#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 2.27 0.00 0.00 -2.85 -1.26 -4.69 119.74 113.20 1uaw s LYS 21 Ca 0.00 1.45 0.00 0.00 -1.00 0.00 0.00 55.97 56.42 1uaw s LYS 21 Cb 0.00 -1.88 0.00 0.00 -2.06 0.00 0.00 37.83 33.89 1uaw s LYS 21 CO 0.00 -1.68 0.00 0.00 0.10 0.00 0.00 175.35 173.77 1uaw n MET 22 N -2.99 0.32 -3.75 1.78 0.00 0.37 -4.67 117.12 108.18 1uaw n MET 22 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 57.70 57.68 1uaw n MET 22 Cb 0.52 0.00 -0.08 0.00 0.00 0.00 0.00 33.22 33.66 1uaw n MET 22 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 175.97 176.09 1uaw s PHE 23 N -0.37 -0.16 -0.10 3.17 2.19 -0.94 -1.89 117.98 119.88 1uaw s PHE 23 Ca 0.00 0.16 0.01 0.00 0.33 0.00 0.00 56.93 57.43 1uaw s PHE 23 Cb 0.00 0.10 -0.02 0.00 -1.31 0.00 0.00 43.02 41.79 1uaw s PHE 23 CO 0.00 -0.44 -0.12 0.42 1.83 0.00 0.00 175.22 176.90 1uaw s ILE 24 N -1.85 3.17 -0.13 3.12 1.09 0.11 -1.26 121.20 125.44 1uaw s ILE 24 Ca -0.10 -0.65 -0.06 0.00 -1.10 0.00 0.00 60.65 58.74 1uaw s ILE 24 Cb -0.03 -2.30 -0.04 0.00 -1.06 0.00 0.00 42.46 39.03 1uaw s ILE 24 CO 0.01 0.55 0.09 -0.83 -0.10 0.00 0.00 174.94 174.66 1uaw s GLY 25 N -0.15 2.02 -1.40 6.18 0.00 -1.14 -2.19 107.32 110.64 1uaw s GLY 25 Ca -0.00 -0.71 -0.10 0.00 0.00 0.00 0.00 44.72 43.91 1uaw s GLY 25 CO 0.03 -0.28 1.12 0.61 0.00 0.00 0.00 173.10 174.58 1uaw n GLY 26 N 2.50 -0.54 3.71 0.20 0.00 -0.90 -0.36 105.19 109.80 1uaw n GLY 26 Ca -0.19 0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 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 3.27 0.10 0.99 2.34 -0.57 -3.91 118.68 113.62 1uaw s LEU 27 Ca 0.59 2.43 -0.34 0.00 0.06 0.00 0.00 54.13 56.87 1uaw s LEU 27 Cb -0.27 -4.60 -0.18 0.00 -0.56 0.00 0.00 46.19 40.58 1uaw s LEU 27 CO 0.73 -2.46 0.83 -1.20 -1.06 0.00 0.00 176.35 173.19 1uaw n SER 28 N -2.89 -0.47 0.05 1.48 7.64 -1.26 -4.69 113.62 113.48 1uaw n SER 28 Ca 0.14 1.15 0.12 0.00 1.01 0.00 0.00 58.87 61.29 1uaw n SER 28 Cb 0.50 -0.95 0.49 0.00 -1.01 0.00 0.00 64.21 63.23 1uaw n SER 28 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 1uaw n TRP 29 N 0.82 0.43 0.36 1.43 4.27 -1.26 -3.28 117.44 120.21 1uaw n TRP 29 Ca 0.19 0.14 0.05 0.00 -3.89 0.00 0.00 57.50 53.98 1uaw n TRP 29 Cb 0.17 -0.72 -0.06 0.00 -1.36 0.00 0.00 31.31 29.34 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 -1.86 3.11 0.00 -2.67 10.64 -1.26 -5.01 117.38 120.33 1uaw n GLN 30 Ca 0.05 -0.02 0.00 0.00 -1.83 0.00 0.00 57.00 55.21 1uaw n GLN 30 Cb 0.34 -1.01 0.00 0.00 -0.86 0.00 0.00 30.24 28.71 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 -1.35 0.00 -2.95 -0.39 5.66 -1.21 -5.08 114.28 108.97 1uaw n THR 31 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 1uaw n THR 31 Cb 0.17 -0.14 0.00 0.00 -1.55 0.00 0.00 70.33 68.81 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 -2.38 0.00 0.00 1.09 5.66 -1.26 -5.02 114.28 112.36 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 -0.26 1.09 6.02 -1.26 -1.33 117.38 121.64 1uaw n GLN 33 Ca 0.00 0.38 0.07 0.00 -0.01 0.00 0.00 57.00 57.43 1uaw n GLN 33 Cb 0.00 -1.16 0.20 0.00 1.02 0.00 0.00 30.24 30.30 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 0.23 -0.31 -1.09 4.81 -1.97 2.49 114.58 118.74 1uaw h GLU 34 Ca 0.00 -0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.31 1uaw h GLU 34 Cb 0.00 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1uaw h GLU 34 CO 0.00 0.16 0.29 0.78 -0.73 0.00 0.00 179.01 179.50 1uaw h GLY 35 N 0.24 0.00 1.47 1.92 0.00 -1.96 0.93 103.07 105.67 1uaw h GLY 35 Ca 0.44 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.50 1uaw h GLY 35 CO -0.55 0.00 -1.37 -2.00 0.00 0.00 0.00 176.54 172.62 1uaw h LEU 36 N 0.00 0.19 -1.60 3.11 5.85 0.53 0.73 115.31 124.12 1uaw h LEU 36 Ca 0.15 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.57 1uaw h LEU 36 Cb 0.72 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 1uaw h LEU 36 CO -0.00 1.21 -0.22 0.03 -0.34 0.00 0.00 178.44 179.12 1uaw h ARG 37 N 0.03 0.00 0.00 1.25 2.47 0.57 0.91 114.38 119.61 1uaw h ARG 37 Ca -0.16 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.56 1uaw h ARG 37 Cb 1.93 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.25 1uaw h ARG 37 CO 0.14 0.22 -0.77 -0.85 0.56 0.00 0.00 179.97 179.26 1uaw n GLU 38 N -4.09 0.28 0.11 0.04 -0.00 0.22 -0.53 120.64 116.67 1uaw n GLU 38 Ca -0.02 0.05 -0.00 0.00 -0.00 0.00 0.00 57.16 57.19 1uaw n GLU 38 Cb 0.29 -1.65 -0.02 0.00 -0.00 0.00 0.00 31.44 30.06 1uaw n GLU 38 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.13 176.21 1uaw h TYR 39 N 0.00 0.00 0.00 -1.84 5.03 0.16 -3.32 116.97 117.00 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 0.73 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.01 1uaw h TYR 39 CO 0.00 0.63 -0.89 1.19 -1.32 0.00 0.00 178.16 177.77 1uaw n PHE 40 N -3.21 0.00 1.79 -3.82 3.72 -0.59 -4.56 117.46 110.79 1uaw n PHE 40 Ca -0.00 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.51 1uaw n PHE 40 Cb 0.80 0.00 0.67 0.00 -0.94 0.00 0.00 39.48 40.01 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 2.30 -0.90 0.17 1.37 0.00 0.31 -3.36 105.19 105.08 1uaw n GLY 41 Ca 0.00 -0.14 -0.10 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 -0.30 -0.58 1.61 5.75 -1.75 -3.27 115.11 116.57 1uaw h GLN 42 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 1uaw h GLN 42 Cb 0.00 0.07 0.00 0.00 1.07 0.00 0.00 27.48 28.62 1uaw h GLN 42 CO 0.00 0.05 0.00 1.97 -2.65 0.00 0.00 178.83 178.20 1uaw n PHE 43 N -4.99 0.93 0.00 3.99 1.16 -1.24 -4.89 117.46 112.41 1uaw n PHE 43 Ca -0.08 -0.40 0.00 0.00 -1.87 0.00 0.00 57.45 55.10 1uaw n PHE 43 Cb 0.25 -0.11 0.00 0.00 -1.61 0.00 0.00 39.48 38.01 1uaw n PHE 43 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1uaw n GLY 44 N 1.11 2.41 3.15 4.97 0.00 -1.21 -4.65 105.19 110.97 1uaw n GLY 44 Ca 0.18 0.06 0.06 0.00 0.00 0.00 0.00 46.02 46.32 1uaw n GLY 44 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1uaw s GLU 45 N 2.62 0.01 0.23 1.61 -1.05 -1.26 -4.84 118.70 116.03 1uaw s GLU 45 Ca 0.00 0.01 -0.11 0.00 -0.15 0.00 0.00 54.97 54.72 1uaw s GLU 45 Cb 0.00 0.01 -0.07 0.00 -0.44 0.00 0.00 34.13 33.62 1uaw s GLU 45 CO 0.00 -0.01 0.58 0.54 0.95 0.00 0.00 175.26 177.32 1uaw s VAL 46 N 3.00 4.89 -0.16 1.83 0.11 -1.26 -2.97 120.40 125.84 1uaw s VAL 46 Ca 0.14 0.58 0.02 0.00 -2.93 0.00 0.00 61.98 59.78 1uaw s VAL 46 Cb -0.03 -3.63 -0.11 0.00 -1.53 0.00 0.00 36.38 31.08 1uaw s VAL 46 CO -0.15 -0.05 -0.13 0.29 -3.33 0.00 0.00 175.10 171.72 1uaw n LYS 47 N -0.07 0.46 -3.76 1.54 4.76 -1.26 -4.94 118.16 114.89 1uaw n LYS 47 Ca 0.00 0.09 -0.13 0.00 -2.87 0.00 0.00 58.31 55.40 1uaw n LYS 47 Cb 0.52 -1.32 -0.09 0.00 -1.84 0.00 0.00 35.03 32.31 1uaw n LYS 47 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1uaw s GLU 48 N -2.32 0.63 0.16 1.97 2.56 -1.26 -5.04 118.70 115.40 1uaw s GLU 48 Ca -0.21 -0.08 -0.13 0.00 0.00 0.00 0.00 54.97 54.56 1uaw s GLU 48 Cb 0.05 0.28 0.01 0.00 2.00 0.00 0.00 34.13 36.48 1uaw s GLU 48 CO 0.37 -0.16 0.38 0.00 -0.56 0.00 0.00 175.26 175.28 1uaw s LEU 50 N -2.91 0.54 -0.08 0.00 0.05 0.89 -4.91 118.68 112.26 1uaw s LEU 50 Ca 0.12 0.04 0.02 0.00 0.05 0.00 0.00 54.13 54.35 1uaw s LEU 50 Cb 0.02 -0.16 -0.02 0.00 -2.05 0.00 0.00 46.19 43.97 1uaw s LEU 50 CO -0.03 -0.20 -0.12 -0.69 -0.55 0.00 0.00 176.35 174.76 1uaw s VAL 51 N 1.74 3.23 0.05 1.48 1.01 -1.26 0.30 120.40 126.95 1uaw s VAL 51 Ca -0.00 -0.64 0.03 0.00 0.00 0.00 0.00 61.98 61.37 1uaw s VAL 51 Cb -0.12 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 1uaw s VAL 51 CO -0.03 0.57 -0.10 -0.32 0.00 0.00 0.00 175.10 175.22 1uaw s MET 52 N -0.42 0.63 -0.13 2.72 0.00 -1.16 -4.99 119.30 115.95 1uaw s MET 52 Ca 0.05 -0.84 -0.09 0.00 0.00 0.00 0.00 55.69 54.81 1uaw s MET 52 Cb -0.12 -0.45 0.04 0.00 0.00 0.00 0.00 34.83 34.30 1uaw s MET 52 CO 0.02 0.09 0.32 -0.98 0.00 0.00 0.00 175.02 174.47 1uaw s ARG 53 N -1.71 0.33 0.08 4.11 1.70 -1.26 -2.16 118.95 120.04 1uaw s ARG 53 Ca -0.07 0.53 -0.26 0.00 -0.47 0.00 0.00 55.73 55.47 1uaw s ARG 53 Cb -0.09 0.07 0.09 0.00 -0.57 0.00 0.00 34.95 34.44 1uaw s ARG 53 CO 0.01 -0.10 1.16 -0.51 -1.08 0.00 0.00 175.30 174.78 1uaw s ASP 54 N 0.68 -0.01 1.18 -2.89 1.01 -1.26 -4.93 116.67 110.45 1uaw s ASP 54 Ca -0.04 -0.42 -0.13 0.00 0.71 0.00 0.00 52.55 52.67 1uaw s ASP 54 Cb -0.05 0.32 0.29 0.00 1.01 0.00 0.00 42.92 44.49 1uaw s ASP 54 CO -0.04 -0.63 1.02 -2.84 0.21 0.00 0.00 175.17 172.88 1uaw s PRO 55 N -2.19 -1.07 -0.16 8.23 0.01 -1.26 -4.46 135.00 134.10 1uaw s PRO 55 Ca 0.24 0.84 -0.17 0.00 0.01 0.00 0.00 61.00 61.91 1uaw s PRO 55 Cb -0.01 -1.54 -0.23 0.00 0.01 0.00 0.00 34.50 32.74 1uaw s PRO 55 CO 0.02 -3.82 0.35 1.37 0.01 0.00 0.00 177.00 174.92 1uaw h LEU 56 N -2.70 0.18 0.00 -5.54 8.10 -1.88 -3.42 115.31 110.05 1uaw h LEU 56 Ca -0.62 -0.71 0.00 0.00 0.11 0.00 0.00 57.88 56.66 1uaw h LEU 56 Cb 1.34 -0.06 0.00 0.00 -0.44 0.00 0.00 40.66 41.50 1uaw h LEU 56 CO 0.50 1.58 0.00 1.07 -4.11 0.00 0.00 178.44 177.48 1uaw n THR 57 N -4.11 0.00 -0.95 0.15 5.66 -1.26 -0.84 114.28 112.92 1uaw n THR 57 Ca -0.30 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.70 1uaw n THR 57 Cb 0.80 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.58 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 0.10 -0.66 1.09 -0.00 -1.26 -5.09 118.16 112.33 1uaw n LYS 58 Ca 0.00 -0.43 0.00 0.00 -0.00 0.00 0.00 58.31 57.88 1uaw n LYS 58 Cb 0.00 -0.52 0.00 0.00 -0.00 0.00 0.00 35.03 34.51 1uaw n LYS 58 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 1uaw n ARG 59 N -0.02 2.38 0.00 -1.58 -4.01 -0.02 -5.11 116.66 108.30 1uaw n ARG 59 Ca 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.81 1uaw n ARG 59 Cb 0.43 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.85 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 -1.12 -1.05 -1.14 2.89 2.88 -1.26 -4.82 113.62 110.00 1uaw n SER 60 Ca 0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 1uaw n SER 60 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1uaw n SER 60 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1uaw n ARG 61 N -1.05 0.00 0.00 -1.46 1.85 -1.26 -4.36 116.66 110.38 1uaw n ARG 61 Ca 0.00 -1.34 0.00 0.00 -1.00 0.00 0.00 57.85 55.51 1uaw n ARG 61 Cb 0.00 0.20 0.00 0.00 -1.05 0.00 0.00 32.46 31.61 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 0.21 0.50 0.00 2.89 0.00 -1.26 -4.75 105.19 102.79 1uaw n GLY 62 Ca -0.10 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.01 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 1.87 -0.05 -3.33 1.61 -1.74 -0.92 -1.50 117.46 113.39 1uaw n PHE 63 Ca 0.00 0.00 0.02 0.00 -0.56 0.00 0.00 57.45 56.91 1uaw n PHE 63 Cb 0.00 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 40.98 1uaw n PHE 63 CO 0.00 0.00 0.00 0.20 -0.56 0.00 0.00 176.76 176.40 1uaw s GLY 64 N -0.43 -0.76 0.24 4.97 0.00 -0.93 -3.00 107.32 107.41 1uaw s GLY 64 Ca 0.00 2.23 -0.25 0.00 0.00 0.00 0.00 44.72 46.70 1uaw s GLY 64 CO 0.00 3.32 0.84 -1.36 0.00 0.00 0.00 173.10 175.90 1uaw s PHE 65 N 2.84 3.78 -0.20 1.90 0.08 0.15 0.08 117.98 126.61 1uaw s PHE 65 Ca 0.08 1.66 -0.04 0.00 0.12 0.00 0.00 56.93 58.74 1uaw s PHE 65 Cb -0.13 -2.81 0.10 0.00 -0.57 0.00 0.00 43.02 39.62 1uaw s PHE 65 CO -0.19 0.37 0.35 0.08 -0.10 0.00 0.00 175.22 175.73 1uaw s VAL 66 N -1.40 -0.55 -0.20 -0.44 1.01 -0.79 -0.08 120.40 117.95 1uaw s VAL 66 Ca 0.43 0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.48 1uaw s VAL 66 Cb -0.20 -0.68 0.25 0.00 0.00 0.00 0.00 36.38 35.75 1uaw s VAL 66 CO 0.25 -0.03 1.52 1.07 0.00 0.00 0.00 175.10 177.91 1uaw n THR 67 N 5.36 2.08 -0.82 3.92 5.66 -0.36 -0.48 114.28 129.65 1uaw n THR 67 Ca -0.06 -0.95 -0.30 0.00 -3.05 0.00 0.00 64.05 59.70 1uaw n THR 67 Cb 0.50 -0.92 0.25 0.00 -1.55 0.00 0.00 70.33 68.61 1uaw n THR 67 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 1uaw s PHE 68 N -1.40 0.35 0.00 1.09 -0.71 -1.26 -4.47 117.98 111.58 1uaw s PHE 68 Ca 0.24 0.62 0.00 0.00 -1.04 0.00 0.00 56.93 56.75 1uaw s PHE 68 Cb 0.20 -3.23 0.00 0.00 -1.21 0.00 0.00 43.02 38.78 1uaw s PHE 68 CO 0.03 -4.16 0.00 0.00 -1.34 0.00 0.00 175.22 169.75 1uaw n MET 69 N -5.01 0.00 -2.71 1.99 0.00 -1.16 -4.83 117.12 105.40 1uaw n MET 69 Ca 0.11 0.00 -0.05 0.00 0.00 0.00 0.00 57.70 57.76 1uaw n MET 69 Cb 0.59 0.00 0.08 0.00 0.00 0.00 0.00 33.22 33.89 1uaw n MET 69 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 175.97 175.57 1uaw n ASP 70 N 0.00 -0.09 0.00 3.17 5.75 -1.26 -4.56 116.55 119.56 1uaw n ASP 70 Ca 0.00 -2.41 0.00 0.00 -0.01 0.00 0.00 54.79 52.37 1uaw n ASP 70 Cb 0.00 0.18 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 1uaw n ASP 70 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1uaw n GLN 71 N -0.60 0.00 0.00 0.11 6.02 -1.26 -2.62 117.38 119.02 1uaw n GLN 71 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 57.00 57.09 1uaw n GLN 71 Cb 0.84 0.00 0.55 0.00 1.02 0.00 0.00 30.24 32.64 1uaw n GLN 71 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1uaw n ALA 72 N 4.13 2.15 0.08 -1.58 0.00 -1.26 -3.85 120.51 120.18 1uaw n ALA 72 Ca 0.00 -0.11 -0.08 0.00 0.00 0.00 0.00 53.44 53.25 1uaw n ALA 72 Cb 0.00 -1.32 -0.05 0.00 0.00 0.00 0.00 19.45 18.09 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 3.11 -1.12 -0.93 0.00 0.00 -1.77 0.06 103.07 102.42 1uaw h GLY 73 Ca 0.00 0.54 0.42 0.00 0.00 0.00 0.00 47.33 48.29 1uaw h GLY 73 CO 0.00 -0.35 1.02 -2.08 0.00 0.00 0.00 176.54 175.13 1uaw h VAL 74 N -0.40 0.26 0.53 4.60 2.07 -1.90 0.74 116.25 122.15 1uaw h VAL 74 Ca -0.01 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 1uaw h VAL 74 Cb 0.38 0.22 0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1uaw h VAL 74 CO -0.10 0.01 -0.26 -0.78 0.02 0.00 0.00 177.57 176.46 1uaw h ASP 75 N 0.03 -0.60 -0.30 0.57 1.82 -1.24 -2.44 116.42 114.25 1uaw h ASP 75 Ca 0.71 0.02 -0.00 0.00 -0.39 0.00 0.00 57.03 57.37 1uaw h ASP 75 Cb 2.73 0.16 -0.01 0.00 0.68 0.00 0.00 39.33 42.88 1uaw h ASP 75 CO -0.07 -0.26 0.19 0.11 -1.61 0.00 0.00 179.24 177.60 1uaw h LYS 76 N -1.05 0.41 -0.12 0.28 6.56 -0.32 -2.78 116.57 119.55 1uaw h LYS 76 Ca -0.07 -0.03 0.02 0.00 -1.06 0.00 0.00 60.65 59.51 1uaw h LYS 76 Cb 0.55 -0.09 -0.05 0.00 -0.57 0.00 0.00 32.23 32.07 1uaw h LYS 76 CO 0.12 0.30 -0.42 0.28 -2.06 0.00 0.00 179.45 177.67 1uaw h VAL 77 N 0.39 0.00 -0.90 0.50 2.07 -1.00 -0.57 116.25 116.74 1uaw h VAL 77 Ca 0.11 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.80 1uaw h VAL 77 Cb -0.01 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 29.60 1uaw h VAL 77 CO -0.02 0.00 -0.28 0.25 0.02 0.00 0.00 177.57 177.54 1uaw h LEU 78 N -0.43 -1.01 -1.48 2.57 7.12 -1.32 2.16 115.31 122.91 1uaw h LEU 78 Ca 0.03 0.28 0.27 0.00 0.13 0.00 0.00 57.88 58.58 1uaw h LEU 78 Cb 0.51 0.61 -0.04 0.00 -0.53 0.00 0.00 40.66 41.22 1uaw h LEU 78 CO -0.35 -0.30 0.97 0.00 -0.13 0.00 0.00 178.44 178.63 1uaw h ALA 79 N 1.71 2.77 -0.58 1.25 0.00 -0.82 2.49 119.26 126.09 1uaw h ALA 79 Ca 0.40 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1uaw h ALA 79 Cb 0.64 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1uaw h ALA 79 CO -0.93 -1.44 0.00 1.04 0.00 0.00 0.00 179.25 177.92 1uaw n GLN 80 N -3.50 4.93 0.11 0.00 1.13 0.73 -4.40 117.38 116.38 1uaw n GLN 80 Ca 0.20 -3.17 0.07 0.00 -1.94 0.00 0.00 57.00 52.16 1uaw n GLN 80 Cb 1.26 -2.28 0.36 0.00 0.11 0.00 0.00 30.24 29.69 1uaw n GLN 80 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 1uaw n SER 81 N 0.63 0.34 -0.91 1.08 3.41 0.84 0.73 113.62 119.73 1uaw n SER 81 Ca 0.28 0.63 0.08 0.00 -0.26 0.00 0.00 58.87 59.59 1uaw n SER 81 Cb 1.21 -0.65 0.22 0.00 -0.26 0.00 0.00 64.21 64.72 1uaw n SER 81 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1uaw n ARG 82 N -1.96 2.87 -0.11 4.33 -4.01 -1.25 -3.86 116.66 112.67 1uaw n ARG 82 Ca -0.01 -2.30 -0.01 0.00 -1.04 0.00 0.00 57.85 54.49 1uaw n ARG 82 Cb 0.08 -1.41 -0.01 0.00 -3.04 0.00 0.00 32.46 28.09 1uaw n ARG 82 CO 0.00 0.00 0.00 0.72 -3.04 0.00 0.00 177.63 175.31 1uaw n HIS 83 N 0.85 0.00 -3.77 2.89 8.25 0.22 -4.29 115.22 119.36 1uaw n HIS 83 Ca 0.16 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.26 1uaw n HIS 83 Cb 0.52 -0.05 -0.11 0.00 1.12 0.00 0.00 29.99 31.47 1uaw n HIS 83 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 1uaw s GLU 84 N 0.54 3.83 0.00 -0.41 2.12 -1.22 0.16 118.70 123.71 1uaw s GLU 84 Ca 0.04 -0.39 0.00 0.00 0.36 0.00 0.00 54.97 54.98 1uaw s GLU 84 Cb -0.03 -3.39 0.00 0.00 0.26 0.00 0.00 34.13 30.97 1uaw s GLU 84 CO 0.02 -0.06 0.00 1.47 -0.54 0.00 0.00 175.26 176.15 1uaw n LEU 85 N 4.58 0.00 -2.50 2.70 -0.00 -0.96 -4.89 117.00 115.93 1uaw n LEU 85 Ca -0.16 0.00 -0.20 0.00 -0.00 0.00 0.00 56.01 55.65 1uaw n LEU 85 Cb 0.52 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.83 1uaw n LEU 85 CO 0.33 0.00 2.14 -0.67 -0.00 0.00 0.00 177.39 179.18 1uaw n ASP 86 N -0.02 5.94 0.00 1.45 -0.08 -1.26 -4.39 116.55 118.20 1uaw n ASP 86 Ca 0.00 -2.44 0.00 0.00 -1.51 0.00 0.00 54.79 50.84 1uaw n ASP 86 Cb 0.00 -1.35 0.00 0.00 2.34 0.00 0.00 41.12 42.11 1uaw n ASP 86 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1uaw n SER 87 N 2.98 -3.97 -4.26 1.67 2.88 -1.26 -4.97 113.62 106.69 1uaw n SER 87 Ca 0.51 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.69 1uaw n SER 87 Cb 0.60 -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 2.88 -1.27 -1.46 -0.14 -1.26 -5.01 119.74 112.62 1uaw s LYS 88 Ca 0.00 -0.98 -0.08 0.00 -1.36 0.00 0.00 55.97 53.55 1uaw s LYS 88 Cb 0.00 -3.21 0.17 0.00 -1.68 0.00 0.00 37.83 33.11 1uaw s LYS 88 CO 0.00 -0.47 1.90 -2.37 -0.76 0.00 0.00 175.35 173.66 1uaw n THR 89 N 4.76 4.53 -0.70 2.17 5.66 -1.21 -2.26 114.28 127.23 1uaw n THR 89 Ca -0.15 -4.51 -0.19 0.00 -3.05 0.00 0.00 64.05 56.14 1uaw n THR 89 Cb 0.47 -2.30 0.09 0.00 -1.55 0.00 0.00 70.33 67.03 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 2.98 0.00 -3.19 1.09 5.41 0.42 -4.55 119.36 121.52 1uaw n ILE 90 Ca 0.41 -0.05 -0.21 0.00 1.00 0.00 0.00 62.75 63.90 1uaw n ILE 90 Cb 0.35 -0.27 -0.06 0.00 -0.71 0.00 0.00 39.64 38.94 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 0.81 -1.05 -4.56 4.38 -0.08 0.52 -2.98 116.55 113.59 1uaw n ASP 91 Ca 0.02 -2.59 -0.52 0.00 -1.51 0.00 0.00 54.79 50.19 1uaw n ASP 91 Cb 0.38 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.77 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 2.49 1.36 -3.81 -0.67 -0.04 -1.26 -2.90 135.00 130.16 1uaw n PRO 92 Ca 0.25 0.44 -0.30 0.00 -0.04 0.00 0.00 63.50 63.85 1uaw n PRO 92 Cb 0.51 -2.44 -0.15 0.00 -0.04 0.00 0.00 33.50 31.38 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 5.16 0.96 0.32 0.54 0.00 -0.39 -4.61 119.74 121.72 1uaw s LYS 93 Ca 1.03 -1.11 0.03 0.00 0.00 0.00 0.00 55.97 55.92 1uaw s LYS 93 Cb -0.86 -2.28 -0.02 0.00 0.00 0.00 0.00 37.83 34.67 1uaw s LYS 93 CO 0.53 -0.88 0.48 0.08 0.00 0.00 0.00 175.35 175.56 1uaw s VAL 94 N 1.50 4.81 0.21 1.79 1.01 -1.26 -2.22 120.40 126.24 1uaw s VAL 94 Ca 0.06 -0.76 -0.22 0.00 0.00 0.00 0.00 61.98 61.06 1uaw s VAL 94 Cb -0.18 -3.72 -0.08 0.00 0.00 0.00 0.00 36.38 32.40 1uaw s VAL 94 CO -0.18 -0.37 0.76 0.00 0.00 0.00 0.00 175.10 175.31 1uaw s ALA 95 N -2.20 3.41 0.00 5.51 0.00 -1.26 -4.97 121.76 122.25 1uaw s ALA 95 Ca 0.40 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.62 1uaw s ALA 95 Cb -0.09 -2.89 0.00 0.00 0.00 0.00 0.00 23.12 20.13 1uaw s ALA 95 CO 0.33 0.30 0.00 0.34 0.00 0.00 0.00 175.76 176.73