#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 0.85 0.73 0.00 -2.85 -1.26 -4.89 119.74 112.33 1uaw s LYS 21 Ca 0.00 -0.32 -0.11 0.00 -1.00 0.00 0.00 55.97 54.54 1uaw s LYS 21 Cb 0.00 0.39 0.03 0.00 -2.06 0.00 0.00 37.83 36.19 1uaw s LYS 21 CO 0.00 -0.37 1.08 1.41 0.10 0.00 0.00 175.35 177.57 1uaw s MET 22 N -3.16 2.63 -0.04 1.78 -2.45 0.44 -4.23 119.30 114.26 1uaw s MET 22 Ca 0.05 0.68 -0.01 0.00 -1.25 0.00 0.00 55.69 55.15 1uaw s MET 22 Cb -0.01 -1.98 0.03 0.00 1.25 0.00 0.00 34.83 34.13 1uaw s MET 22 CO -0.09 -1.25 0.09 0.12 1.05 0.00 0.00 175.02 174.94 1uaw s PHE 23 N -3.18 -0.06 0.18 4.11 5.36 -0.54 -1.59 117.98 122.26 1uaw s PHE 23 Ca 0.59 0.31 0.06 0.00 -0.96 0.00 0.00 56.93 56.92 1uaw s PHE 23 Cb -0.13 -0.19 -0.04 0.00 -0.34 0.00 0.00 43.02 42.32 1uaw s PHE 23 CO 0.54 -0.14 0.13 0.42 -1.46 0.00 0.00 175.22 174.71 1uaw s ILE 24 N 1.23 4.37 -0.00 3.12 1.09 0.98 0.47 121.20 132.45 1uaw s ILE 24 Ca -0.08 -1.20 0.00 0.00 -1.10 0.00 0.00 60.65 58.28 1uaw s ILE 24 Cb -0.12 -3.25 0.00 0.00 -1.06 0.00 0.00 42.46 38.03 1uaw s ILE 24 CO -0.04 -0.16 -0.01 -0.83 -0.10 0.00 0.00 174.94 173.80 1uaw s GLY 25 N -3.22 0.06 0.00 6.18 0.00 -0.71 -2.44 107.32 107.18 1uaw s GLY 25 Ca 0.31 -0.02 0.00 0.00 0.00 0.00 0.00 44.72 45.01 1uaw s GLY 25 CO 0.23 0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.97 1uaw n GLY 26 N 3.16 1.80 3.66 0.20 0.00 -1.04 0.31 105.19 113.29 1uaw n GLY 26 Ca -0.14 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.34 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 2.67 -4.24 0.99 7.94 0.77 -4.04 117.00 121.08 1uaw n LEU 27 Ca 0.00 0.95 -0.30 0.00 -1.11 0.00 0.00 56.01 55.55 1uaw n LEU 27 Cb 0.00 -1.22 0.29 0.00 0.53 0.00 0.00 43.42 43.01 1uaw n LEU 27 CO 0.00 -0.35 0.35 -0.24 -1.11 0.00 0.00 177.39 176.04 1uaw n SER 28 N 6.41 -3.86 -0.62 1.96 2.88 -1.26 -4.72 113.62 114.41 1uaw n SER 28 Ca 0.28 -0.77 0.02 0.00 -1.33 0.00 0.00 58.87 57.07 1uaw n SER 28 Cb 0.19 -1.03 0.09 0.00 -0.75 0.00 0.00 64.21 62.71 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 -5.70 0.40 -1.20 0.66 4.27 -1.26 -3.56 117.44 111.05 1uaw n TRP 29 Ca 0.12 -0.15 0.00 0.00 -3.89 0.00 0.00 57.50 53.58 1uaw n TRP 29 Cb 0.59 -0.11 0.00 0.00 -1.36 0.00 0.00 31.31 30.42 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 0.10 0.00 -1.60 -2.67 10.64 -1.26 -5.10 117.38 117.48 1uaw n GLN 30 Ca 0.06 -0.30 -0.32 0.00 -1.83 0.00 0.00 57.00 54.61 1uaw n GLN 30 Cb 0.34 -0.40 0.06 0.00 -0.86 0.00 0.00 30.24 29.38 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 3.39 0.43 -0.39 2.01 -1.23 -5.06 115.64 114.80 1uaw s THR 31 Ca 0.00 0.56 0.03 0.00 0.31 0.00 0.00 61.69 62.60 1uaw s THR 31 Cb 0.00 -3.09 -0.02 0.00 0.01 0.00 0.00 72.50 69.40 1uaw s THR 31 CO 0.00 -0.48 0.10 0.28 -0.69 0.00 0.00 174.62 173.82 1uaw s THR 32 N -2.60 0.75 0.00 -0.82 -1.32 -1.26 -4.99 115.64 105.40 1uaw s THR 32 Ca 0.64 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 59.12 1uaw s THR 32 Cb -0.18 -2.31 0.00 0.00 -1.51 0.00 0.00 72.50 68.50 1uaw s THR 32 CO 0.47 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.88 1uaw n GLN 33 N -1.00 0.00 -0.15 7.08 6.02 -1.26 -3.20 117.38 124.87 1uaw n GLN 33 Ca -0.09 0.18 -0.03 0.00 -0.01 0.00 0.00 57.00 57.04 1uaw n GLN 33 Cb 0.65 -0.60 0.04 0.00 1.02 0.00 0.00 30.24 31.35 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 -0.82 -1.09 4.81 -1.98 2.10 114.58 117.62 1uaw h GLU 34 Ca 0.00 -0.00 0.24 0.00 -0.13 0.00 0.00 59.36 59.47 1uaw h GLU 34 Cb 0.00 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 1uaw h GLU 34 CO 0.00 0.02 0.71 0.78 -0.73 0.00 0.00 179.01 179.79 1uaw h GLY 35 N 0.02 0.00 1.79 1.92 0.00 -1.99 2.48 103.07 107.29 1uaw h GLY 35 Ca 0.23 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.32 1uaw h GLY 35 CO -0.47 0.00 -1.14 -2.00 0.00 0.00 0.00 176.54 172.92 1uaw h LEU 36 N 0.00 0.17 -1.49 3.11 5.85 0.33 -1.40 115.31 121.88 1uaw h LEU 36 Ca 0.39 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 1uaw h LEU 36 Cb 1.81 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.76 1uaw h LEU 36 CO -0.00 1.15 0.28 0.08 -0.34 0.00 0.00 178.44 179.61 1uaw h ARG 37 N 0.03 0.63 0.00 1.25 0.11 0.73 0.22 114.38 117.35 1uaw h ARG 37 Ca -0.08 -0.05 -0.09 0.00 0.10 0.00 0.00 59.98 59.86 1uaw h ARG 37 Cb 1.86 -0.14 -0.01 0.00 1.11 0.00 0.00 29.97 32.79 1uaw h ARG 37 CO 0.15 0.44 -0.45 0.93 0.10 0.00 0.00 179.97 181.14 1uaw h GLU 38 N 0.64 0.00 0.00 0.08 5.08 -0.43 0.47 114.58 120.41 1uaw h GLU 38 Ca 0.17 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.45 1uaw h GLU 38 Cb -0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1uaw h GLU 38 CO -0.03 0.45 -0.40 -0.92 -1.00 0.00 0.00 179.01 177.11 1uaw h TYR 39 N 0.00 0.00 0.00 4.33 5.03 0.54 -3.10 116.97 123.78 1uaw h TYR 39 Ca -0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 1uaw h TYR 39 Cb 1.18 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.46 1uaw h TYR 39 CO 0.00 0.40 -1.10 1.19 -1.32 0.00 0.00 178.16 177.32 1uaw n PHE 40 N -3.35 0.00 1.43 -3.82 3.72 -0.66 -4.38 117.46 110.40 1uaw n PHE 40 Ca 0.01 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.56 1uaw n PHE 40 Cb 0.60 -0.12 0.76 0.00 -0.94 0.00 0.00 39.48 39.77 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 1.91 -1.26 0.18 1.37 0.00 0.16 -2.64 105.19 104.91 1uaw n GLY 41 Ca -0.01 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 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 0.56 -0.08 1.61 5.75 -1.74 -3.15 115.11 118.06 1uaw h GLN 42 Ca 0.00 -0.11 0.00 0.00 -0.15 0.00 0.00 58.65 58.39 1uaw h GLN 42 Cb 0.27 -0.09 0.00 0.00 1.07 0.00 0.00 27.48 28.74 1uaw h GLN 42 CO 0.00 0.56 0.00 1.97 -2.65 0.00 0.00 178.83 178.71 1uaw n PHE 43 N -4.65 0.09 -4.05 3.99 1.16 -1.23 -5.02 117.46 107.75 1uaw n PHE 43 Ca -0.01 -0.08 -0.14 0.00 -1.87 0.00 0.00 57.45 55.35 1uaw n PHE 43 Cb 0.16 -0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 37.99 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 -1.16 1.42 -0.26 4.97 0.00 -1.08 -4.64 107.32 106.56 1uaw s GLY 44 Ca 0.19 -1.46 -0.10 0.00 0.00 0.00 0.00 44.72 43.34 1uaw s GLY 44 CO 0.18 -0.92 0.16 -1.83 0.00 0.00 0.00 173.10 170.69 1uaw s GLU 45 N -2.83 3.92 -0.26 2.90 -1.05 -1.26 -4.04 118.70 116.08 1uaw s GLU 45 Ca 0.29 -0.34 -0.13 0.00 -0.15 0.00 0.00 54.97 54.64 1uaw s GLU 45 Cb -0.01 -3.57 -0.04 0.00 -0.44 0.00 0.00 34.13 30.07 1uaw s GLU 45 CO 0.20 -0.13 0.28 0.08 0.95 0.00 0.00 175.26 176.65 1uaw s VAL 46 N 1.57 5.26 -0.07 1.83 1.01 -1.26 -4.09 120.40 124.65 1uaw s VAL 46 Ca 0.07 0.39 -0.01 0.00 0.00 0.00 0.00 61.98 62.43 1uaw s VAL 46 Cb -0.15 -3.61 -0.26 0.00 0.00 0.00 0.00 36.38 32.36 1uaw s VAL 46 CO 0.08 0.23 0.56 0.50 0.00 0.00 0.00 175.10 176.48 1uaw h LYS 47 N 8.01 0.19 -2.84 2.72 1.63 -1.89 -3.47 116.57 120.92 1uaw h LYS 47 Ca -0.34 -0.33 0.02 0.00 -0.85 0.00 0.00 60.65 59.15 1uaw h LYS 47 Cb 1.17 0.12 -0.12 0.00 -0.60 0.00 0.00 32.23 32.81 1uaw h LYS 47 CO 0.63 0.99 0.27 -2.00 -3.45 0.00 0.00 179.45 175.89 1uaw s GLU 48 N -2.58 1.24 0.18 1.90 2.12 -1.26 -5.00 118.70 115.30 1uaw s GLU 48 Ca -0.14 -0.49 -0.12 0.00 0.36 0.00 0.00 54.97 54.58 1uaw s GLU 48 Cb 0.07 0.55 0.00 0.00 0.26 0.00 0.00 34.13 35.01 1uaw s GLU 48 CO 0.81 -0.55 0.37 0.00 -0.54 0.00 0.00 175.26 175.35 1uaw s LEU 50 N -2.95 0.26 -0.08 0.00 0.05 -0.45 -4.90 118.68 110.61 1uaw s LEU 50 Ca 0.16 0.74 0.04 0.00 0.05 0.00 0.00 54.13 55.12 1uaw s LEU 50 Cb 0.02 1.14 -0.00 0.00 -2.05 0.00 0.00 46.19 45.30 1uaw s LEU 50 CO 0.00 -0.16 -0.22 -0.69 -0.55 0.00 0.00 176.35 174.73 1uaw s VAL 51 N 1.01 1.86 0.08 1.48 1.01 -1.26 0.70 120.40 125.28 1uaw s VAL 51 Ca -0.07 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.04 1uaw s VAL 51 Cb -0.07 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 1uaw s VAL 51 CO -0.08 0.52 -0.12 -0.32 0.00 0.00 0.00 175.10 175.10 1uaw s MET 52 N 0.24 0.82 0.00 2.72 0.00 -0.88 -5.02 119.30 117.19 1uaw s MET 52 Ca -0.13 -1.01 0.00 0.00 0.00 0.00 0.00 55.69 54.54 1uaw s MET 52 Cb -0.16 -0.71 0.00 0.00 0.00 0.00 0.00 34.83 33.96 1uaw s MET 52 CO 0.06 0.14 0.00 2.89 0.00 0.00 0.00 175.02 178.12 1uaw n ARG 53 N 1.04 0.00 -0.80 4.11 1.85 -1.26 -2.35 116.66 119.24 1uaw n ARG 53 Ca -0.19 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.66 1uaw n ARG 53 Cb 0.55 -0.26 0.00 0.00 -1.05 0.00 0.00 32.46 31.71 1uaw n ARG 53 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1uaw n ASP 54 N -1.11 -4.90 0.00 2.89 2.03 -1.26 -3.75 116.55 110.45 1uaw n ASP 54 Ca 0.00 0.62 0.03 0.00 0.52 0.00 0.00 54.79 55.96 1uaw n ASP 54 Cb 0.00 -1.87 0.17 0.00 -0.72 0.00 0.00 41.12 38.70 1uaw n ASP 54 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1uaw n PRO 55 N -0.80 0.08 -0.10 -0.67 -0.05 -1.26 -2.70 135.00 129.50 1uaw n PRO 55 Ca 0.00 0.26 -0.21 0.00 -0.05 0.00 0.00 63.50 63.50 1uaw n PRO 55 Cb 0.00 -1.50 -0.11 0.00 -0.05 0.00 0.00 33.50 31.84 1uaw n PRO 55 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 175.50 175.38 1uaw h LEU 56 N 0.00 0.00 0.00 1.53 3.38 -2.02 -3.47 115.31 114.74 1uaw h LEU 56 Ca 0.00 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1uaw h LEU 56 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1uaw h LEU 56 CO 0.00 1.44 0.00 0.35 0.09 0.00 0.00 178.44 180.32 1uaw n THR 57 N -4.45 0.00 -0.29 0.22 -2.24 -1.10 -4.17 114.28 102.25 1uaw n THR 57 Ca -0.30 0.00 0.34 0.00 -2.27 0.00 0.00 64.05 61.82 1uaw n THR 57 Cb 0.65 0.00 0.70 0.00 -2.10 0.00 0.00 70.33 69.58 1uaw n THR 57 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1uaw h LYS 58 N 0.00 0.00 0.00 -0.78 2.10 -1.91 -1.32 116.57 114.66 1uaw h LYS 58 Ca 0.00 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.47 1uaw h LYS 58 Cb 0.00 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.30 1uaw h LYS 58 CO 0.00 0.00 -1.70 2.89 -2.00 0.00 0.00 179.45 178.64 1uaw n ARG 59 N -3.84 1.28 0.00 0.07 -4.01 -1.26 -5.01 116.66 103.89 1uaw n ARG 59 Ca 0.25 0.04 0.00 0.00 -1.04 0.00 0.00 57.85 57.10 1uaw n ARG 59 Cb 1.34 -1.25 0.00 0.00 -3.04 0.00 0.00 32.46 29.50 1uaw n ARG 59 CO 0.00 0.00 0.00 0.45 -3.04 0.00 0.00 177.63 175.04 1uaw n SER 60 N -2.63 0.00 0.00 2.89 2.88 -0.50 -5.03 113.62 111.23 1uaw n SER 60 Ca -0.19 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.35 1uaw n SER 60 Cb 0.78 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.24 1uaw n SER 60 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1uaw n ARG 61 N 0.00 0.00 -1.39 -1.46 5.12 -1.26 -4.88 116.66 112.78 1uaw n ARG 61 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1uaw n ARG 61 Cb 0.00 -0.59 0.00 0.00 -1.16 0.00 0.00 32.46 30.71 1uaw n ARG 61 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1uaw n GLY 62 N 1.99 -2.58 2.42 -0.13 0.00 -1.26 -4.70 105.19 100.93 1uaw n GLY 62 Ca 0.00 -0.28 -0.11 0.00 0.00 0.00 0.00 46.02 45.63 1uaw n GLY 62 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1uaw n PHE 63 N -0.01 -1.15 -4.05 1.61 1.16 -0.99 -0.17 117.46 113.86 1uaw n PHE 63 Ca 0.00 -1.70 -0.09 0.00 -1.87 0.00 0.00 57.45 53.80 1uaw n PHE 63 Cb 0.00 0.39 -0.09 0.00 -1.61 0.00 0.00 39.48 38.17 1uaw n PHE 63 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 1uaw s GLY 64 N -2.56 0.59 0.13 4.97 0.00 -1.02 -2.06 107.32 107.36 1uaw s GLY 64 Ca 0.21 -1.14 0.07 0.00 0.00 0.00 0.00 44.72 43.86 1uaw s GLY 64 CO 0.15 -1.16 -0.15 -1.36 0.00 0.00 0.00 173.10 170.58 1uaw s PHE 65 N -3.96 1.50 -0.23 1.90 0.08 0.22 -0.02 117.98 117.47 1uaw s PHE 65 Ca 0.14 -0.52 -0.03 0.00 0.12 0.00 0.00 56.93 56.64 1uaw s PHE 65 Cb 0.06 -0.78 0.12 0.00 -0.57 0.00 0.00 43.02 41.86 1uaw s PHE 65 CO -0.04 0.18 0.34 0.08 -0.10 0.00 0.00 175.22 175.68 1uaw s VAL 66 N -2.01 -0.54 -0.39 -0.44 1.01 -0.62 -1.34 120.40 116.08 1uaw s VAL 66 Ca 0.09 -0.08 -0.04 0.00 0.00 0.00 0.00 61.98 61.96 1uaw s VAL 66 Cb -0.06 -0.78 0.01 0.00 0.00 0.00 0.00 36.38 35.56 1uaw s VAL 66 CO 0.04 -0.14 2.90 0.41 0.00 0.00 0.00 175.10 178.30 1uaw n THR 67 N 5.35 3.27 -1.31 3.92 -1.04 0.65 -0.42 114.28 124.71 1uaw n THR 67 Ca -0.04 -2.77 -0.23 0.00 -2.04 0.00 0.00 64.05 58.97 1uaw n THR 67 Cb 0.50 -1.65 -0.10 0.00 -1.82 0.00 0.00 70.33 67.26 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 1.11 1.12 -1.70 -1.42 -1.74 -1.26 -3.31 117.46 110.26 1uaw n PHE 68 Ca 0.48 -1.99 -0.65 0.00 -0.56 0.00 0.00 57.45 54.73 1uaw n PHE 68 Cb 0.61 -1.66 -0.09 0.00 1.52 0.00 0.00 39.48 39.85 1uaw n PHE 68 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1uaw n MET 69 N 2.00 0.30 -2.61 3.97 0.00 -1.26 -4.51 117.12 115.01 1uaw n MET 69 Ca 0.52 0.11 -0.06 0.00 0.00 0.00 0.00 57.70 58.26 1uaw n MET 69 Cb 0.64 -1.66 -0.01 0.00 0.00 0.00 0.00 33.22 32.18 1uaw n MET 69 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1uaw n ASP 70 N 4.68 -0.67 0.00 3.17 2.03 -1.26 -4.75 116.55 119.75 1uaw n ASP 70 Ca 0.32 -1.84 0.00 0.00 0.52 0.00 0.00 54.79 53.79 1uaw n ASP 70 Cb -0.01 1.22 0.00 0.00 -0.72 0.00 0.00 41.12 41.61 1uaw n ASP 70 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1uaw n GLN 71 N -0.26 0.00 -0.05 -0.67 0.00 -1.26 -4.48 117.38 110.66 1uaw n GLN 71 Ca -0.00 0.11 0.04 0.00 -0.00 0.00 0.00 57.00 57.15 1uaw n GLN 71 Cb 0.27 -0.56 0.17 0.00 0.00 0.00 0.00 30.24 30.11 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 -2.22 2.51 -0.04 1.69 0.00 -1.26 -4.29 120.51 116.89 1uaw n ALA 72 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1uaw n ALA 72 Cb 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1uaw n ALA 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uaw n GLY 73 N 0.74 -2.56 0.64 0.00 0.00 -1.26 -1.69 105.19 101.06 1uaw n GLY 73 Ca 0.07 0.09 0.45 0.00 0.00 0.00 0.00 46.02 46.63 1uaw n GLY 73 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1uaw h VAL 74 N 0.00 0.09 0.00 1.61 2.07 -1.86 0.14 116.25 118.29 1uaw h VAL 74 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1uaw h VAL 74 Cb 0.00 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 29.87 1uaw h VAL 74 CO 0.00 0.00 0.00 0.47 0.02 0.00 0.00 177.57 178.06 1uaw n ASP 75 N -3.85 0.00 0.02 0.57 8.00 -0.68 -0.55 116.55 120.05 1uaw n ASP 75 Ca 0.37 0.32 0.22 0.00 0.71 0.00 0.00 54.79 56.40 1uaw n ASP 75 Cb 1.77 0.00 0.61 0.00 -0.02 0.00 0.00 41.12 43.47 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 0.00 0.30 -1.24 6.56 -0.99 0.12 116.57 121.33 1uaw h LYS 76 Ca 0.00 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.58 1uaw h LYS 76 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1uaw h LYS 76 CO 0.00 0.00 -0.14 0.28 -2.06 0.00 0.00 179.45 177.53 1uaw h VAL 77 N 0.00 0.65 -0.95 0.50 2.07 -0.66 -2.61 116.25 115.24 1uaw h VAL 77 Ca 0.27 -0.72 0.28 0.00 0.82 0.00 0.00 66.70 67.35 1uaw h VAL 77 Cb 1.75 0.98 -0.04 0.00 -1.52 0.00 0.00 31.29 32.46 1uaw h VAL 77 CO -0.00 0.13 0.77 0.17 0.02 0.00 0.00 177.57 178.65 1uaw h LEU 78 N -0.84 0.00 -1.74 2.57 8.10 0.18 1.38 115.31 124.96 1uaw h LEU 78 Ca -0.04 0.00 0.21 0.00 0.11 0.00 0.00 57.88 58.16 1uaw h LEU 78 Cb 0.52 0.00 -0.05 0.00 -0.44 0.00 0.00 40.66 40.69 1uaw h LEU 78 CO 0.07 0.00 0.58 0.00 -4.11 0.00 0.00 178.44 174.98 1uaw h ALA 79 N 1.35 2.46 -0.73 0.17 0.00 -1.22 1.10 119.26 122.39 1uaw h ALA 79 Ca 0.45 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 55.15 1uaw h ALA 79 Cb 1.99 0.01 -0.12 0.00 0.00 0.00 0.00 17.79 19.67 1uaw h ALA 79 CO -0.00 -0.71 0.26 1.04 0.00 0.00 0.00 179.25 179.83 1uaw n GLN 80 N -4.41 3.78 0.29 0.00 1.13 0.47 -4.49 117.38 114.15 1uaw n GLN 80 Ca 0.18 -3.02 0.10 0.00 -1.94 0.00 0.00 57.00 52.31 1uaw n GLN 80 Cb 0.77 -2.21 0.54 0.00 0.11 0.00 0.00 30.24 29.44 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 0.13 2.02 113.55 120.37 1uaw h SER 81 Ca 0.25 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 1uaw h SER 81 Cb 2.31 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 64.27 1uaw h SER 81 CO 0.73 0.00 -0.62 -2.11 -0.53 0.00 0.00 176.83 174.29 1uaw n ARG 82 N -2.60 1.36 -2.87 2.24 1.85 -1.26 -3.95 116.66 111.43 1uaw n ARG 82 Ca -0.01 -0.41 -0.18 0.00 -1.00 0.00 0.00 57.85 56.24 1uaw n ARG 82 Cb 0.50 -1.34 -0.03 0.00 -1.05 0.00 0.00 32.46 30.54 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 -0.79 -0.86 -2.99 2.89 -0.00 0.69 -2.88 115.22 111.26 1uaw n HIS 83 Ca 0.05 0.29 -0.41 0.00 0.46 0.00 0.00 57.72 58.12 1uaw n HIS 83 Cb 0.33 -0.98 -0.05 0.00 -0.12 0.00 0.00 29.99 29.17 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 -4.29 4.16 0.00 1.57 2.12 -1.21 -2.40 118.70 118.65 1uaw s GLU 84 Ca 0.36 0.76 0.00 0.00 0.36 0.00 0.00 54.97 56.45 1uaw s GLU 84 Cb -0.21 -3.64 0.00 0.00 0.26 0.00 0.00 34.13 30.54 1uaw s GLU 84 CO 0.44 -0.46 0.00 1.47 -0.54 0.00 0.00 175.26 176.17 1uaw n LEU 85 N 5.82 0.00 -2.41 2.70 -0.00 -0.97 -4.93 117.00 117.21 1uaw n LEU 85 Ca 0.03 0.00 -0.20 0.00 -0.00 0.00 0.00 56.01 55.83 1uaw n LEU 85 Cb 0.48 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.78 1uaw n LEU 85 CO 0.45 0.00 2.16 -0.67 -0.00 0.00 0.00 177.39 179.33 1uaw n ASP 86 N -0.65 6.27 0.00 1.45 2.03 -1.26 -4.48 116.55 119.91 1uaw n ASP 86 Ca 0.00 -2.50 0.00 0.00 0.52 0.00 0.00 54.79 52.81 1uaw n ASP 86 Cb 0.00 -1.45 0.00 0.00 -0.72 0.00 0.00 41.12 38.95 1uaw n ASP 86 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1uaw n SER 87 N 2.84 -1.23 -4.39 1.67 2.88 -1.26 -4.96 113.62 109.17 1uaw n SER 87 Ca 0.54 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.73 1uaw n SER 87 Cb 0.70 -1.33 -0.13 0.00 -0.75 0.00 0.00 64.21 62.70 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 -0.58 3.49 -0.94 -1.46 -2.85 -1.26 -5.02 119.74 111.12 1uaw s LYS 88 Ca 0.00 -0.59 -0.00 0.00 -1.00 0.00 0.00 55.97 54.38 1uaw s LYS 88 Cb 0.00 -2.94 0.31 0.00 -2.06 0.00 0.00 37.83 33.15 1uaw s LYS 88 CO 0.00 0.01 1.50 -2.37 0.10 0.00 0.00 175.35 174.59 1uaw n THR 89 N 4.19 5.11 -0.28 3.79 5.66 -1.24 -2.30 114.28 129.20 1uaw n THR 89 Ca -0.18 -5.85 -0.13 0.00 -3.05 0.00 0.00 64.05 54.85 1uaw n THR 89 Cb 0.52 -1.74 0.12 0.00 -1.55 0.00 0.00 70.33 67.68 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 0.40 0.00 -3.37 1.09 5.41 -1.01 -4.62 119.36 117.26 1uaw n ILE 90 Ca 0.37 0.00 -0.23 0.00 1.00 0.00 0.00 62.75 63.89 1uaw n ILE 90 Cb 0.31 -0.41 -0.09 0.00 -0.71 0.00 0.00 39.64 38.74 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 -2.06 1.75 -0.20 4.38 -1.08 0.93 -3.18 116.67 117.21 1uaw s ASP 91 Ca 0.28 -2.16 -0.30 0.00 -0.52 0.00 0.00 52.55 49.85 1uaw s ASP 91 Cb -0.05 0.05 -0.07 0.00 -1.46 0.00 0.00 42.92 41.39 1uaw s ASP 91 CO 0.23 -0.25 2.17 -0.81 0.52 0.00 0.00 175.17 177.04 1uaw n PRO 92 N 3.77 1.96 -3.87 4.34 -0.04 -1.25 -1.74 135.00 138.17 1uaw n PRO 92 Ca 0.16 0.58 -0.27 0.00 -0.04 0.00 0.00 63.50 63.93 1uaw n PRO 92 Cb 0.43 -3.07 -0.17 0.00 -0.04 0.00 0.00 33.50 30.65 1uaw n PRO 92 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1uaw s LYS 93 N 6.00 1.32 0.56 0.54 0.00 0.18 -4.76 119.74 123.57 1uaw s LYS 93 Ca 1.00 -0.32 0.06 0.00 0.00 0.00 0.00 55.97 56.71 1uaw s LYS 93 Cb -0.44 -1.71 0.06 0.00 0.00 0.00 0.00 37.83 35.75 1uaw s LYS 93 CO 0.39 -0.36 0.77 0.08 0.00 0.00 0.00 175.35 176.23 1uaw s VAL 94 N 1.72 2.47 -0.45 1.79 1.01 -1.26 -1.47 120.40 124.21 1uaw s VAL 94 Ca 0.03 -0.86 -0.18 0.00 0.00 0.00 0.00 61.98 60.96 1uaw s VAL 94 Cb -0.14 -2.60 0.03 0.00 0.00 0.00 0.00 36.38 33.67 1uaw s VAL 94 CO -0.08 0.00 0.52 0.00 0.00 0.00 0.00 175.10 175.54 1uaw s ALA 95 N -2.69 3.41 0.00 5.51 0.00 -1.26 -4.87 121.76 121.86 1uaw s ALA 95 Ca 0.60 -1.54 0.00 0.00 0.00 0.00 0.00 51.96 51.02 1uaw s ALA 95 Cb -0.08 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1uaw s ALA 95 CO 0.38 -1.73 0.00 0.34 0.00 0.00 0.00 175.76 174.75