#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uaw s LYS 21 N 0.00 0.28 0.71 0.00 -2.85 -1.26 -4.47 119.74 112.16 1uaw s LYS 21 Ca 0.00 0.59 -0.11 0.00 -1.00 0.00 0.00 55.97 55.45 1uaw s LYS 21 Cb 0.00 -1.71 0.02 0.00 -2.06 0.00 0.00 37.83 34.07 1uaw s LYS 21 CO 0.00 -2.85 1.07 -1.64 0.10 0.00 0.00 175.35 172.03 1uaw s MET 22 N -4.89 2.80 -0.06 1.78 -1.94 0.70 -4.39 119.30 113.30 1uaw s MET 22 Ca 0.66 0.75 -0.14 0.00 -1.71 0.00 0.00 55.69 55.25 1uaw s MET 22 Cb -0.19 -1.99 0.03 0.00 2.01 0.00 0.00 34.83 34.68 1uaw s MET 22 CO 0.59 -1.15 0.32 0.12 -0.01 0.00 0.00 175.02 174.89 1uaw s PHE 23 N -3.15 -0.26 -0.01 -0.03 5.36 -0.93 -1.18 117.98 117.77 1uaw s PHE 23 Ca 0.58 0.53 0.04 0.00 -0.96 0.00 0.00 56.93 57.12 1uaw s PHE 23 Cb -0.13 0.11 -0.03 0.00 -0.34 0.00 0.00 43.02 42.63 1uaw s PHE 23 CO 0.54 -0.31 -0.12 0.42 -1.46 0.00 0.00 175.22 174.29 1uaw s ILE 24 N -0.72 3.22 -0.12 3.12 1.09 0.56 0.17 121.20 128.52 1uaw s ILE 24 Ca -0.08 -0.83 0.03 0.00 -1.10 0.00 0.00 60.65 58.67 1uaw s ILE 24 Cb -0.04 -2.33 0.01 0.00 -1.06 0.00 0.00 42.46 39.03 1uaw s ILE 24 CO 0.03 0.47 -0.22 -0.83 -0.10 0.00 0.00 174.94 174.29 1uaw s GLY 25 N -1.11 1.32 0.00 6.18 0.00 -0.22 -1.91 107.32 111.58 1uaw s GLY 25 Ca 0.14 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.85 1uaw s GLY 25 CO 0.04 -0.13 0.00 0.61 0.00 0.00 0.00 173.10 173.61 1uaw n GLY 26 N 3.85 0.84 3.59 0.20 0.00 -0.96 0.26 105.19 112.96 1uaw n GLY 26 Ca -0.20 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.36 1uaw n GLY 26 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1uaw n LEU 27 N 0.00 3.15 -4.11 0.99 7.94 -1.02 -4.18 117.00 119.77 1uaw n LEU 27 Ca 0.00 0.54 -0.34 0.00 -1.11 0.00 0.00 56.01 55.10 1uaw n LEU 27 Cb 0.00 -1.43 0.10 0.00 0.53 0.00 0.00 43.42 42.61 1uaw n LEU 27 CO 0.00 -0.42 -1.33 -0.24 -1.11 0.00 0.00 177.39 174.29 1uaw n SER 28 N 9.40 -2.71 -0.18 1.96 2.88 -1.26 0.92 113.62 124.63 1uaw n SER 28 Ca 0.29 -0.08 0.01 0.00 -1.33 0.00 0.00 58.87 57.77 1uaw n SER 28 Cb 0.35 -0.70 0.03 0.00 -0.75 0.00 0.00 64.21 63.14 1uaw n SER 28 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1uaw n TRP 29 N -3.93 0.09 -1.20 0.66 4.27 -1.26 -3.31 117.44 112.77 1uaw n TRP 29 Ca -0.01 -0.04 0.00 0.00 -3.89 0.00 0.00 57.50 53.56 1uaw n TRP 29 Cb 0.66 -0.02 0.00 0.00 -1.36 0.00 0.00 31.31 30.59 1uaw n TRP 29 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1uaw n GLN 30 N -0.28 0.00 -1.28 -2.67 10.64 -1.26 -4.94 117.38 117.59 1uaw n GLN 30 Ca 0.02 -0.36 -0.30 0.00 -1.83 0.00 0.00 57.00 54.53 1uaw n GLN 30 Cb 0.09 -0.40 0.11 0.00 -0.86 0.00 0.00 30.24 29.18 1uaw n GLN 30 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 1uaw s THR 31 N 0.00 3.00 0.20 -0.39 2.01 -1.22 -5.07 115.64 114.17 1uaw s THR 31 Ca 0.00 0.32 0.03 0.00 0.31 0.00 0.00 61.69 62.35 1uaw s THR 31 Cb 0.00 -2.85 -0.01 0.00 0.01 0.00 0.00 72.50 69.65 1uaw s THR 31 CO 0.00 -0.42 0.20 1.07 -0.69 0.00 0.00 174.62 174.78 1uaw n THR 32 N -3.67 0.00 0.00 -0.82 5.66 -1.26 -4.98 114.28 109.21 1uaw n THR 32 Ca 0.08 -1.29 0.00 0.00 -3.05 0.00 0.00 64.05 59.78 1uaw n THR 32 Cb 0.55 0.69 0.00 0.00 -1.55 0.00 0.00 70.33 70.01 1uaw n THR 32 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1uaw n GLN 33 N -0.36 0.00 -0.21 1.09 6.02 -1.26 -2.72 117.38 119.95 1uaw n GLN 33 Ca 0.03 0.34 -0.00 0.00 -0.01 0.00 0.00 57.00 57.36 1uaw n GLN 33 Cb 0.35 -0.84 0.07 0.00 1.02 0.00 0.00 30.24 30.84 1uaw n GLN 33 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 1uaw h GLU 34 N 0.00 0.02 -1.20 -1.09 4.81 -1.99 2.35 114.58 117.47 1uaw h GLU 34 Ca 0.00 -0.00 0.35 0.00 -0.13 0.00 0.00 59.36 59.57 1uaw h GLU 34 Cb 0.00 -0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 1uaw h GLU 34 CO 0.00 0.01 0.85 0.78 -0.73 0.00 0.00 179.01 179.93 1uaw h GLY 35 N 0.02 0.20 1.29 1.92 0.00 -1.98 1.99 103.07 106.51 1uaw h GLY 35 Ca 0.30 -0.03 -0.31 0.00 0.00 0.00 0.00 47.33 47.30 1uaw h GLY 35 CO -0.61 -0.03 -1.30 -2.00 0.00 0.00 0.00 176.54 172.60 1uaw h LEU 36 N 0.05 0.83 -2.32 3.11 5.85 0.40 -0.44 115.31 122.80 1uaw h LEU 36 Ca 0.59 -0.80 0.01 0.00 0.84 0.00 0.00 57.88 58.53 1uaw h LEU 36 Cb 2.24 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 43.00 1uaw h LEU 36 CO -0.06 1.60 0.05 0.03 -0.34 0.00 0.00 178.44 179.73 1uaw h ARG 37 N 0.23 0.00 0.00 1.25 3.08 0.59 0.63 114.38 120.16 1uaw h ARG 37 Ca -0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.85 1uaw h ARG 37 Cb 1.97 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.02 1uaw h ARG 37 CO 0.24 0.00 -0.80 0.93 -1.07 0.00 0.00 179.97 179.28 1uaw h GLU 38 N 0.00 0.00 0.15 0.04 5.08 0.16 0.17 114.58 120.19 1uaw h GLU 38 Ca 0.02 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.15 1uaw h GLU 38 Cb 0.12 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.40 1uaw h GLU 38 CO -0.00 0.00 -0.99 -0.92 -1.00 0.00 0.00 179.01 176.10 1uaw h TYR 39 N 0.00 0.70 0.00 4.33 5.03 0.19 -3.26 116.97 123.97 1uaw h TYR 39 Ca 0.00 -0.49 -0.21 0.00 2.58 0.00 0.00 58.73 60.61 1uaw h TYR 39 Cb 0.98 -0.04 -0.04 0.00 1.55 0.00 0.00 36.73 39.19 1uaw h TYR 39 CO 0.00 1.37 -1.93 1.19 -1.32 0.00 0.00 178.16 177.47 1uaw n PHE 40 N -4.01 0.00 0.37 -3.82 3.72 -0.14 -4.22 117.46 109.35 1uaw n PHE 40 Ca -0.14 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.31 1uaw n PHE 40 Cb 0.89 -0.64 0.23 0.00 -0.94 0.00 0.00 39.48 39.03 1uaw n PHE 40 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1uaw n GLY 41 N 2.03 -0.87 0.31 1.37 0.00 0.60 -0.44 105.19 108.19 1uaw n GLY 41 Ca -0.19 -0.03 -0.02 0.00 0.00 0.00 0.00 46.02 45.77 1uaw n GLY 41 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1uaw h GLN 42 N 0.00 0.86 0.00 1.61 4.15 -1.66 -3.27 115.11 116.80 1uaw h GLN 42 Ca 0.00 -0.15 0.00 0.00 0.77 0.00 0.00 58.65 59.27 1uaw h GLN 42 Cb 0.19 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.73 1uaw h GLN 42 CO 0.00 0.73 0.00 1.97 -1.93 0.00 0.00 178.83 179.60 1uaw n PHE 43 N -4.30 0.00 -3.40 3.99 1.16 -0.99 -4.95 117.46 108.96 1uaw n PHE 43 Ca 0.05 -0.03 -0.18 0.00 -1.87 0.00 0.00 57.45 55.42 1uaw n PHE 43 Cb 0.19 -0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 37.96 1uaw n PHE 43 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 1uaw s GLY 44 N -0.05 -0.03 -0.32 4.97 0.00 0.42 -4.63 107.32 107.68 1uaw s GLY 44 Ca 0.00 -0.58 -0.40 0.00 0.00 0.00 0.00 44.72 43.74 1uaw s GLY 44 CO 0.00 2.60 1.30 -1.84 0.00 0.00 0.00 173.10 175.16 1uaw n GLU 45 N 5.03 0.00 -3.17 2.90 -0.00 -1.26 -3.51 120.64 120.63 1uaw n GLU 45 Ca 0.01 0.00 -0.40 0.00 -0.00 0.00 0.00 57.16 56.77 1uaw n GLU 45 Cb 0.45 -1.34 -0.07 0.00 -0.00 0.00 0.00 31.44 30.48 1uaw n GLU 45 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1uaw s VAL 46 N 1.94 5.03 -0.26 3.84 1.01 -1.26 -2.00 120.40 128.70 1uaw s VAL 46 Ca 0.90 0.99 0.21 0.00 0.00 0.00 0.00 61.98 64.09 1uaw s VAL 46 Cb -1.28 -3.88 0.08 0.00 0.00 0.00 0.00 36.38 31.29 1uaw s VAL 46 CO 0.67 0.05 1.21 0.50 0.00 0.00 0.00 175.10 177.53 1uaw h LYS 47 N 7.97 0.00 -1.06 2.72 3.64 -1.89 -3.46 116.57 124.48 1uaw h LYS 47 Ca -0.28 0.00 0.22 0.00 -1.27 0.00 0.00 60.65 59.32 1uaw h LYS 47 Cb 1.13 0.00 -0.30 0.00 -0.41 0.00 0.00 32.23 32.65 1uaw h LYS 47 CO 0.74 0.11 0.92 -2.00 -2.27 0.00 0.00 179.45 176.95 1uaw s GLU 48 N -3.20 0.06 0.23 1.90 2.12 -1.26 -4.99 118.70 113.56 1uaw s GLU 48 Ca 0.02 0.04 -0.09 0.00 0.36 0.00 0.00 54.97 55.30 1uaw s GLU 48 Cb 0.08 0.03 -0.02 0.00 0.26 0.00 0.00 34.13 34.48 1uaw s GLU 48 CO 0.76 -0.01 0.37 0.00 -0.54 0.00 0.00 175.26 175.83 1uaw s LEU 50 N -3.07 0.38 -0.15 0.00 0.05 -0.05 -4.87 118.68 110.98 1uaw s LEU 50 Ca 0.28 0.68 -0.03 0.00 0.05 0.00 0.00 54.13 55.12 1uaw s LEU 50 Cb 0.02 1.06 -0.02 0.00 -2.05 0.00 0.00 46.19 45.19 1uaw s LEU 50 CO 0.10 -0.15 -0.06 -0.69 -0.55 0.00 0.00 176.35 174.99 1uaw s VAL 51 N 0.91 3.65 0.19 1.48 1.01 -1.26 0.33 120.40 126.71 1uaw s VAL 51 Ca -0.06 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.44 1uaw s VAL 51 Cb -0.07 -2.58 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 1uaw s VAL 51 CO -0.07 0.50 0.17 -0.32 0.00 0.00 0.00 175.10 175.39 1uaw s MET 52 N 0.33 1.19 0.00 2.72 0.00 -0.51 -5.01 119.30 118.01 1uaw s MET 52 Ca -0.06 -1.51 0.00 0.00 0.00 0.00 0.00 55.69 54.13 1uaw s MET 52 Cb -0.15 0.30 0.00 0.00 0.00 0.00 0.00 34.83 34.98 1uaw s MET 52 CO 0.04 -0.40 0.00 2.89 0.00 0.00 0.00 175.02 177.55 1uaw n ARG 53 N -0.25 2.92 0.00 4.11 1.85 -1.26 -1.90 116.66 122.14 1uaw n ARG 53 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.84 1uaw n ARG 53 Cb 0.65 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.06 1uaw n ARG 53 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1uaw n ASP 54 N -0.09 0.00 -3.45 2.89 8.00 -0.99 -4.78 116.55 118.13 1uaw n ASP 54 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1uaw n ASP 54 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1uaw n ASP 54 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1uaw n PRO 55 N 0.00 2.00 -0.00 -0.24 -0.04 -1.26 -5.00 135.00 130.45 1uaw n PRO 55 Ca 0.00 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1uaw n PRO 55 Cb 0.00 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1uaw n PRO 55 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1uaw n LEU 56 N 0.00 0.10 0.00 1.53 4.77 -1.26 -5.05 117.00 117.09 1uaw n LEU 56 Ca 0.00 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1uaw n LEU 56 Cb 0.00 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.57 1uaw n LEU 56 CO 0.00 -0.49 0.00 1.07 -1.33 0.00 0.00 177.39 176.64 1uaw n THR 57 N -2.47 0.00 -0.00 -5.08 5.66 -1.26 -4.98 114.28 106.14 1uaw n THR 57 Ca -0.01 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 1uaw n THR 57 Cb 0.02 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 68.76 1uaw n THR 57 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 1uaw h LYS 58 N 0.00 -0.04 0.00 1.09 1.79 -2.02 -3.42 116.57 113.97 1uaw h LYS 58 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1uaw h LYS 58 Cb 0.00 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 1uaw h LYS 58 CO 0.00 -0.03 0.00 2.89 -1.08 0.00 0.00 179.45 181.23 1uaw n ARG 59 N -5.19 1.49 0.00 3.15 -4.01 -1.26 -5.01 116.66 105.83 1uaw n ARG 59 Ca -0.04 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.77 1uaw n ARG 59 Cb 0.12 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.54 1uaw n ARG 59 CO 0.00 0.00 0.00 0.43 -3.04 0.00 0.00 177.63 175.02 1uaw n SER 60 N 0.00 0.00 0.00 2.89 7.64 -1.26 -4.64 113.62 118.25 1uaw n SER 60 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1uaw n SER 60 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1uaw n SER 60 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1uaw n ARG 61 N 0.00 0.00 0.00 1.43 0.63 0.26 -3.97 116.66 115.01 1uaw n ARG 61 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1uaw n ARG 61 Cb 0.00 -0.47 0.00 0.00 0.45 0.00 0.00 32.46 32.44 1uaw n ARG 61 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1uaw n GLY 62 N 1.81 -1.42 3.94 5.14 0.00 -1.20 -2.36 105.19 111.10 1uaw n GLY 62 Ca 0.00 0.50 0.03 0.00 0.00 0.00 0.00 46.02 46.55 1uaw n GLY 62 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1uaw s PHE 63 N 0.00 0.01 0.12 1.61 -0.12 -0.80 -2.27 117.98 116.54 1uaw s PHE 63 Ca 0.00 -0.09 -0.03 0.00 -0.05 0.00 0.00 56.93 56.76 1uaw s PHE 63 Cb 0.00 0.54 -0.03 0.00 -0.63 0.00 0.00 43.02 42.90 1uaw s PHE 63 CO 0.00 -0.18 0.09 0.20 -0.05 0.00 0.00 175.22 175.28 1uaw s GLY 64 N -3.73 0.79 0.09 1.99 0.00 -0.80 -1.43 107.32 104.22 1uaw s GLY 64 Ca 0.28 -1.29 0.08 0.00 0.00 0.00 0.00 44.72 43.79 1uaw s GLY 64 CO -0.02 -1.24 -0.21 -1.36 0.00 0.00 0.00 173.10 170.27 1uaw s PHE 65 N -4.01 1.84 -0.14 1.90 0.08 0.15 -0.32 117.98 117.48 1uaw s PHE 65 Ca 0.20 -0.40 -0.06 0.00 0.12 0.00 0.00 56.93 56.78 1uaw s PHE 65 Cb 0.07 -1.03 0.06 0.00 -0.57 0.00 0.00 43.02 41.54 1uaw s PHE 65 CO -0.01 0.18 0.32 0.08 -0.10 0.00 0.00 175.22 175.69 1uaw s VAL 66 N -1.04 -0.18 -0.26 -0.44 1.01 -0.33 -0.88 120.40 118.28 1uaw s VAL 66 Ca 0.07 0.16 0.16 0.00 0.00 0.00 0.00 61.98 62.37 1uaw s VAL 66 Cb -0.10 -0.49 0.65 0.00 0.00 0.00 0.00 36.38 36.44 1uaw s VAL 66 CO 0.04 0.07 1.56 0.41 0.00 0.00 0.00 175.10 177.18 1uaw n THR 67 N 4.60 2.44 -1.56 3.92 -1.04 0.55 -0.22 114.28 122.97 1uaw n THR 67 Ca -0.19 -1.64 -0.43 0.00 -2.04 0.00 0.00 64.05 59.75 1uaw n THR 67 Cb 0.53 -0.23 -0.00 0.00 -1.82 0.00 0.00 70.33 68.80 1uaw n THR 67 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 1uaw n PHE 68 N 0.04 0.82 -3.85 -1.42 1.16 -1.26 -4.28 117.46 108.67 1uaw n PHE 68 Ca 0.24 0.64 -0.21 0.00 -1.87 0.00 0.00 57.45 56.26 1uaw n PHE 68 Cb 1.01 -2.18 -0.17 0.00 -1.61 0.00 0.00 39.48 36.53 1uaw n PHE 68 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 1uaw s MET 69 N -1.70 0.47 0.00 3.97 1.75 -0.85 -4.81 119.30 118.14 1uaw s MET 69 Ca 0.61 0.11 0.00 0.00 -1.25 0.00 0.00 55.69 55.16 1uaw s MET 69 Cb -0.64 -0.77 0.00 0.00 2.84 0.00 0.00 34.83 36.26 1uaw s MET 69 CO 0.58 -0.23 0.00 -3.47 -0.65 0.00 0.00 175.02 171.25 1uaw n ASP 70 N 4.75 0.00 0.00 1.11 2.03 -1.26 -4.53 116.55 118.66 1uaw n ASP 70 Ca -0.14 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.17 1uaw n ASP 70 Cb 0.50 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.90 1uaw n ASP 70 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1uaw n GLN 71 N 0.00 0.00 -0.38 -0.67 3.00 -1.26 -4.19 117.38 113.88 1uaw n GLN 71 Ca 0.00 0.37 0.00 0.00 -0.01 0.00 0.00 57.00 57.36 1uaw n GLN 71 Cb 0.00 -0.86 0.14 0.00 0.00 0.00 0.00 30.24 29.52 1uaw n GLN 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1uaw n ALA 72 N -1.67 3.18 -0.16 -1.58 0.00 -1.26 -4.54 120.51 114.48 1uaw n ALA 72 Ca 0.00 -0.83 -0.08 0.00 0.00 0.00 0.00 53.44 52.53 1uaw n ALA 72 Cb 0.00 -1.08 -0.06 0.00 0.00 0.00 0.00 19.45 18.31 1uaw n ALA 72 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1uaw h GLY 73 N 4.27 -1.44 1.23 0.00 0.00 -1.82 1.30 103.07 106.61 1uaw h GLY 73 Ca 0.05 0.84 0.06 0.00 0.00 0.00 0.00 47.33 48.28 1uaw h GLY 73 CO 0.24 -0.36 0.32 -2.08 0.00 0.00 0.00 176.54 174.67 1uaw h VAL 74 N -0.15 0.27 0.00 4.60 2.07 -1.90 -0.55 116.25 120.59 1uaw h VAL 74 Ca 0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.59 1uaw h VAL 74 Cb 0.33 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1uaw h VAL 74 CO -0.46 0.00 0.00 0.47 0.02 0.00 0.00 177.57 177.60 1uaw n ASP 75 N -3.47 0.00 -0.26 0.57 8.00 0.42 -2.11 116.55 119.71 1uaw n ASP 75 Ca 0.03 0.46 0.06 0.00 0.71 0.00 0.00 54.79 56.05 1uaw n ASP 75 Cb 0.44 -0.34 0.18 0.00 -0.02 0.00 0.00 41.12 41.38 1uaw n ASP 75 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1uaw h LYS 76 N 0.00 0.18 -0.16 -1.24 1.79 -0.80 0.14 116.57 116.47 1uaw h LYS 76 Ca 0.00 -0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.51 1uaw h LYS 76 Cb 0.00 -0.04 -0.06 0.00 -1.58 0.00 0.00 32.23 30.55 1uaw h LYS 76 CO 0.00 0.12 -0.23 0.28 -1.08 0.00 0.00 179.45 178.53 1uaw h VAL 77 N 0.18 0.43 -0.94 0.50 2.07 -1.24 -1.30 116.25 115.95 1uaw h VAL 77 Ca 0.43 0.00 0.17 0.00 0.82 0.00 0.00 66.70 68.12 1uaw h VAL 77 Cb 0.77 0.43 -0.17 0.00 -1.52 0.00 0.00 31.29 30.79 1uaw h VAL 77 CO -0.59 0.00 -0.30 0.25 0.02 0.00 0.00 177.57 176.95 1uaw h LEU 78 N -0.28 -1.11 -1.57 2.57 7.12 -0.18 1.45 115.31 123.31 1uaw h LEU 78 Ca 0.11 0.29 0.36 0.00 0.13 0.00 0.00 57.88 58.77 1uaw h LEU 78 Cb 0.45 0.65 -0.05 0.00 -0.53 0.00 0.00 40.66 41.18 1uaw h LEU 78 CO -0.32 -0.30 1.13 0.00 -0.13 0.00 0.00 178.44 178.81 1uaw h ALA 79 N 1.67 3.14 -0.51 1.25 0.00 -0.93 2.43 119.26 126.32 1uaw h ALA 79 Ca 0.40 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.19 1uaw h ALA 79 Cb 0.65 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 1uaw h ALA 79 CO -0.96 -1.77 0.07 1.04 0.00 0.00 0.00 179.25 177.63 1uaw n GLN 80 N -3.62 3.74 0.23 0.00 1.13 0.50 -4.53 117.38 114.82 1uaw n GLN 80 Ca 0.28 -3.05 0.09 0.00 -1.94 0.00 0.00 57.00 52.38 1uaw n GLN 80 Cb 1.52 -2.09 0.50 0.00 0.11 0.00 0.00 30.24 30.27 1uaw n GLN 80 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1uaw h SER 81 N 2.72 0.00 -0.01 1.08 0.87 0.43 1.32 113.55 119.96 1uaw h SER 81 Ca 0.09 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 1uaw h SER 81 Cb 1.90 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.86 1uaw h SER 81 CO 0.47 0.00 -0.26 -2.11 -0.53 0.00 0.00 176.83 174.41 1uaw n ARG 82 N -2.35 1.81 -2.28 2.24 1.85 -1.26 -4.12 116.66 112.55 1uaw n ARG 82 Ca -0.01 -0.75 -0.06 0.00 -1.00 0.00 0.00 57.85 56.03 1uaw n ARG 82 Cb 0.38 -1.19 -0.01 0.00 -1.05 0.00 0.00 32.46 30.59 1uaw n ARG 82 CO 0.00 0.00 0.00 1.58 -0.01 0.00 0.00 177.63 179.20 1uaw n HIS 83 N -0.13 -1.32 -2.93 2.89 -0.00 0.45 -3.06 115.22 111.12 1uaw n HIS 83 Ca 0.06 0.10 -0.42 0.00 0.46 0.00 0.00 57.72 57.91 1uaw n HIS 83 Cb 0.28 -0.84 -0.05 0.00 -0.12 0.00 0.00 29.99 29.26 1uaw n HIS 83 CO 0.00 0.00 0.00 -2.00 0.46 0.00 0.00 176.34 174.80 1uaw s GLU 84 N -3.96 4.01 0.00 1.57 2.12 -1.22 -2.94 118.70 118.27 1uaw s GLU 84 Ca 0.12 0.67 0.00 0.00 0.36 0.00 0.00 54.97 56.11 1uaw s GLU 84 Cb -0.07 -3.71 0.00 0.00 0.26 0.00 0.00 34.13 30.61 1uaw s GLU 84 CO 0.14 -0.65 0.00 1.47 -0.54 0.00 0.00 175.26 175.69 1uaw n LEU 85 N 6.17 0.00 -2.01 2.70 -0.00 -1.02 -4.92 117.00 117.91 1uaw n LEU 85 Ca 0.04 0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 55.92 1uaw n LEU 85 Cb 0.48 0.22 -0.14 0.00 -0.00 0.00 0.00 43.42 43.98 1uaw n LEU 85 CO 0.50 -0.32 1.56 0.47 -0.00 0.00 0.00 177.39 179.60 1uaw n ASP 86 N -1.95 5.40 0.00 1.45 8.00 -1.26 -4.57 116.55 123.62 1uaw n ASP 86 Ca 0.00 -2.56 0.00 0.00 0.71 0.00 0.00 54.79 52.94 1uaw n ASP 86 Cb 0.00 -1.37 0.00 0.00 -0.02 0.00 0.00 41.12 39.73 1uaw n ASP 86 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1uaw n SER 87 N 2.22 0.00 -4.43 -2.24 2.88 -1.26 -4.97 113.62 105.82 1uaw n SER 87 Ca 0.40 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.62 1uaw n SER 87 Cb 0.84 -1.04 -0.14 0.00 -0.75 0.00 0.00 64.21 63.13 1uaw n SER 87 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 1uaw s LYS 88 N -0.41 2.54 -0.80 -1.46 0.00 -1.26 -5.06 119.74 113.29 1uaw s LYS 88 Ca 0.00 -0.74 0.02 0.00 0.00 0.00 0.00 55.97 55.25 1uaw s LYS 88 Cb 0.00 -2.34 0.26 0.00 0.00 0.00 0.00 37.83 35.75 1uaw s LYS 88 CO 0.00 0.56 0.97 -2.37 0.00 0.00 0.00 175.35 174.50 1uaw n THR 89 N 2.49 3.31 -0.06 3.79 5.66 -1.25 -2.44 114.28 125.78 1uaw n THR 89 Ca -0.17 -5.42 -0.04 0.00 -3.05 0.00 0.00 64.05 55.36 1uaw n THR 89 Cb 0.52 -2.12 0.04 0.00 -1.55 0.00 0.00 70.33 67.22 1uaw n THR 89 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 1uaw n ILE 90 N 1.15 0.00 -3.37 1.09 5.41 -1.15 -4.70 119.36 117.79 1uaw n ILE 90 Ca 0.28 0.00 -0.23 0.00 1.00 0.00 0.00 62.75 63.80 1uaw n ILE 90 Cb 0.38 -0.13 -0.09 0.00 -0.71 0.00 0.00 39.64 39.09 1uaw n ILE 90 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1uaw s ASP 91 N -1.89 1.73 -0.19 4.38 -1.08 0.72 -3.69 116.67 116.64 1uaw s ASP 91 Ca 0.09 -2.18 -0.29 0.00 -0.52 0.00 0.00 52.55 49.65 1uaw s ASP 91 Cb -0.02 0.05 -0.05 0.00 -1.46 0.00 0.00 42.92 41.44 1uaw s ASP 91 CO 0.07 -0.24 2.04 -2.16 0.52 0.00 0.00 175.17 175.40 1uaw s PRO 92 N 0.93 3.40 -0.30 4.34 0.04 -1.26 -1.06 135.00 141.09 1uaw s PRO 92 Ca 0.22 1.99 -0.01 0.00 0.04 0.00 0.00 61.00 63.24 1uaw s PRO 92 Cb -0.13 -4.27 0.05 0.00 0.04 0.00 0.00 34.50 30.19 1uaw s PRO 92 CO -0.05 -1.79 -0.00 -1.59 0.04 0.00 0.00 177.00 173.60 1uaw s LYS 93 N 5.74 2.37 0.14 4.56 0.00 0.13 -4.81 119.74 127.87 1uaw s LYS 93 Ca 0.92 -1.31 -0.02 0.00 0.00 0.00 0.00 55.97 55.55 1uaw s LYS 93 Cb -0.32 -3.16 -0.05 0.00 0.00 0.00 0.00 37.83 34.30 1uaw s LYS 93 CO 0.35 -0.64 0.34 0.08 0.00 0.00 0.00 175.35 175.48 1uaw s VAL 94 N 1.22 5.23 -0.21 1.79 1.01 -1.26 -2.19 120.40 125.99 1uaw s VAL 94 Ca -0.05 -0.21 -0.05 0.00 0.00 0.00 0.00 61.98 61.68 1uaw s VAL 94 Cb -0.20 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.50 1uaw s VAL 94 CO -0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 175.10 175.07 1uaw s ALA 95 N -1.70 2.99 -2.97 5.51 0.00 -1.26 -4.98 121.76 119.36 1uaw s ALA 95 Ca 0.39 -1.04 0.24 0.00 0.00 0.00 0.00 51.96 51.55 1uaw s ALA 95 Cb -0.12 -1.78 0.25 0.00 0.00 0.00 0.00 23.12 21.47 1uaw s ALA 95 CO 0.27 -0.23 1.29 0.34 0.00 0.00 0.00 175.76 177.43