n GLY 125 N 1.67 3.15 3.74 -1.23 0.00 -0.22 -4.94 105.19 107.35 2dfy n GLY 125 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 2dfy n GLY 125 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dfy n ASP 126 N 0.12 2.91 -4.78 1.61 8.00 -0.50 -4.65 116.55 119.25 2dfy n ASP 126 Ca 0.00 1.08 -0.39 0.00 0.71 0.00 0.00 54.79 56.19 2dfy n ASP 126 Cb 0.00 -1.56 -0.06 0.00 -0.02 0.00 0.00 41.12 39.48 2dfy n ASP 126 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2dfy s ARG 127 N -2.45 4.46 0.24 -1.24 0.52 -1.26 -0.65 118.95 118.58 2dfy s ARG 127 Ca 0.63 1.04 -0.11 0.00 -0.52 0.00 0.00 55.73 56.76 2dfy s ARG 127 Cb -0.46 -3.26 -0.01 0.00 0.52 0.00 0.00 34.95 31.74 2dfy s ARG 127 CO 0.56 0.57 0.44 -0.59 0.02 0.00 0.00 175.30 176.29 2dfy s PHE 128 N -1.05 0.46 0.10 -0.53 -0.71 0.12 -2.27 117.98 114.10 2dfy s PHE 128 Ca 0.34 -0.80 0.09 0.00 -1.04 0.00 0.00 56.93 55.52 2dfy s PHE 128 Cb -0.22 0.10 -0.04 0.00 -1.21 0.00 0.00 43.02 41.65 2dfy s PHE 128 CO 0.24 -0.95 -0.23 -1.01 -1.34 0.00 0.00 175.22 171.93 2dfy s HIS 129 N -4.03 1.94 -0.08 3.49 3.76 0.49 -0.32 115.29 120.54 2dfy s HIS 129 Ca 0.24 -0.40 -0.00 0.00 -0.15 0.00 0.00 55.06 54.75 2dfy s HIS 129 Cb 0.00 -1.07 0.02 0.00 1.11 0.00 0.00 32.58 32.65 2dfy s HIS 129 CO 0.09 0.23 -0.05 -0.47 -0.85 0.00 0.00 174.74 173.69 2dfy s TYR 130 N -1.09 1.10 -0.24 1.40 6.14 -1.26 -1.31 117.35 122.09 2dfy s TYR 130 Ca 0.09 -0.44 -0.02 0.00 0.64 0.00 0.00 57.07 57.33 2dfy s TYR 130 Cb -0.10 -0.98 0.08 0.00 0.42 0.00 0.00 41.96 41.38 2dfy s TYR 130 CO 0.04 -0.37 0.07 0.42 0.64 0.00 0.00 175.55 176.35 2dfy s ILE 131 N 1.50 0.55 -1.36 3.14 1.01 -0.03 -4.43 121.20 121.58 2dfy s ILE 131 Ca -0.01 -0.84 -0.05 0.00 0.00 0.00 0.00 60.65 59.76 2dfy s ILE 131 Cb -0.13 -1.22 0.02 0.00 0.01 0.00 0.00 42.46 41.14 2dfy s ILE 131 CO -0.04 -0.42 0.88 0.59 0.00 0.00 0.00 174.94 175.95 2dfy n ASN 132 N 5.01 -2.90 0.00 3.58 3.02 -1.26 -1.44 115.26 121.27 2dfy n ASN 132 Ca -0.06 -0.74 0.00 0.00 -0.03 0.00 0.00 54.58 53.74 2dfy n ASN 132 Cb 0.45 -4.31 0.00 0.00 -0.61 0.00 0.00 39.78 35.31 2dfy n ASN 132 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dfy n GLY 133 N -1.59 1.77 3.78 7.41 0.00 -1.26 -5.02 105.19 110.27 2dfy n GLY 133 Ca -0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 2dfy n GLY 133 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dfy s SER 134 N -3.33 6.43 -0.12 1.61 0.01 -0.52 -5.02 113.70 112.76 2dfy s SER 134 Ca 0.00 0.50 -0.06 0.00 1.31 0.00 0.00 55.95 57.71 2dfy s SER 134 Cb 0.00 -2.15 -0.04 0.00 0.21 0.00 0.00 66.02 64.05 2dfy s SER 134 CO 0.00 0.22 0.09 -0.76 0.41 0.00 0.00 173.24 173.20 2dfy s LEU 135 N -0.12 4.08 -0.01 2.44 1.43 -1.26 -0.85 118.68 124.38 2dfy s LEU 135 Ca 0.15 0.32 0.02 0.00 -1.03 0.00 0.00 54.13 53.59 2dfy s LEU 135 Cb -0.13 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.11 2dfy s LEU 135 CO 0.04 0.36 -0.05 -0.36 0.23 0.00 0.00 176.35 176.57 2dfy s PHE 136 N -0.76 0.50 0.88 0.29 0.08 -0.42 0.17 117.98 118.72 2dfy s PHE 136 Ca 0.13 -0.10 -0.12 0.00 0.12 0.00 0.00 56.93 56.96 2dfy s PHE 136 Cb -0.12 -0.35 0.12 0.00 -0.57 0.00 0.00 43.02 42.10 2dfy s PHE 136 CO 0.03 -0.03 1.13 0.00 -0.10 0.00 0.00 175.22 176.24 2dfy h GLU 138 N -1.39 0.26 -0.08 0.00 4.81 -1.82 -0.34 114.58 116.03 2dfy h GLU 138 Ca -0.50 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 2dfy h GLU 138 Cb 1.32 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.64 2dfy h GLU 138 CO 0.61 0.17 0.00 0.72 -0.73 0.00 0.00 179.01 179.79 2dfy n HIS 139 N -4.44 0.08 -1.85 0.92 -0.00 -1.26 -3.83 115.22 104.85 2dfy n HIS 139 Ca 0.15 -0.04 -0.10 0.00 -0.00 0.00 0.00 57.72 57.73 2dfy n HIS 139 Cb 0.66 0.00 0.11 0.00 -0.00 0.00 0.00 29.99 30.75 2dfy n HIS 139 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 2dfy n ASP 140 N 0.86 3.42 -4.68 0.41 8.00 -0.14 -5.05 116.55 119.37 2dfy n ASP 140 Ca 0.17 -3.79 -0.51 0.00 0.71 0.00 0.00 54.79 51.37 2dfy n ASP 140 Cb 0.49 -0.43 -0.06 0.00 -0.02 0.00 0.00 41.12 41.11 2dfy n ASP 140 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2dfy n ARG 141 N -0.88 1.70 -2.09 -1.24 0.63 -1.19 -4.62 116.66 108.98 2dfy n ARG 141 Ca 0.32 0.62 -0.42 0.00 -0.92 0.00 0.00 57.85 57.45 2dfy n ARG 141 Cb 0.84 -2.37 0.00 0.00 0.45 0.00 0.00 32.46 31.38 2dfy n ARG 141 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 2dfy n PRO 142 N 5.11 3.17 -0.17 -0.14 -0.04 -1.26 -4.78 135.00 136.90 2dfy n PRO 142 Ca 0.22 -3.05 0.04 0.00 -0.04 0.00 0.00 63.50 60.67 2dfy n PRO 142 Cb 0.23 -3.18 0.32 0.00 -0.04 0.00 0.00 33.50 30.83 2dfy n PRO 142 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dfy h THR 143 N 4.13 1.11 -0.66 0.52 1.03 -1.90 0.13 112.91 117.27 2dfy h THR 143 Ca 0.48 -0.29 -0.03 0.00 -0.01 0.00 0.00 66.41 66.57 2dfy h THR 143 Cb 0.68 0.20 -0.03 0.00 -1.07 0.00 0.00 68.15 67.93 2dfy h THR 143 CO 1.72 0.15 0.30 0.00 -0.01 0.00 0.00 175.52 177.68 2dfy h ALA 144 N 1.60 0.85 -0.39 0.00 0.00 -2.00 -2.60 119.26 116.71 2dfy h ALA 144 Ca 0.27 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2dfy h ALA 144 Cb 0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2dfy h ALA 144 CO -0.07 0.44 0.05 -0.07 0.00 0.00 0.00 179.25 179.59 2dfy h LEU 145 N 0.92 0.63-10.17 0.00 3.38 -1.65 -3.56 115.31 104.86 2dfy h LEU 145 Ca 0.22 -0.27 -0.52 0.00 0.09 0.00 0.00 57.88 57.40 2dfy h LEU 145 Cb 0.15 -0.17 0.13 0.00 0.09 0.00 0.00 40.66 40.86 2dfy h LEU 145 CO -0.02 0.74 0.39 -0.63 0.09 0.00 0.00 178.44 179.01 2dfy s ILE 146 N -5.15 2.74 0.00 1.22 1.01 -0.08 -5.12 121.20 115.82 2dfy s ILE 146 Ca -0.13 0.37 0.00 0.00 0.00 0.00 0.00 60.65 60.89 2dfy s ILE 146 Cb 0.10 -2.93 0.00 0.00 0.01 0.00 0.00 42.46 39.63 2dfy s ILE 146 CO 0.78 -0.19 0.00 0.61 0.00 0.00 0.00 174.94 176.14 2dfy n GLY 298 N 0.04 2.36 0.13 6.18 0.00 -1.26 -4.89 105.19 107.74 2dfy n GLY 298 Ca 0.12 -0.19 0.12 0.00 0.00 0.00 0.00 46.02 46.07 2dfy n GLY 298 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dfy n GLY 299 N 0.00 -1.40 3.67 -0.02 0.00 -1.26 -4.52 105.19 101.66 2dfy n GLY 299 Ca 0.00 0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2dfy n GLY 299 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dfy s ASP 300 N -4.36 6.54 -0.05 1.61 1.01 -1.26 -4.97 116.67 115.19 2dfy s ASP 300 Ca 0.06 2.53 -0.30 0.00 0.71 0.00 0.00 52.55 55.55 2dfy s ASP 300 Cb 0.10 -2.54 -0.02 0.00 1.01 0.00 0.00 42.92 41.46 2dfy s ASP 300 CO 0.45 -0.97 1.03 -0.69 0.21 0.00 0.00 175.17 175.20 2dfy s VAL 301 N 3.66 4.71 0.22 -1.27 1.01 -1.26 -4.59 120.40 122.88 2dfy s VAL 301 Ca 0.80 1.97 0.10 0.00 0.00 0.00 0.00 61.98 64.85 2dfy s VAL 301 Cb -0.40 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 31.67 2dfy s VAL 301 CO 0.35 0.07 -0.14 -0.04 0.00 0.00 0.00 175.10 175.34 2dfy s MET 302 N 1.61 1.88 -0.14 2.72 -1.94 0.57 -4.92 119.30 119.08 2dfy s MET 302 Ca 0.51 -1.48 -0.03 0.00 -1.71 0.00 0.00 55.69 52.99 2dfy s MET 302 Cb -0.21 -1.99 -0.02 0.00 2.01 0.00 0.00 34.83 34.62 2dfy s MET 302 CO 0.23 0.39 -0.06 0.08 -0.01 0.00 0.00 175.02 175.64 2dfy s VAL 303 N -2.01 3.65 0.12 -6.03 1.01 -1.26 0.14 120.40 116.03 2dfy s VAL 303 Ca 0.26 -0.45 -0.31 0.00 0.00 0.00 0.00 61.98 61.49 2dfy s VAL 303 Cb -0.07 -2.58 -0.08 0.00 0.00 0.00 0.00 36.38 33.65 2dfy s VAL 303 CO 0.15 0.51 1.37 -0.69 0.00 0.00 0.00 175.10 176.43 2dfy s VAL 304 N 0.31 3.33 0.65 2.92 1.01 0.18 -4.88 120.40 123.92 2dfy s VAL 304 Ca -0.06 0.97 -0.04 0.00 0.00 0.00 0.00 61.98 62.85 2dfy s VAL 304 Cb -0.15 -3.62 0.05 0.00 0.00 0.00 0.00 36.38 32.67 2dfy s VAL 304 CO 0.04 0.08 0.93 -0.83 0.00 0.00 0.00 175.10 175.32 2dfy s GLY 305 N 1.01 1.73 0.51 4.51 0.00 -1.26 -1.06 107.32 112.76 2dfy s GLY 305 Ca 0.63 -1.05 -0.22 0.00 0.00 0.00 0.00 44.72 44.09 2dfy s GLY 305 CO 0.31 -0.69 1.23 -0.54 0.00 0.00 0.00 173.10 173.42 2dfy s GLU 306 N -5.08 3.42 0.93 2.90 0.41 -1.26 -4.31 118.70 115.71 2dfy s GLU 306 Ca 0.59 1.92 -0.10 0.00 -0.41 0.00 0.00 54.97 56.97 2dfy s GLU 306 Cb -0.11 -2.27 0.16 0.00 -1.78 0.00 0.00 34.13 30.13 2dfy s GLU 306 CO 0.43 -0.87 1.13 -2.14 -0.49 0.00 0.00 175.26 173.31 2dfy s PRO 307 N -2.89 0.88 0.07 0.39 0.02 -1.26 -4.90 135.00 127.31 2dfy s PRO 307 Ca 0.69 1.42 -0.02 0.00 0.02 0.00 0.00 61.00 63.11 2dfy s PRO 307 Cb -0.32 -1.72 -0.04 0.00 0.02 0.00 0.00 34.50 32.44 2dfy s PRO 307 CO 0.38 -2.68 0.01 0.95 -0.33 0.00 0.00 177.00 175.34 2dfy s THR 308 N -2.65 0.19 0.30 0.99 -4.23 -0.85 -4.90 115.64 104.48 2dfy s THR 308 Ca 0.66 -1.75 -0.28 0.00 -1.18 0.00 0.00 61.69 59.14 2dfy s THR 308 Cb -0.22 -1.59 -0.09 0.00 1.34 0.00 0.00 72.50 71.93 2dfy s THR 308 CO 0.59 -0.86 1.10 -0.76 -0.54 0.00 0.00 174.62 174.14 2dfy s LEU 309 N -2.94 4.48 0.14 4.79 1.43 -1.26 0.12 118.68 125.43 2dfy s LEU 309 Ca 0.10 2.24 -0.17 0.00 -1.03 0.00 0.00 54.13 55.27 2dfy s LEU 309 Cb 0.07 -3.73 -0.01 0.00 0.03 0.00 0.00 46.19 42.56 2dfy s LEU 309 CO -0.08 -0.22 1.78 -0.03 0.23 0.00 0.00 176.35 178.03 2dfy h MET 310 N 3.57 0.46 0.00 1.70 1.85 -1.26 -1.97 114.93 119.27 2dfy h MET 310 Ca -0.47 -0.04 -0.01 0.00 -0.61 0.00 0.00 59.70 58.57 2dfy h MET 310 Cb 1.21 -0.10 -0.00 0.00 0.43 0.00 0.00 31.60 33.14 2dfy h MET 310 CO 0.66 0.33 -0.07 0.78 -0.40 0.00 0.00 176.91 178.21 2dfy h GLY 311 N 0.45 0.00 0.00 1.39 0.00 -1.28 -3.46 103.07 100.17 2dfy h GLY 311 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2dfy h GLY 311 CO -0.02 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.13 2dfy n GLY 312 N -0.51 0.26 3.80 4.60 0.00 -0.74 -4.56 105.19 108.04 2dfy n GLY 312 Ca -0.01 -0.89 -0.35 0.00 0.00 0.00 0.00 46.02 44.77 2dfy n GLY 312 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dfy s GLU 313 N 0.00 4.27 0.07 1.61 2.02 -1.26 -4.98 118.70 120.43 2dfy s GLU 313 Ca 0.00 1.28 0.01 0.00 0.02 0.00 0.00 54.97 56.29 2dfy s GLU 313 Cb 0.00 -2.42 -0.04 0.00 0.10 0.00 0.00 34.13 31.78 2dfy s GLU 313 CO 0.00 -0.01 -0.06 -0.59 0.02 0.00 0.00 175.26 174.62 2dfy s PHE 314 N -1.89 0.73 0.92 1.61 -0.71 -1.26 -5.07 117.98 112.31 2dfy s PHE 314 Ca 0.58 -0.80 -0.12 0.00 -1.04 0.00 0.00 56.93 55.55 2dfy s PHE 314 Cb -0.15 -0.44 0.15 0.00 -1.21 0.00 0.00 43.02 41.36 2dfy s PHE 314 CO 0.20 -0.17 1.12 0.20 -1.34 0.00 0.00 175.22 175.22 2dfy s GLY 315 N -2.53 1.58 -0.22 1.99 0.00 -1.26 -4.99 107.32 101.89 2dfy s GLY 315 Ca 0.03 -0.42 0.14 0.00 0.00 0.00 0.00 44.72 44.48 2dfy s GLY 315 CO -0.04 0.14 1.50 2.09 0.00 0.00 0.00 173.10 176.79 2dfy n ASP 316 N -3.86 3.89 0.27 1.64 5.68 -1.26 -4.71 116.55 118.20 2dfy n ASP 316 Ca 0.06 -3.17 0.13 0.00 -0.50 0.00 0.00 54.79 51.31 2dfy n ASP 316 Cb 0.58 -0.60 0.78 0.00 -1.14 0.00 0.00 41.12 40.75 2dfy n ASP 316 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 2dfy h GLU 317 N 1.90 0.00 -0.02 0.11 9.09 -2.01 -1.71 114.58 121.94 2dfy h GLU 317 Ca 0.08 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.49 2dfy h GLU 317 Cb 1.64 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.74 2dfy h GLU 317 CO 0.34 0.08 -0.19 -0.25 0.05 0.00 0.00 179.01 179.04 2dfy n ASP 318 N -3.76 2.47 -4.74 3.06 8.00 -1.26 -4.97 116.55 115.36 2dfy n ASP 318 Ca -0.02 -1.74 -0.41 0.00 0.71 0.00 0.00 54.79 53.33 2dfy n ASP 318 Cb 0.18 0.21 -0.05 0.00 -0.02 0.00 0.00 41.12 41.44 2dfy n ASP 318 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2dfy s GLU 319 N -2.08 4.74 -0.20 -1.24 2.12 -0.65 -0.94 118.70 120.45 2dfy s GLU 319 Ca 0.22 1.50 -0.02 0.00 0.36 0.00 0.00 54.97 57.04 2dfy s GLU 319 Cb 0.18 -3.33 0.06 0.00 0.26 0.00 0.00 34.13 31.30 2dfy s GLU 319 CO 0.39 0.29 0.01 1.03 -0.54 0.00 0.00 175.26 176.45 2dfy s ARG 320 N -0.44 0.91 0.60 4.30 1.81 0.56 -4.96 118.95 121.72 2dfy s ARG 320 Ca 0.45 -0.57 -0.18 0.00 -1.72 0.00 0.00 55.73 53.72 2dfy s ARG 320 Cb -0.25 -2.23 -0.03 0.00 -0.45 0.00 0.00 34.95 31.99 2dfy s ARG 320 CO 0.31 -0.63 1.16 -0.51 -0.68 0.00 0.00 175.30 174.96 2dfy s LEU 321 N 1.74 3.61 -0.16 2.53 1.43 -1.26 -1.06 118.68 125.51 2dfy s LEU 321 Ca -0.02 2.25 -0.06 0.00 -1.03 0.00 0.00 54.13 55.27 2dfy s LEU 321 Cb -0.17 -4.58 -0.04 0.00 0.03 0.00 0.00 46.19 41.42 2dfy s LEU 321 CO -0.07 -1.54 0.05 -0.63 0.23 0.00 0.00 176.35 174.39 2dfy s ILE 322 N -1.81 4.70 -0.20 -0.59 1.01 -0.42 -4.55 121.20 119.34 2dfy s ILE 322 Ca 0.74 -0.07 -0.05 0.00 0.00 0.00 0.00 60.65 61.26 2dfy s ILE 322 Cb -0.26 -3.08 -0.02 0.00 0.01 0.00 0.00 42.46 39.10 2dfy s ILE 322 CO 0.33 0.51 0.00 -0.89 0.00 0.00 0.00 174.94 174.89 2dfy s THR 323 N -0.00 3.96 -0.19 2.92 2.01 -0.23 -4.81 115.64 119.30 2dfy s THR 323 Ca 0.05 -0.31 -0.22 0.00 0.31 0.00 0.00 61.69 61.52 2dfy s THR 323 Cb -0.12 -2.79 -0.02 0.00 0.01 0.00 0.00 72.50 69.57 2dfy s THR 323 CO 0.01 0.43 0.69 -0.13 -0.69 0.00 0.00 174.62 174.92 2dfy s ARG 324 N 1.00 4.23 0.08 4.92 0.52 -1.26 -0.74 118.95 127.69 2dfy s ARG 324 Ca 0.02 0.73 0.09 0.00 -0.52 0.00 0.00 55.73 56.05 2dfy s ARG 324 Cb -0.14 -3.58 -0.03 0.00 0.52 0.00 0.00 34.95 31.71 2dfy s ARG 324 CO 0.02 -0.27 -0.24 -0.51 0.02 0.00 0.00 175.30 174.32 2dfy s LEU 325 N 1.99 2.36 -0.14 2.53 1.43 -0.24 -5.01 118.68 121.60 2dfy s LEU 325 Ca 0.31 -0.60 -0.08 0.00 -1.03 0.00 0.00 54.13 52.73 2dfy s LEU 325 Cb -0.16 -1.34 -0.04 0.00 0.03 0.00 0.00 46.19 44.67 2dfy s LEU 325 CO 0.11 0.23 0.15 -0.70 0.23 0.00 0.00 176.35 176.36 2dfy s GLU 326 N -1.60 3.69 0.00 1.70 2.12 -1.26 -0.90 118.70 122.44 2dfy s GLU 326 Ca 0.14 -0.14 0.28 0.00 0.36 0.00 0.00 54.97 55.61 2dfy s GLU 326 Cb -0.10 -3.26 1.70 0.00 0.26 0.00 0.00 34.13 32.72 2dfy s GLU 326 CO 0.05 0.63 2.04 -1.71 -0.54 0.00 0.00 175.26 175.72