#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 0.67 0.25 0.00 -2.85 -1.26 -4.85 119.74 111.71 1uaw s LYS 21 Ca 0.00 -0.96 -0.04 0.00 -1.00 0.00 0.00 55.97 53.97 1uaw s LYS 21 Cb 0.00 -0.38 0.06 0.00 -2.06 0.00 0.00 37.83 35.45 1uaw s LYS 21 CO 0.00 0.06 0.25 -1.33 0.10 0.00 0.00 175.35 174.43 1uaw n MET 22 N 1.01 -1.10 -3.73 1.78 2.81 0.54 -4.80 117.12 113.62 1uaw n MET 22 Ca -0.19 -0.40 -0.14 0.00 -1.81 0.00 0.00 57.70 55.16 1uaw n MET 22 Cb 0.56 -0.34 -0.09 0.00 -0.71 0.00 0.00 33.22 32.65 1uaw n MET 22 CO 0.00 0.00 0.00 0.12 1.51 0.00 0.00 175.97 177.60 1uaw s PHE 23 N -1.49 -0.33 -0.14 2.03 5.36 -0.96 -2.33 117.98 120.12 1uaw s PHE 23 Ca 0.16 0.70 0.02 0.00 -0.96 0.00 0.00 56.93 56.84 1uaw s PHE 23 Cb -0.01 0.14 0.00 0.00 -0.34 0.00 0.00 43.02 42.82 1uaw s PHE 23 CO 0.12 -0.32 -0.20 0.42 -1.46 0.00 0.00 175.22 173.78 1uaw s ILE 24 N -0.61 2.31 0.25 3.12 -1.09 0.52 -1.17 121.20 124.53 1uaw s ILE 24 Ca -0.07 -0.90 0.08 0.00 -2.23 0.00 0.00 60.65 57.53 1uaw s ILE 24 Cb -0.04 -1.94 -0.04 0.00 -1.58 0.00 0.00 42.46 38.87 1uaw s ILE 24 CO 0.03 0.54 0.08 -0.83 -1.23 0.00 0.00 174.94 173.53 1uaw s GLY 25 N 0.70 1.56 -1.50 6.18 0.00 -1.19 -1.44 107.32 111.62 1uaw s GLY 25 Ca -0.09 -1.53 -0.13 0.00 0.00 0.00 0.00 44.72 42.97 1uaw s GLY 25 CO 0.01 -1.59 1.02 0.61 0.00 0.00 0.00 173.10 173.15 1uaw n GLY 26 N -0.96 -0.50 3.81 0.20 0.00 -1.20 0.18 105.19 106.71 1uaw n GLY 26 Ca -0.07 0.20 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 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 -7.28 4.40 0.09 0.99 2.34 -0.89 -1.92 118.68 116.41 1uaw s LEU 27 Ca 0.64 1.46 -0.33 0.00 0.06 0.00 0.00 54.13 55.96 1uaw s LEU 27 Cb -0.32 -3.50 -0.18 0.00 -0.56 0.00 0.00 46.19 41.64 1uaw s LEU 27 CO 0.81 0.08 0.78 -1.20 -1.06 0.00 0.00 176.35 175.76 1uaw n SER 28 N 0.94 -0.59 -0.09 1.48 7.64 -1.26 -4.50 113.62 117.24 1uaw n SER 28 Ca -0.03 1.11 -0.09 0.00 1.01 0.00 0.00 58.87 60.87 1uaw n SER 28 Cb 0.51 -0.91 0.06 0.00 -1.01 0.00 0.00 64.21 62.86 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 1.98 0.92 0.00 1.43 5.08 -1.93 -2.36 115.95 121.07 1uaw h TRP 29 Ca -0.39 -0.23 0.00 0.00 1.08 0.00 0.00 58.89 59.36 1uaw h TRP 29 Cb 1.39 -0.21 0.00 0.00 -3.00 0.00 0.00 29.16 27.34 1uaw h TRP 29 CO 0.48 0.98 0.00 0.00 -1.28 0.00 0.00 178.44 178.62 1uaw n GLN 30 N -4.09 0.74 -1.84 0.12 10.64 -1.26 -4.82 117.38 116.86 1uaw n GLN 30 Ca -0.00 0.00 -0.34 0.00 -1.83 0.00 0.00 57.00 54.83 1uaw n GLN 30 Cb 0.46 -1.49 0.04 0.00 -0.86 0.00 0.00 30.24 28.39 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 -2.00 3.16 0.21 -0.39 2.01 -0.89 -5.05 115.64 112.68 1uaw s THR 31 Ca 0.35 0.58 0.01 0.00 0.31 0.00 0.00 61.69 62.93 1uaw s THR 31 Cb 0.16 -3.12 -0.00 0.00 0.01 0.00 0.00 72.50 69.55 1uaw s THR 31 CO 0.27 -0.30 0.02 1.07 -0.69 0.00 0.00 174.62 174.99 1uaw n THR 32 N -2.19 0.00 0.00 -0.82 5.66 -1.26 -5.01 114.28 110.65 1uaw n THR 32 Ca 0.11 -1.04 0.00 0.00 -3.05 0.00 0.00 64.05 60.06 1uaw n THR 32 Cb 0.52 0.27 0.00 0.00 -1.55 0.00 0.00 70.33 69.56 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 -0.50 0.00 -0.19 1.09 6.02 -1.26 -1.69 117.38 120.85 1uaw n GLN 33 Ca -0.07 0.34 -0.02 0.00 -0.01 0.00 0.00 57.00 57.25 1uaw n GLN 33 Cb 0.28 -1.04 0.05 0.00 1.02 0.00 0.00 30.24 30.55 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 -0.00 -0.97 -1.09 4.81 -1.97 2.41 114.58 117.77 1uaw h GLU 34 Ca 0.00 0.00 0.28 0.00 -0.13 0.00 0.00 59.36 59.51 1uaw h GLU 34 Cb 0.00 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.34 1uaw h GLU 34 CO 0.00 -0.00 0.74 0.78 -0.73 0.00 0.00 179.01 179.80 1uaw h GLY 35 N -0.00 0.00 1.27 1.92 0.00 -1.98 1.46 103.07 105.74 1uaw h GLY 35 Ca 0.28 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.29 1uaw h GLY 35 CO -0.60 0.00 -1.49 -2.00 0.00 0.00 0.00 176.54 172.44 1uaw h LEU 36 N 0.00 0.65 -2.22 3.11 5.85 0.47 -0.08 115.31 123.10 1uaw h LEU 36 Ca 0.46 -0.76 0.03 0.00 0.84 0.00 0.00 57.88 58.45 1uaw h LEU 36 Cb 1.94 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.75 1uaw h LEU 36 CO -0.00 1.61 0.09 0.03 -0.34 0.00 0.00 178.44 179.82 1uaw h ARG 37 N 0.11 0.00 0.00 1.25 3.08 0.66 0.57 114.38 120.05 1uaw h ARG 37 Ca -0.25 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.76 1uaw h ARG 37 Cb 2.10 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 32.14 1uaw h ARG 37 CO 0.23 0.00 -1.02 0.93 -1.07 0.00 0.00 179.97 179.03 1uaw h GLU 38 N 0.00 0.00 0.00 0.04 5.08 -0.06 0.14 114.58 119.78 1uaw h GLU 38 Ca 0.04 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.33 1uaw h GLU 38 Cb 0.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1uaw h GLU 38 CO -0.00 0.07 -0.36 -0.92 -1.00 0.00 0.00 179.01 176.80 1uaw h TYR 39 N 0.00 0.00 0.00 4.33 5.03 0.21 -3.03 116.97 123.51 1uaw h TYR 39 Ca -0.04 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.27 1uaw h TYR 39 Cb 1.13 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.41 1uaw h TYR 39 CO 0.00 0.36 -0.99 1.19 -1.32 0.00 0.00 178.16 177.40 1uaw n PHE 40 N -3.99 0.00 0.45 -3.82 3.72 -0.83 -4.49 117.46 108.50 1uaw n PHE 40 Ca -0.02 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.48 1uaw n PHE 40 Cb 0.41 -0.05 0.41 0.00 -0.94 0.00 0.00 39.48 39.31 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 2.19 -1.16 0.11 1.37 0.00 0.49 0.13 105.19 108.31 1uaw n GLY 41 Ca -0.00 0.02 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 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 0.27 -0.01 1.61 4.15 -1.75 -3.28 115.11 116.10 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 0.32 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.96 1uaw h GLN 42 CO 0.00 0.29 0.00 1.97 -1.93 0.00 0.00 178.83 179.16 1uaw n PHE 43 N -4.88 0.02 -3.16 3.99 1.16 -1.13 -4.93 117.46 108.53 1uaw n PHE 43 Ca -0.04 -0.39 0.03 0.00 -1.87 0.00 0.00 57.45 55.18 1uaw n PHE 43 Cb 0.09 -0.04 -0.00 0.00 -1.61 0.00 0.00 39.48 37.92 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 -0.80 -1.22 0.47 4.97 0.00 0.12 -3.47 107.32 107.40 1uaw s GLY 44 Ca 0.01 1.00 -0.19 0.00 0.00 0.00 0.00 44.72 45.53 1uaw s GLY 44 CO 0.01 3.64 0.04 -1.84 0.00 0.00 0.00 173.10 174.95 1uaw n GLU 45 N 5.41 0.08 -4.54 2.90 0.28 -1.26 -2.94 120.64 120.58 1uaw n GLU 45 Ca 0.05 0.03 -0.27 0.00 -0.16 0.00 0.00 57.16 56.81 1uaw n GLU 45 Cb 0.54 -1.10 -0.14 0.00 1.43 0.00 0.00 31.44 32.17 1uaw n GLU 45 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1uaw s VAL 46 N -1.85 1.93 -0.15 3.84 1.01 -1.26 -2.71 120.40 121.21 1uaw s VAL 46 Ca 0.59 -1.47 0.09 0.00 0.00 0.00 0.00 61.98 61.20 1uaw s VAL 46 Cb -0.54 -1.70 -0.16 0.00 0.00 0.00 0.00 36.38 33.98 1uaw s VAL 46 CO 0.63 0.14 -0.01 0.29 0.00 0.00 0.00 175.10 176.16 1uaw n LYS 47 N 1.40 1.38 -3.56 2.72 5.02 -1.26 -4.91 118.16 118.96 1uaw n LYS 47 Ca -0.18 0.02 -0.11 0.00 -2.02 0.00 0.00 58.31 56.02 1uaw n LYS 47 Cb 0.53 -1.36 -0.05 0.00 -0.02 0.00 0.00 35.03 34.14 1uaw n LYS 47 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1uaw s GLU 48 N -2.34 0.69 0.21 1.97 2.12 -1.26 -5.02 118.70 115.07 1uaw s GLU 48 Ca -0.11 0.07 -0.12 0.00 0.36 0.00 0.00 54.97 55.16 1uaw s GLU 48 Cb 0.05 0.32 -0.00 0.00 0.26 0.00 0.00 34.13 34.76 1uaw s GLU 48 CO 0.53 -0.24 0.41 0.00 -0.54 0.00 0.00 175.26 175.42 1uaw s LEU 50 N -2.98 0.82 -0.12 0.00 0.05 0.42 -4.90 118.68 111.97 1uaw s LEU 50 Ca 0.19 0.01 0.01 0.00 0.05 0.00 0.00 54.13 54.38 1uaw s LEU 50 Cb 0.01 -0.19 -0.01 0.00 -2.05 0.00 0.00 46.19 43.95 1uaw s LEU 50 CO 0.04 -0.16 -0.15 -0.69 -0.55 0.00 0.00 176.35 174.84 1uaw s VAL 51 N 1.44 2.88 0.05 1.48 1.01 -1.26 0.39 120.40 126.39 1uaw s VAL 51 Ca -0.04 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.25 1uaw s VAL 51 Cb -0.13 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 1uaw s VAL 51 CO -0.03 0.53 -0.12 -0.32 0.00 0.00 0.00 175.10 175.17 1uaw s MET 52 N 0.30 0.75 0.00 2.72 0.00 -1.07 -4.99 119.30 117.01 1uaw s MET 52 Ca -0.11 -0.80 0.00 0.00 0.00 0.00 0.00 55.69 54.78 1uaw s MET 52 Cb -0.16 -0.69 0.00 0.00 0.00 0.00 0.00 34.83 33.98 1uaw s MET 52 CO 0.06 0.16 0.00 -2.13 0.00 0.00 0.00 175.02 173.11 1uaw n ARG 53 N 1.61 0.00 -3.64 4.11 0.63 -1.26 -2.48 116.66 115.63 1uaw n ARG 53 Ca -0.20 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.44 1uaw n ARG 53 Cb 0.55 0.00 -0.13 0.00 0.45 0.00 0.00 32.46 33.33 1uaw n ARG 53 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1uaw s ASP 54 N 1.00 3.39 0.08 6.15 1.01 -1.26 -4.08 116.67 122.96 1uaw s ASP 54 Ca 0.00 -2.58 -0.24 0.00 0.71 0.00 0.00 52.55 50.43 1uaw s ASP 54 Cb 0.00 -0.86 -0.16 0.00 1.01 0.00 0.00 42.92 42.91 1uaw s ASP 54 CO 0.00 -0.27 1.69 1.55 0.21 0.00 0.00 175.17 178.35 1uaw h PRO 55 N 6.69 -0.09 0.00 8.23 0.13 -1.98 -3.36 132.00 141.63 1uaw h PRO 55 Ca 0.03 0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.11 1uaw h PRO 55 Cb 0.93 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.07 1uaw h PRO 55 CO 0.43 -0.03 -0.67 -0.07 -0.23 0.00 0.00 178.00 177.44 1uaw h LEU 56 N -0.13 0.00 0.00 1.56 3.38 -2.01 -3.49 115.31 114.62 1uaw h LEU 56 Ca -0.01 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1uaw h LEU 56 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1uaw h LEU 56 CO 0.02 0.91 0.00 1.07 0.09 0.00 0.00 178.44 180.53 1uaw n THR 57 N -4.58 0.00 -1.33 0.22 5.66 -1.26 -5.01 114.28 107.98 1uaw n THR 57 Ca -0.13 0.00 -0.00 0.00 -3.05 0.00 0.00 64.05 60.87 1uaw n THR 57 Cb 0.35 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 69.13 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 -1.95 0.00 0.07 1.09 -0.00 -1.26 -4.78 118.16 111.33 1uaw n LYS 58 Ca 0.00 -0.07 -0.06 0.00 -0.00 0.00 0.00 58.31 58.18 1uaw n LYS 58 Cb 0.00 0.16 -0.09 0.00 -0.00 0.00 0.00 35.03 35.10 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 0.00 0.00 -1.58 -0.00 -1.95 -3.45 114.38 107.40 1uaw h ARG 59 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.94 1uaw h ARG 59 Cb 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.33 1uaw h ARG 59 CO -0.02 0.96 0.00 0.45 -0.00 0.00 0.00 179.97 181.36 1uaw n SER 60 N -3.39 0.00 0.00 0.08 2.88 -1.26 -5.01 113.62 106.92 1uaw n SER 60 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1uaw n SER 60 Cb 0.91 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.37 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 1.22 -0.53 -1.46 1.74 -1.26 -5.05 116.66 111.32 1uaw n ARG 61 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1uaw n ARG 61 Cb 0.00 -0.65 0.00 0.00 -1.02 0.00 0.00 32.46 30.79 1uaw n ARG 61 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uaw n GLY 62 N 1.23 -0.88 0.97 -0.13 0.00 -1.25 -4.79 105.19 100.34 1uaw n GLY 62 Ca 0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.03 -0.89 -3.66 1.61 1.16 -1.03 -2.09 117.46 112.53 1uaw n PHE 63 Ca 0.00 -0.63 -0.07 0.00 -1.87 0.00 0.00 57.45 54.88 1uaw n PHE 63 Cb 0.00 0.18 -0.09 0.00 -1.61 0.00 0.00 39.48 37.97 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 -1.60 -0.42 0.34 4.97 0.00 -0.52 -2.60 107.32 107.49 1uaw s GLY 64 Ca 0.07 1.65 -0.17 0.00 0.00 0.00 0.00 44.72 46.27 1uaw s GLY 64 CO 0.05 2.51 0.80 -1.36 0.00 0.00 0.00 173.10 175.10 1uaw s PHE 65 N 2.64 3.39 -0.21 1.90 0.08 0.16 -0.36 117.98 125.59 1uaw s PHE 65 Ca -0.03 1.36 -0.04 0.00 0.12 0.00 0.00 56.93 58.34 1uaw s PHE 65 Cb -0.12 -2.64 0.10 0.00 -0.57 0.00 0.00 43.02 39.79 1uaw s PHE 65 CO -0.14 0.06 0.35 0.08 -0.10 0.00 0.00 175.22 175.47 1uaw s VAL 66 N -1.99 -0.55 -2.00 -0.44 1.01 -0.98 -0.44 120.40 115.01 1uaw s VAL 66 Ca 0.55 0.05 0.19 0.00 0.00 0.00 0.00 61.98 62.77 1uaw s VAL 66 Cb -0.11 -0.69 0.54 0.00 0.00 0.00 0.00 36.38 36.12 1uaw s VAL 66 CO 0.17 -0.04 1.73 1.07 0.00 0.00 0.00 175.10 178.03 1uaw n THR 67 N 5.36 0.00 -1.12 3.92 5.66 0.40 -0.34 114.28 128.17 1uaw n THR 67 Ca -0.06 -0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.59 1uaw n THR 67 Cb 0.50 -0.29 0.07 0.00 -1.55 0.00 0.00 70.33 69.06 1uaw n THR 67 CO 0.00 0.00 0.00 2.22 -3.05 0.00 0.00 175.07 174.24 1uaw n PHE 68 N -0.79 -1.63 -3.23 1.09 -1.74 -1.26 -4.61 117.46 105.29 1uaw n PHE 68 Ca 0.14 0.29 0.04 0.00 -0.56 0.00 0.00 57.45 57.36 1uaw n PHE 68 Cb 0.07 -1.81 -0.02 0.00 1.52 0.00 0.00 39.48 39.23 1uaw n PHE 68 CO 0.00 0.00 0.00 1.41 -0.56 0.00 0.00 176.76 177.61 1uaw s MET 69 N -2.74 0.28 0.23 3.97 1.75 -1.10 -4.70 119.30 116.99 1uaw s MET 69 Ca 0.60 0.56 0.03 0.00 -1.25 0.00 0.00 55.69 55.63 1uaw s MET 69 Cb -0.31 0.32 -0.05 0.00 2.84 0.00 0.00 34.83 37.63 1uaw s MET 69 CO 0.64 -0.23 0.01 0.34 -0.65 0.00 0.00 175.02 175.13 1uaw s ASP 70 N 2.77 1.70 0.00 1.11 2.15 -1.26 -4.79 116.67 118.35 1uaw s ASP 70 Ca 0.02 -1.24 0.00 0.00 0.43 0.00 0.00 52.55 51.76 1uaw s ASP 70 Cb -0.10 0.04 0.00 0.00 -0.30 0.00 0.00 42.92 42.56 1uaw s ASP 70 CO -0.15 -0.55 0.93 0.00 -0.17 0.00 0.00 175.17 175.24 1uaw n GLN 71 N -0.41 0.00 0.00 4.34 3.00 -1.26 -1.74 117.38 121.31 1uaw n GLN 71 Ca -0.05 0.86 0.13 0.00 -0.01 0.00 0.00 57.00 57.94 1uaw n GLN 71 Cb 0.64 -1.43 0.47 0.00 0.00 0.00 0.00 30.24 29.91 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 -2.60 2.94 -0.76 -1.58 0.00 -1.26 -4.47 120.51 112.78 1uaw n ALA 72 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.08 1uaw n ALA 72 Cb 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.24 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 1.31 -3.28 0.36 0.00 0.00 -0.71 -0.67 105.19 102.20 1uaw n GLY 73 Ca 0.13 0.46 0.02 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 0.04 -0.54 1.61 2.07 -1.78 0.29 116.25 117.93 1uaw h VAL 74 Ca 0.00 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.62 1uaw h VAL 74 Cb 0.00 0.04 -0.11 0.00 -1.52 0.00 0.00 31.29 29.70 1uaw h VAL 74 CO 0.00 0.00 -0.28 0.44 0.02 0.00 0.00 177.57 177.75 1uaw h ASP 75 N -0.01 -0.95 -0.17 0.57 5.19 -1.67 0.51 116.42 119.87 1uaw h ASP 75 Ca 0.40 0.20 -0.10 0.00 -0.62 0.00 0.00 57.03 56.92 1uaw h ASP 75 Cb 0.65 0.49 -0.02 0.00 0.18 0.00 0.00 39.33 40.64 1uaw h ASP 75 CO -0.96 -0.28 -0.20 0.11 -3.12 0.00 0.00 179.24 174.79 1uaw h LYS 76 N -0.14 0.61 0.00 3.56 6.56 0.18 -2.57 116.57 124.76 1uaw h LYS 76 Ca 0.24 -0.22 0.00 0.00 -1.06 0.00 0.00 60.65 59.60 1uaw h LYS 76 Cb 0.52 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.14 1uaw h LYS 76 CO -0.62 0.77 0.00 0.28 -2.06 0.00 0.00 179.45 177.82 1uaw n VAL 77 N -4.14 0.00 -0.35 0.50 0.31 0.20 -1.82 118.33 113.03 1uaw n VAL 77 Ca 0.00 1.36 0.25 0.00 -0.01 0.00 0.00 64.34 65.94 1uaw n VAL 77 Cb 0.39 -2.22 0.51 0.00 -0.91 0.00 0.00 33.84 31.61 1uaw n VAL 77 CO 0.00 0.00 0.00 0.17 -1.32 0.00 0.00 176.83 175.68 1uaw h LEU 78 N 0.00 0.45 -1.90 7.52 8.10 -1.50 2.07 115.31 130.06 1uaw h LEU 78 Ca 0.00 0.12 0.14 0.00 0.11 0.00 0.00 57.88 58.25 1uaw h LEU 78 Cb 0.00 0.06 -0.02 0.00 -0.44 0.00 0.00 40.66 40.26 1uaw h LEU 78 CO 0.00 -0.00 0.52 0.00 -4.11 0.00 0.00 178.44 174.85 1uaw h ALA 79 N 1.67 2.21 -0.68 0.17 0.00 -0.93 1.27 119.26 122.98 1uaw h ALA 79 Ca 0.67 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 55.30 1uaw h ALA 79 Cb 1.71 0.04 -0.16 0.00 0.00 0.00 0.00 17.79 19.38 1uaw h ALA 79 CO -0.40 -0.77 0.27 1.04 0.00 0.00 0.00 179.25 179.39 1uaw n GLN 80 N -3.67 2.90 0.20 0.00 1.13 0.70 -4.54 117.38 114.10 1uaw n GLN 80 Ca 0.09 -3.07 0.10 0.00 -1.94 0.00 0.00 57.00 52.18 1uaw n GLN 80 Cb 0.71 -2.09 0.52 0.00 0.11 0.00 0.00 30.24 29.49 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 1.83 0.00 -0.20 1.08 0.87 0.17 1.15 113.55 118.45 1uaw h SER 81 Ca 0.32 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.88 1uaw h SER 81 Cb 2.24 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 64.20 1uaw h SER 81 CO 0.71 0.00 0.00 -2.11 -0.53 0.00 0.00 176.83 174.90 1uaw n ARG 82 N -2.27 2.40 0.00 2.24 1.85 -1.25 -3.78 116.66 115.85 1uaw n ARG 82 Ca -0.01 -1.72 0.00 0.00 -1.00 0.00 0.00 57.85 55.12 1uaw n ARG 82 Cb 0.25 -1.18 0.00 0.00 -1.05 0.00 0.00 32.46 30.48 1uaw n ARG 82 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1uaw n HIS 83 N 0.25 0.00 -2.07 2.89 8.25 0.40 -4.53 115.22 120.40 1uaw n HIS 83 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 1uaw n HIS 83 Cb 0.34 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.45 1uaw n HIS 83 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1uaw n GLU 84 N -0.13 -5.60 0.00 -0.41 2.13 -1.16 -4.87 120.64 110.59 1uaw n GLU 84 Ca 0.00 3.96 0.00 0.00 0.66 0.00 0.00 57.16 61.78 1uaw n GLU 84 Cb 0.00 -4.32 0.00 0.00 0.27 0.00 0.00 31.44 27.39 1uaw n GLU 84 CO 0.00 0.00 0.00 1.47 -0.41 0.00 0.00 177.13 178.19 1uaw n LEU 85 N 1.63 0.00 -2.42 4.31 -0.00 -1.07 -4.93 117.00 114.52 1uaw n LEU 85 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 56.01 55.76 1uaw n LEU 85 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.43 1uaw n LEU 85 CO 0.00 0.00 0.16 -0.67 -0.00 0.00 0.00 177.39 176.88 1uaw n ASP 86 N -1.28 4.44 0.00 1.45 2.03 -1.26 -4.83 116.55 117.11 1uaw n ASP 86 Ca 0.00 -3.62 0.00 0.00 0.52 0.00 0.00 54.79 51.69 1uaw n ASP 86 Cb 0.00 -0.44 0.00 0.00 -0.72 0.00 0.00 41.12 39.96 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 -0.49 -0.51 -4.19 1.67 2.88 -1.26 -4.96 113.62 106.76 1uaw n SER 87 Ca 0.37 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.57 1uaw n SER 87 Cb 0.73 -0.78 -0.15 0.00 -0.75 0.00 0.00 64.21 63.26 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 -0.32 3.09 -1.20 -1.46 -0.14 -1.26 -5.04 119.74 113.41 1uaw s LYS 88 Ca 0.00 -0.79 -0.11 0.00 -1.36 0.00 0.00 55.97 53.71 1uaw s LYS 88 Cb 0.00 -2.75 0.20 0.00 -1.68 0.00 0.00 37.83 33.60 1uaw s LYS 88 CO 0.00 -0.23 1.44 -2.37 -0.76 0.00 0.00 175.35 173.43 1uaw n THR 89 N 4.68 4.40 -0.98 2.17 5.66 -1.26 -2.61 114.28 126.35 1uaw n THR 89 Ca -0.20 -4.89 -0.38 0.00 -3.05 0.00 0.00 64.05 55.53 1uaw n THR 89 Cb 0.50 -2.45 0.04 0.00 -1.55 0.00 0.00 70.33 66.87 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 3.80 0.00 -3.26 1.09 2.08 -0.81 -4.59 119.36 117.66 1uaw n ILE 90 Ca 0.34 -0.12 -0.25 0.00 0.56 0.00 0.00 62.75 63.28 1uaw n ILE 90 Cb 0.40 -0.05 -0.07 0.00 -0.75 0.00 0.00 39.64 39.17 1uaw n ILE 90 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1uaw n ASP 91 N 3.09 1.42 -4.50 4.38 -0.08 0.48 -3.79 116.55 117.55 1uaw n ASP 91 Ca -0.02 -2.96 -0.53 0.00 -1.51 0.00 0.00 54.79 49.77 1uaw n ASP 91 Cb 0.71 -0.65 -0.07 0.00 2.34 0.00 0.00 41.12 43.44 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 1.18 1.07 -3.90 -0.67 -0.04 -1.26 -3.18 135.00 128.18 1uaw n PRO 92 Ca 0.24 0.33 -0.30 0.00 -0.04 0.00 0.00 63.50 63.73 1uaw n PRO 92 Cb 0.49 -2.31 -0.16 0.00 -0.04 0.00 0.00 33.50 31.49 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 5.48 1.41 0.20 0.54 0.00 -0.32 -4.29 119.74 122.77 1uaw s LYS 93 Ca 1.07 -1.02 -0.02 0.00 0.00 0.00 0.00 55.97 56.00 1uaw s LYS 93 Cb -0.95 -2.53 -0.05 0.00 0.00 0.00 0.00 37.83 34.30 1uaw s LYS 93 CO 0.54 -0.68 0.41 0.08 0.00 0.00 0.00 175.35 175.71 1uaw s VAL 94 N 1.42 5.17 -2.00 1.79 1.01 -1.26 -2.27 120.40 124.27 1uaw s VAL 94 Ca -0.02 -0.24 0.23 0.00 0.00 0.00 0.00 61.98 61.95 1uaw s VAL 94 Cb -0.19 -3.71 0.66 0.00 0.00 0.00 0.00 36.38 33.14 1uaw s VAL 94 CO -0.09 -0.15 1.87 0.00 0.00 0.00 0.00 175.10 176.72 1uaw n ALA 95 N -0.56 2.59 0.11 5.51 0.00 -1.26 -4.99 120.51 121.91 1uaw n ALA 95 Ca -0.04 -0.15 0.01 0.00 0.00 0.00 0.00 53.44 53.27 1uaw n ALA 95 Cb 0.53 -1.38 0.01 0.00 0.00 0.00 0.00 19.45 18.62 1uaw n ALA 95 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69