#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uaw n LYS 21 N 0.00 0.00 -4.64 0.00 2.85 -1.26 -5.01 118.16 110.10 1uaw n LYS 21 Ca 0.00 -0.06 -0.29 0.00 -1.05 0.00 0.00 58.31 56.91 1uaw n LYS 21 Cb 0.00 0.12 -0.09 0.00 -0.65 0.00 0.00 35.03 34.41 1uaw n LYS 21 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1uaw s MET 22 N -2.00 2.03 0.07 -1.58 0.23 -0.07 -3.73 119.30 114.25 1uaw s MET 22 Ca 0.04 -2.24 -0.09 0.00 -1.03 0.00 0.00 55.69 52.37 1uaw s MET 22 Cb -0.00 -1.26 -0.00 0.00 -1.53 0.00 0.00 34.83 32.03 1uaw s MET 22 CO -0.00 -0.31 0.18 0.12 -2.03 0.00 0.00 175.02 172.98 1uaw s PHE 23 N -2.97 0.14 -0.08 3.16 2.19 -0.87 -1.45 117.98 118.09 1uaw s PHE 23 Ca 0.19 -0.51 0.03 0.00 0.33 0.00 0.00 56.93 56.97 1uaw s PHE 23 Cb 0.04 -0.06 -0.02 0.00 -1.31 0.00 0.00 43.02 41.67 1uaw s PHE 23 CO 0.10 -0.50 -0.17 0.42 1.83 0.00 0.00 175.22 176.90 1uaw s ILE 24 N -3.45 2.75 -0.03 3.12 -1.09 0.36 -0.32 121.20 122.53 1uaw s ILE 24 Ca 0.02 -0.81 0.04 0.00 -2.23 0.00 0.00 60.65 57.67 1uaw s ILE 24 Cb 0.03 -2.09 -0.03 0.00 -1.58 0.00 0.00 42.46 38.79 1uaw s ILE 24 CO -0.09 0.56 -0.12 -0.83 -1.23 0.00 0.00 174.94 173.23 1uaw s GLY 25 N -0.15 1.60 -1.31 6.18 0.00 -1.07 -1.57 107.32 111.00 1uaw s GLY 25 Ca -0.02 -1.01 -0.07 0.00 0.00 0.00 0.00 44.72 43.62 1uaw s GLY 25 CO 0.04 -0.83 1.14 0.61 0.00 0.00 0.00 173.10 174.05 1uaw n GLY 26 N 2.02 -0.49 3.82 0.20 0.00 -0.94 0.62 105.19 110.42 1uaw n GLY 26 Ca -0.17 0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1uaw n GLY 26 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1uaw s LEU 27 N -7.05 3.62 0.01 0.99 2.34 -0.49 -3.60 118.68 114.50 1uaw s LEU 27 Ca 0.47 1.70 -0.38 0.00 0.06 0.00 0.00 54.13 55.98 1uaw s LEU 27 Cb -0.21 -4.52 -0.19 0.00 -0.56 0.00 0.00 46.19 40.71 1uaw s LEU 27 CO 0.72 -0.80 1.00 -1.20 -1.06 0.00 0.00 176.35 175.01 1uaw n SER 28 N -1.63 -0.10 0.19 1.48 7.64 -1.26 -4.55 113.62 115.39 1uaw n SER 28 Ca 0.08 1.12 0.05 0.00 1.01 0.00 0.00 58.87 61.13 1uaw n SER 28 Cb 0.53 -0.90 0.39 0.00 -1.01 0.00 0.00 64.21 63.23 1uaw n SER 28 CO 0.00 0.00 0.00 4.11 -3.01 0.00 0.00 175.04 176.14 1uaw h TRP 29 N 2.77 0.00 0.00 1.43 5.08 -1.92 -2.74 115.95 120.58 1uaw h TRP 29 Ca -0.48 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.49 1uaw h TRP 29 Cb 1.39 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.55 1uaw h TRP 29 CO 0.54 0.36 -0.65 0.00 -1.28 0.00 0.00 178.44 177.41 1uaw n GLN 30 N -3.84 0.28 0.00 0.12 10.64 -1.26 -4.91 117.38 118.41 1uaw n GLN 30 Ca -0.01 0.08 0.00 0.00 -1.83 0.00 0.00 57.00 55.23 1uaw n GLN 30 Cb 0.43 -1.68 0.00 0.00 -0.86 0.00 0.00 30.24 28.13 1uaw n GLN 30 CO 0.00 0.00 0.00 -2.37 -1.83 0.00 0.00 177.06 172.86 1uaw n THR 31 N -2.09 0.00 -2.79 -0.39 5.66 -1.03 -5.05 114.28 108.58 1uaw n THR 31 Ca 0.03 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.03 1uaw n THR 31 Cb 0.44 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.22 1uaw n THR 31 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 1uaw n THR 32 N -2.46 0.00 0.00 1.09 5.66 -1.26 -5.04 114.28 112.27 1uaw n THR 32 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1uaw n THR 32 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 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 0.00 0.00 -0.28 1.09 6.02 -1.26 -2.75 117.38 120.20 1uaw n GLN 33 Ca 0.00 0.35 0.10 0.00 -0.01 0.00 0.00 57.00 57.44 1uaw n GLN 33 Cb 0.00 -0.86 0.25 0.00 1.02 0.00 0.00 30.24 30.65 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 0.31 -1.09 -1.09 4.81 -1.97 2.24 114.58 117.79 1uaw h GLU 34 Ca 0.00 -0.02 0.30 0.00 -0.13 0.00 0.00 59.36 59.51 1uaw h GLU 34 Cb 0.00 -0.07 -0.09 0.00 0.63 0.00 0.00 28.75 29.22 1uaw h GLU 34 CO 0.00 0.20 0.72 0.78 -0.73 0.00 0.00 179.01 179.98 1uaw h GLY 35 N 0.32 1.02 1.20 1.92 0.00 -1.97 1.66 103.07 107.21 1uaw h GLY 35 Ca 0.50 -0.16 -0.26 0.00 0.00 0.00 0.00 47.33 47.40 1uaw h GLY 35 CO -0.54 -0.14 -1.03 -2.00 0.00 0.00 0.00 176.54 172.83 1uaw h LEU 36 N 0.29 0.92 -2.40 3.11 5.85 0.38 -1.48 115.31 121.99 1uaw h LEU 36 Ca 0.61 -0.73 0.01 0.00 0.84 0.00 0.00 57.88 58.61 1uaw h LEU 36 Cb 1.74 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 42.49 1uaw h LEU 36 CO -0.26 1.53 0.04 0.03 -0.34 0.00 0.00 178.44 179.43 1uaw h ARG 37 N 0.40 0.00 0.00 1.25 3.08 0.44 0.76 114.38 120.31 1uaw h ARG 37 Ca -0.13 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.88 1uaw h ARG 37 Cb 1.68 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.72 1uaw h ARG 37 CO 0.20 0.00 -0.62 0.93 -1.07 0.00 0.00 179.97 179.41 1uaw h GLU 38 N 0.00 0.00 0.03 0.04 5.08 0.76 0.21 114.58 120.71 1uaw h GLU 38 Ca 0.02 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.23 1uaw h GLU 38 Cb 0.09 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1uaw h GLU 38 CO -0.00 0.15 -0.77 -0.92 -1.00 0.00 0.00 179.01 176.47 1uaw h TYR 39 N 0.00 0.13 0.02 4.33 5.03 0.14 -3.24 116.97 123.38 1uaw h TYR 39 Ca -0.03 -0.09 -0.35 0.00 2.58 0.00 0.00 58.73 60.84 1uaw h TYR 39 Cb 1.17 -0.01 -0.05 0.00 1.55 0.00 0.00 36.73 39.39 1uaw h TYR 39 CO 0.00 1.30 -2.12 1.19 -1.32 0.00 0.00 178.16 177.21 1uaw n PHE 40 N -4.38 0.54 0.30 -3.82 3.72 0.75 -3.91 117.46 110.67 1uaw n PHE 40 Ca -0.21 0.16 0.16 0.00 -0.05 0.00 0.00 57.45 57.51 1uaw n PHE 40 Cb 0.66 -1.09 0.74 0.00 -0.94 0.00 0.00 39.48 38.84 1uaw n PHE 40 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1uaw h GLY 41 N 2.99 0.00 0.89 1.37 0.00 -0.47 2.10 103.07 109.95 1uaw h GLY 41 Ca -0.45 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.90 1uaw h GLY 41 CO 0.04 0.00 0.31 -1.61 0.00 0.00 0.00 176.54 175.28 1uaw h GLN 42 N 0.00 0.60 0.00 4.80 4.15 -1.58 -3.27 115.11 119.82 1uaw h GLN 42 Ca 0.00 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1uaw h GLN 42 Cb 0.25 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.81 1uaw h GLN 42 CO 0.00 0.40 -0.39 1.97 -1.93 0.00 0.00 178.83 178.88 1uaw n PHE 43 N -4.79 0.00 -3.59 3.99 1.16 -0.95 -4.87 117.46 108.42 1uaw n PHE 43 Ca 0.04 0.00 -0.29 0.00 -1.87 0.00 0.00 57.45 55.33 1uaw n PHE 43 Cb 0.07 -0.02 -0.12 0.00 -1.61 0.00 0.00 39.48 37.81 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 -1.52 1.44 -0.76 4.97 0.00 0.70 -4.36 107.32 107.80 1uaw s GLY 44 Ca 0.00 -2.46 -0.36 0.00 0.00 0.00 0.00 44.72 41.90 1uaw s GLY 44 CO 0.10 1.78 2.45 -1.84 0.00 0.00 0.00 173.10 175.59 1uaw n GLU 45 N 3.41 0.09 -3.30 2.90 0.00 -1.24 -2.99 120.64 119.50 1uaw n GLU 45 Ca 0.15 0.01 -0.37 0.00 0.00 0.00 0.00 57.16 56.95 1uaw n GLU 45 Cb 0.38 -1.61 -0.06 0.00 0.00 0.00 0.00 31.44 30.15 1uaw n GLU 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1uaw s VAL 46 N 7.85 4.78 -0.02 3.84 0.11 -1.26 -2.89 120.40 132.81 1uaw s VAL 46 Ca 1.27 1.05 0.06 0.00 -2.93 0.00 0.00 61.98 61.43 1uaw s VAL 46 Cb -1.30 -3.82 -0.08 0.00 -1.53 0.00 0.00 36.38 29.65 1uaw s VAL 46 CO 0.55 0.39 0.09 0.29 -3.33 0.00 0.00 175.10 173.09 1uaw n LYS 47 N 1.24 1.26 -4.28 1.54 5.02 0.21 -4.88 118.16 118.27 1uaw n LYS 47 Ca -0.08 -0.03 -0.24 0.00 -2.02 0.00 0.00 58.31 55.94 1uaw n LYS 47 Cb 0.51 -1.14 -0.17 0.00 -0.02 0.00 0.00 35.03 34.22 1uaw n LYS 47 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1uaw s GLU 48 N -2.31 1.45 0.01 1.97 2.02 -1.05 -4.98 118.70 115.81 1uaw s GLU 48 Ca -0.02 -0.29 -0.15 0.00 0.02 0.00 0.00 54.97 54.53 1uaw s GLU 48 Cb 0.03 -1.34 0.02 0.00 0.10 0.00 0.00 34.13 32.94 1uaw s GLU 48 CO 0.24 -0.09 0.32 0.00 0.02 0.00 0.00 175.26 175.75 1uaw s LEU 50 N -1.65 0.31 -0.08 0.00 0.05 -0.68 -4.88 118.68 111.75 1uaw s LEU 50 Ca -0.10 0.76 0.04 0.00 0.05 0.00 0.00 54.13 54.88 1uaw s LEU 50 Cb -0.03 1.19 -0.01 0.00 -2.05 0.00 0.00 46.19 45.29 1uaw s LEU 50 CO 0.01 -0.16 -0.20 -0.69 -0.55 0.00 0.00 176.35 174.77 1uaw s VAL 51 N 0.85 2.54 0.10 1.48 1.01 -1.26 0.64 120.40 125.76 1uaw s VAL 51 Ca -0.05 -0.88 0.06 0.00 0.00 0.00 0.00 61.98 61.10 1uaw s VAL 51 Cb -0.06 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 1uaw s VAL 51 CO -0.06 0.56 -0.15 -0.32 0.00 0.00 0.00 175.10 175.13 1uaw s MET 52 N -0.14 0.95 0.33 2.72 0.00 -0.90 -4.99 119.30 117.26 1uaw s MET 52 Ca -0.03 -1.11 0.00 0.00 0.00 0.00 0.00 55.69 54.55 1uaw s MET 52 Cb -0.14 -0.93 0.00 0.00 0.00 0.00 0.00 34.83 33.76 1uaw s MET 52 CO 0.04 0.20 0.00 0.54 0.00 0.00 0.00 175.02 175.79 1uaw n ARG 53 N 0.91 0.00 -3.68 4.11 3.00 -1.26 -2.59 116.66 117.15 1uaw n ARG 53 Ca -0.18 0.00 -0.29 0.00 -0.01 0.00 0.00 57.85 57.37 1uaw n ARG 53 Cb 0.55 0.00 -0.12 0.00 0.00 0.00 0.00 32.46 32.89 1uaw n ARG 53 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1uaw s ASP 54 N -3.76 3.42 0.00 0.55 1.01 -1.26 -4.47 116.67 112.16 1uaw s ASP 54 Ca 0.00 -2.91 0.00 0.00 0.71 0.00 0.00 52.55 50.35 1uaw s ASP 54 Cb 0.00 -1.01 0.00 0.00 1.01 0.00 0.00 42.92 42.92 1uaw s ASP 54 CO 0.00 -0.22 0.57 -0.81 0.21 0.00 0.00 175.17 174.92 1uaw n PRO 55 N 3.15 0.00 0.00 8.23 -0.05 -1.26 -4.76 135.00 140.31 1uaw n PRO 55 Ca 0.15 0.16 0.00 0.00 -0.05 0.00 0.00 63.50 63.75 1uaw n PRO 55 Cb 0.37 -1.09 0.00 0.00 -0.05 0.00 0.00 33.50 32.73 1uaw n PRO 55 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 175.50 176.92 1uaw n LEU 56 N -0.97 0.00 0.00 1.53 -0.00 -1.26 -5.08 117.00 111.22 1uaw n LEU 56 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1uaw n LEU 56 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1uaw n LEU 56 CO 0.00 0.00 0.00 1.07 -0.00 0.00 0.00 177.39 178.46 1uaw n THR 57 N -1.66 0.00 -0.89 1.47 5.66 -1.26 -5.07 114.28 112.54 1uaw n THR 57 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1uaw n THR 57 Cb 0.33 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.11 1uaw n THR 57 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 1uaw n LYS 58 N 0.00 0.21 -0.30 1.09 -0.00 -1.26 -4.83 118.16 113.07 1uaw n LYS 58 Ca 0.00 -0.45 0.01 0.00 -0.00 0.00 0.00 58.31 57.87 1uaw n LYS 58 Cb 0.00 -0.56 0.20 0.00 -0.00 0.00 0.00 35.03 34.68 1uaw n LYS 58 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.40 177.47 1uaw h ARG 59 N 0.00 1.09 -6.45 -1.58 -0.00 -1.97 -3.43 114.38 102.04 1uaw h ARG 59 Ca 0.00 -0.07 -0.45 0.00 -0.00 0.00 0.00 59.98 59.46 1uaw h ARG 59 Cb 0.80 -0.25 0.24 0.00 -0.00 0.00 0.00 29.97 30.76 1uaw h ARG 59 CO 0.00 0.72 -1.55 0.43 -0.00 0.00 0.00 179.97 179.57 1uaw n SER 60 N -4.44 -2.57 0.00 0.08 7.64 -1.26 -4.96 113.62 108.10 1uaw n SER 60 Ca 0.12 -0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1uaw n SER 60 Cb 0.10 -0.81 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 1uaw n SER 60 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1uaw n ARG 61 N -0.73 2.75 0.00 1.43 1.85 -1.26 -5.04 116.66 115.67 1uaw n ARG 61 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1uaw n ARG 61 Cb 0.65 -0.75 0.00 0.00 -1.05 0.00 0.00 32.46 31.31 1uaw n ARG 61 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1uaw n GLY 62 N 1.34 0.93 0.00 2.89 0.00 -1.26 -4.87 105.19 104.22 1uaw n GLY 62 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.26 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 0.44 -0.24 -3.88 1.61 1.16 -1.07 -1.39 117.46 114.09 1uaw n PHE 63 Ca 0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 57.45 55.54 1uaw n PHE 63 Cb 0.00 0.00 0.02 0.00 -1.61 0.00 0.00 39.48 37.89 1uaw n PHE 63 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1uaw n GLY 64 N 0.00 0.66 3.23 4.97 0.00 -0.61 -2.12 105.19 111.33 1uaw n GLY 64 Ca 0.00 -1.17 -0.19 0.00 0.00 0.00 0.00 46.02 44.66 1uaw n GLY 64 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1uaw s PHE 65 N -2.07 1.39 -0.07 1.61 0.08 0.21 -0.49 117.98 118.63 1uaw s PHE 65 Ca 0.22 -0.52 -0.14 0.00 0.12 0.00 0.00 56.93 56.61 1uaw s PHE 65 Cb -0.03 -0.74 0.03 0.00 -0.57 0.00 0.00 43.02 41.70 1uaw s PHE 65 CO 0.07 0.13 0.34 0.08 -0.10 0.00 0.00 175.22 175.74 1uaw s VAL 66 N -1.82 0.03 -0.30 -0.44 1.01 -0.53 -1.69 120.40 116.67 1uaw s VAL 66 Ca 0.06 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.82 1uaw s VAL 66 Cb -0.07 -0.57 0.16 0.00 0.00 0.00 0.00 36.38 35.90 1uaw s VAL 66 CO 0.03 -0.13 0.39 -0.89 0.00 0.00 0.00 175.10 174.50 1uaw s THR 67 N -0.58 -0.58 0.00 3.92 2.01 0.11 -0.89 115.64 119.63 1uaw s THR 67 Ca -0.07 -0.37 0.00 0.00 0.31 0.00 0.00 61.69 61.56 1uaw s THR 67 Cb -0.04 -0.95 0.00 0.00 0.01 0.00 0.00 72.50 71.52 1uaw s THR 67 CO 0.03 -0.33 0.00 2.22 -0.69 0.00 0.00 174.62 175.84 1uaw n PHE 68 N 5.26 -1.83 -2.98 4.92 1.16 -1.26 -0.62 117.46 122.11 1uaw n PHE 68 Ca 0.01 0.00 -0.14 0.00 -1.87 0.00 0.00 57.45 55.45 1uaw n PHE 68 Cb 0.49 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.34 1uaw n PHE 68 CO 0.00 0.00 0.00 -1.33 -1.87 0.00 0.00 176.76 173.56 1uaw n MET 69 N -0.61 0.57 -4.03 3.97 2.81 -1.14 -4.82 117.12 113.87 1uaw n MET 69 Ca 0.00 -2.45 -0.10 0.00 -1.81 0.00 0.00 57.70 53.34 1uaw n MET 69 Cb 0.00 -1.45 -0.06 0.00 -0.71 0.00 0.00 33.22 31.00 1uaw n MET 69 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1uaw s ASP 70 N -0.51 0.04 -0.02 7.83 2.15 -1.26 -4.97 116.67 119.92 1uaw s ASP 70 Ca 0.32 -1.05 -0.10 0.00 0.43 0.00 0.00 52.55 52.16 1uaw s ASP 70 Cb 0.11 0.57 -0.31 0.00 -0.30 0.00 0.00 42.92 43.00 1uaw s ASP 70 CO -0.15 -1.13 0.78 0.06 -0.17 0.00 0.00 175.17 174.56 1uaw h GLN 71 N 2.28 0.39 -0.06 4.34 3.07 -2.00 -3.28 115.11 119.85 1uaw h GLN 71 Ca -0.28 -0.67 0.00 0.00 0.09 0.00 0.00 58.65 57.80 1uaw h GLN 71 Cb 1.25 0.25 0.00 0.00 0.08 0.00 0.00 27.48 29.06 1uaw h GLN 71 CO 0.38 1.30 0.00 0.00 0.09 0.00 0.00 178.83 180.60 1uaw n ALA 72 N -2.79 2.57 -1.00 0.06 0.00 -1.26 -4.40 120.51 113.70 1uaw n ALA 72 Ca -0.21 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1uaw n ALA 72 Cb 1.07 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 19.31 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 0.92 -2.86 0.33 0.00 0.00 -1.24 -2.14 105.19 100.21 1uaw n GLY 73 Ca 0.15 0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.27 1uaw n GLY 73 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1uaw h VAL 74 N 0.00 0.09 -0.14 1.61 -1.51 -1.82 -0.50 116.25 113.98 1uaw h VAL 74 Ca 0.00 -0.01 0.01 0.00 -1.23 0.00 0.00 66.70 65.48 1uaw h VAL 74 Cb 0.00 0.07 -0.02 0.00 -2.13 0.00 0.00 31.29 29.21 1uaw h VAL 74 CO 0.00 0.00 -0.11 0.44 -1.23 0.00 0.00 177.57 176.68 1uaw h ASP 75 N 0.02 -0.38 -0.73 4.19 5.19 -1.76 0.26 116.42 123.21 1uaw h ASP 75 Ca 0.50 0.06 0.03 0.00 -0.62 0.00 0.00 57.03 56.99 1uaw h ASP 75 Cb 0.90 0.16 -0.04 0.00 0.18 0.00 0.00 39.33 40.54 1uaw h ASP 75 CO -0.90 -0.05 0.49 0.11 -3.12 0.00 0.00 179.24 175.76 1uaw h LYS 76 N -0.03 0.89 0.61 3.56 6.56 -0.76 -2.77 116.57 124.64 1uaw h LYS 76 Ca 0.02 -0.05 -0.02 0.00 -1.06 0.00 0.00 60.65 59.54 1uaw h LYS 76 Cb 0.09 -0.20 -0.02 0.00 -0.57 0.00 0.00 32.23 31.53 1uaw h LYS 76 CO -0.15 0.59 -0.50 0.28 -2.06 0.00 0.00 179.45 177.62 1uaw h VAL 77 N 0.92 0.02 -0.98 0.50 2.07 0.67 -1.13 116.25 118.32 1uaw h VAL 77 Ca 0.29 0.00 0.28 0.00 0.82 0.00 0.00 66.70 68.09 1uaw h VAL 77 Cb 0.01 0.02 -0.14 0.00 -1.52 0.00 0.00 31.29 29.66 1uaw h VAL 77 CO -0.08 0.00 0.52 -0.07 0.02 0.00 0.00 177.57 177.97 1uaw h LEU 78 N -1.08 0.48 -1.36 2.57 4.07 -0.40 1.02 115.31 120.61 1uaw h LEU 78 Ca -0.08 0.18 0.40 0.00 0.08 0.00 0.00 57.88 58.46 1uaw h LEU 78 Cb 0.91 0.13 -0.13 0.00 1.08 0.00 0.00 40.66 42.65 1uaw h LEU 78 CO 0.00 -0.07 0.80 0.00 -1.08 0.00 0.00 178.44 178.09 1uaw h ALA 79 N 1.80 2.60 -0.78 1.53 0.00 -0.93 2.37 119.26 125.85 1uaw h ALA 79 Ca 0.68 0.12 -0.34 0.00 0.00 0.00 0.00 54.91 55.36 1uaw h ALA 79 Cb 1.45 0.18 -0.21 0.00 0.00 0.00 0.00 17.79 19.21 1uaw h ALA 79 CO -0.57 -1.20 0.39 1.04 0.00 0.00 0.00 179.25 178.91 1uaw n GLN 80 N -4.72 2.72 0.23 0.00 1.13 0.35 -4.59 117.38 112.50 1uaw n GLN 80 Ca 0.35 -3.06 0.11 0.00 -1.94 0.00 0.00 57.00 52.46 1uaw n GLN 80 Cb 1.32 -2.13 0.40 0.00 0.11 0.00 0.00 30.24 29.94 1uaw n GLN 80 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1uaw h SER 81 N 1.60 0.00 0.00 1.08 4.64 0.41 1.38 113.55 122.67 1uaw h SER 81 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 1uaw h SER 81 Cb 2.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.55 1uaw h SER 81 CO 0.84 0.00 -1.66 -2.11 -0.87 0.00 0.00 176.83 173.03 1uaw n ARG 82 N -2.85 0.51 -1.10 4.77 1.85 -1.26 -3.71 116.66 114.87 1uaw n ARG 82 Ca 0.03 -0.13 0.11 0.00 -1.00 0.00 0.00 57.85 56.86 1uaw n ARG 82 Cb 0.84 -1.36 -0.05 0.00 -1.05 0.00 0.00 32.46 30.85 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 -2.00 -2.38 0.00 2.89 -0.00 0.47 -1.96 115.22 112.24 1uaw n HIS 83 Ca -0.03 1.28 0.00 0.00 0.46 0.00 0.00 57.72 59.43 1uaw n HIS 83 Cb 0.39 -2.16 0.00 0.00 -0.12 0.00 0.00 29.99 28.10 1uaw n HIS 83 CO 0.00 0.00 0.00 -1.91 0.46 0.00 0.00 176.34 174.89 1uaw n GLU 84 N -3.63 0.00 0.00 1.57 2.13 -1.17 -3.82 120.64 115.72 1uaw n GLU 84 Ca -0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.78 1uaw n GLU 84 Cb 0.53 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.24 1uaw n GLU 84 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1uaw n LEU 85 N 0.00 0.00 -2.59 4.31 7.99 -0.98 -4.90 117.00 120.83 1uaw n LEU 85 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 56.01 55.75 1uaw n LEU 85 Cb 0.00 0.00 -0.09 0.00 -0.11 0.00 0.00 43.42 43.22 1uaw n LEU 85 CO 0.00 0.00 2.05 0.47 -1.51 0.00 0.00 177.39 178.40 1uaw n ASP 86 N -0.35 6.64 0.00 -1.43 9.92 -1.26 -4.50 116.55 125.57 1uaw n ASP 86 Ca 0.00 -2.79 0.00 0.00 -0.53 0.00 0.00 54.79 51.47 1uaw n ASP 86 Cb 0.00 -1.39 0.00 0.00 -0.64 0.00 0.00 41.12 39.09 1uaw n ASP 86 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 1uaw n SER 87 N 2.14 -4.18 -4.44 -2.24 2.88 -1.26 -4.97 113.62 101.54 1uaw n SER 87 Ca 0.54 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.72 1uaw n SER 87 Cb 0.59 -1.79 -0.13 0.00 -0.75 0.00 0.00 64.21 62.14 1uaw n SER 87 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1uaw s LYS 88 N -0.86 3.64 -1.14 -1.46 -0.14 -1.26 -5.03 119.74 113.48 1uaw s LYS 88 Ca 0.00 -0.49 -0.09 0.00 -1.36 0.00 0.00 55.97 54.02 1uaw s LYS 88 Cb 0.00 -3.22 0.26 0.00 -1.68 0.00 0.00 37.83 33.18 1uaw s LYS 88 CO 0.00 -0.11 1.26 -2.37 -0.76 0.00 0.00 175.35 173.37 1uaw n THR 89 N 4.65 4.59 -0.38 2.17 5.66 -1.26 -2.31 114.28 127.41 1uaw n THR 89 Ca -0.17 -5.27 -0.08 0.00 -3.05 0.00 0.00 64.05 55.48 1uaw n THR 89 Cb 0.51 -2.49 0.08 0.00 -1.55 0.00 0.00 70.33 66.88 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 2.96 0.00 -3.37 1.09 5.41 -0.83 -4.61 119.36 120.01 1uaw n ILE 90 Ca 0.28 0.00 -0.26 0.00 1.00 0.00 0.00 62.75 63.76 1uaw n ILE 90 Cb 0.39 -0.27 -0.10 0.00 -0.71 0.00 0.00 39.64 38.96 1uaw n ILE 90 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1uaw n ASP 91 N -0.63 -0.27 -4.53 4.38 -0.08 0.20 -3.52 116.55 112.10 1uaw n ASP 91 Ca 0.04 -2.45 -0.49 0.00 -1.51 0.00 0.00 54.79 50.37 1uaw n ASP 91 Cb 0.16 -0.57 -0.06 0.00 2.34 0.00 0.00 41.12 42.99 1uaw n ASP 91 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1uaw n PRO 92 N 2.55 1.46 -3.91 -0.67 -0.04 -1.24 -2.61 135.00 130.53 1uaw n PRO 92 Ca 0.28 0.44 -0.33 0.00 -0.04 0.00 0.00 63.50 63.85 1uaw n PRO 92 Cb 0.49 -2.63 -0.13 0.00 -0.04 0.00 0.00 33.50 31.18 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 5.69 1.71 0.25 0.54 0.00 0.56 -4.78 119.74 123.72 1uaw s LYS 93 Ca 1.04 -1.87 0.01 0.00 0.00 0.00 0.00 55.97 55.15 1uaw s LYS 93 Cb -0.74 -3.37 -0.04 0.00 0.00 0.00 0.00 37.83 33.68 1uaw s LYS 93 CO 0.48 -1.00 0.42 0.08 0.00 0.00 0.00 175.35 175.33 1uaw s VAL 94 N 0.98 5.19 -0.24 1.79 1.01 -1.26 -2.05 120.40 125.81 1uaw s VAL 94 Ca 0.10 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 1uaw s VAL 94 Cb -0.21 -3.80 0.07 0.00 0.00 0.00 0.00 36.38 32.45 1uaw s VAL 94 CO -0.06 -0.31 0.04 0.00 0.00 0.00 0.00 175.10 174.76 1uaw s ALA 95 N -2.01 1.43 -2.02 5.51 0.00 -1.24 -4.98 121.76 118.43 1uaw s ALA 95 Ca 0.38 -1.20 0.32 0.00 0.00 0.00 0.00 51.96 51.45 1uaw s ALA 95 Cb -0.10 -1.40 1.87 0.00 0.00 0.00 0.00 23.12 23.49 1uaw s ALA 95 CO 0.31 -1.35 2.21 0.34 0.00 0.00 0.00 175.76 177.26