#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1daz s GLN 2 N 0.00 3.04 -0.20 -0.52 0.74 -1.26 -5.11 119.66 116.35 1daz s GLN 2 Ca 0.00 -0.88 0.01 0.00 0.05 0.00 0.00 55.36 54.54 1daz s GLN 2 Cb 0.00 -2.30 0.02 0.00 1.10 0.00 0.00 33.01 31.83 1daz s GLN 2 CO 0.00 0.19 -0.17 0.42 -0.55 0.00 0.00 175.29 175.18 1daz s ILE 3 N 0.31 2.21 0.82 -2.34 1.01 -1.26 -5.12 121.20 116.84 1daz s ILE 3 Ca -0.18 -1.03 -0.12 0.00 0.00 0.00 0.00 60.65 59.32 1daz s ILE 3 Cb -0.18 -2.01 0.09 0.00 0.01 0.00 0.00 42.46 40.37 1daz s ILE 3 CO 0.09 0.42 1.15 0.42 0.00 0.00 0.00 174.94 177.02 1daz s THR 4 N 1.27 2.28 -0.18 2.92 -4.23 -1.26 -5.01 115.64 111.44 1daz s THR 4 Ca 0.03 0.09 0.17 0.00 -1.18 0.00 0.00 61.69 60.80 1daz s THR 4 Cb -0.14 -3.00 0.51 0.00 1.34 0.00 0.00 72.50 71.21 1daz s THR 4 CO -0.11 -0.12 1.40 0.18 -0.54 0.00 0.00 174.62 175.44 1daz n LEU 5 N -3.41 3.77 -0.18 4.79 4.77 -1.26 -4.57 117.00 120.91 1daz n LEU 5 Ca 0.07 -3.04 0.01 0.00 -0.03 0.00 0.00 56.01 53.02 1daz n LEU 5 Cb 0.60 -0.54 0.27 0.00 -2.33 0.00 0.00 43.42 41.42 1daz n LEU 5 CO 0.57 0.69 1.23 -0.50 -1.33 0.00 0.00 177.39 178.05 1daz h TRP 6 N 1.64 0.88 -3.13 -1.77 4.06 -2.06 -3.43 115.95 112.13 1daz h TRP 6 Ca 0.01 0.02 -0.43 0.00 2.06 0.00 0.00 58.89 60.55 1daz h TRP 6 Cb 1.42 -0.30 -0.14 0.00 -1.00 0.00 0.00 29.16 29.14 1daz h TRP 6 CO 0.47 0.55 -0.62 -1.59 -3.56 0.00 0.00 178.44 173.68 1daz s LYS 7 N -5.79 1.53 0.17 0.49 -2.85 -1.26 -5.11 119.74 106.92 1daz s LYS 7 Ca -0.11 -1.82 -0.33 0.00 -1.00 0.00 0.00 55.97 52.71 1daz s LYS 7 Cb 0.18 -0.70 -0.14 0.00 -2.06 0.00 0.00 37.83 35.10 1daz s LYS 7 CO 0.77 -0.18 1.48 0.54 0.10 0.00 0.00 175.35 178.06 1daz n ARG 8 N -0.57 1.93 -1.97 1.78 1.74 -1.26 -4.84 116.66 113.46 1daz n ARG 8 Ca -0.03 0.69 -0.39 0.00 -0.77 0.00 0.00 57.85 57.36 1daz n ARG 8 Cb 0.66 -2.40 -0.03 0.00 -1.02 0.00 0.00 32.46 29.67 1daz n ARG 8 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1daz n PRO 9 N 2.82 2.31 -3.51 5.56 -0.04 -1.26 -4.94 135.00 135.94 1daz n PRO 9 Ca 0.16 -2.61 -0.38 0.00 -0.04 0.00 0.00 63.50 60.63 1daz n PRO 9 Cb 0.28 -3.41 -0.06 0.00 -0.04 0.00 0.00 33.50 30.27 1daz n PRO 9 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1daz s LEU 10 N 5.21 4.39 0.13 1.53 1.43 -1.26 -1.09 118.68 129.02 1daz s LEU 10 Ca 0.58 0.81 0.01 0.00 -1.03 0.00 0.00 54.13 54.49 1daz s LEU 10 Cb 0.07 -2.52 -0.04 0.00 0.03 0.00 0.00 46.19 43.73 1daz s LEU 10 CO 0.07 0.23 -0.01 0.68 0.23 0.00 0.00 176.35 177.56 1daz s VAL 11 N -0.47 0.51 0.06 -1.59 -7.23 0.09 -4.94 120.40 106.83 1daz s VAL 11 Ca 0.22 -1.94 -0.24 0.00 -1.81 0.00 0.00 61.98 58.21 1daz s VAL 11 Cb -0.15 -1.94 -0.06 0.00 0.56 0.00 0.00 36.38 34.79 1daz s VAL 11 CO 0.10 -0.62 0.72 -0.89 -0.31 0.00 0.00 175.10 174.10 1daz s THR 12 N -3.76 4.71 0.20 5.32 2.01 -1.26 -0.45 115.64 122.40 1daz s THR 12 Ca 0.19 1.54 0.07 0.00 0.31 0.00 0.00 61.69 63.81 1daz s THR 12 Cb 0.06 -4.07 -0.05 0.00 0.01 0.00 0.00 72.50 68.46 1daz s THR 12 CO -0.00 0.41 -0.14 0.27 -0.69 0.00 0.00 174.62 174.47 1daz s ILE 13 N -0.32 1.68 -0.11 1.82 -4.36 0.95 -1.62 121.20 119.24 1daz s ILE 13 Ca 0.36 -2.20 0.01 0.00 -0.26 0.00 0.00 60.65 58.56 1daz s ILE 13 Cb -0.20 -2.02 0.02 0.00 1.25 0.00 0.00 42.46 41.50 1daz s ILE 13 CO 0.22 -0.61 -0.12 -0.75 0.24 0.00 0.00 174.94 173.92 1daz s LYS 14 N -3.65 1.95 -0.11 0.37 2.20 -0.06 -1.16 119.74 119.28 1daz s LYS 14 Ca 0.22 -0.44 -0.08 0.00 -0.36 0.00 0.00 55.97 55.31 1daz s LYS 14 Cb -0.00 -1.78 0.04 0.00 -1.51 0.00 0.00 37.83 34.58 1daz s LYS 14 CO 0.06 -0.15 0.28 -1.50 -0.36 0.00 0.00 175.35 173.68 1daz s ILE 15 N 1.28 -0.02 -1.82 5.43 2.07 -0.28 -1.22 121.20 126.64 1daz s ILE 15 Ca -0.01 0.08 0.00 0.00 -1.41 0.00 0.00 60.65 59.31 1daz s ILE 15 Cb -0.14 -0.42 0.00 0.00 0.13 0.00 0.00 42.46 42.03 1daz s ILE 15 CO -0.05 0.03 0.00 0.61 -1.91 0.00 0.00 174.94 173.62 1daz n GLY 16 N 3.70 0.39 1.82 1.50 0.00 -1.26 -1.22 105.19 110.12 1daz n GLY 16 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1daz n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1daz n GLY 17 N -0.75 0.63 3.33 -0.02 0.00 -1.26 -5.04 105.19 102.08 1daz n GLY 17 Ca -0.22 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 1daz n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1daz s GLN 18 N -0.16 1.67 -0.09 1.61 -0.21 -0.36 -5.13 119.66 117.00 1daz s GLN 18 Ca 0.00 -1.11 -0.12 0.00 0.02 0.00 0.00 55.36 54.15 1daz s GLN 18 Cb 0.00 -1.88 -0.05 0.00 1.00 0.00 0.00 33.01 32.08 1daz s GLN 18 CO 0.00 0.48 0.28 -0.51 -2.12 0.00 0.00 175.29 173.42 1daz s LEU 19 N -1.34 4.37 0.19 2.90 1.43 -1.26 -1.13 118.68 123.85 1daz s LEU 19 Ca 0.11 0.65 -0.06 0.00 -1.03 0.00 0.00 54.13 53.79 1daz s LEU 19 Cb -0.10 -2.34 -0.02 0.00 0.03 0.00 0.00 46.19 43.77 1daz s LEU 19 CO 0.02 0.29 0.25 -0.54 0.23 0.00 0.00 176.35 176.60 1daz s LYS 20 N -0.59 1.21 -0.16 1.70 1.02 -0.31 -4.97 119.74 117.65 1daz s LYS 20 Ca 0.18 -1.35 -0.07 0.00 0.02 0.00 0.00 55.97 54.76 1daz s LYS 20 Cb -0.14 0.35 -0.04 0.00 -0.52 0.00 0.00 37.83 37.48 1daz s LYS 20 CO 0.07 -0.44 0.08 -1.21 -0.92 0.00 0.00 175.35 172.93 1daz s GLU 21 N -4.04 3.75 0.07 1.68 0.41 -1.26 -0.03 118.70 119.28 1daz s GLU 21 Ca 0.25 -0.29 0.03 0.00 -0.41 0.00 0.00 54.97 54.55 1daz s GLU 21 Cb 0.04 -3.17 -0.03 0.00 -1.78 0.00 0.00 34.13 29.19 1daz s GLU 21 CO 0.05 0.44 -0.09 0.00 -0.49 0.00 0.00 175.26 175.17 1daz s ALA 22 N -0.11 0.90 -0.21 5.21 0.00 0.40 -4.49 121.76 123.45 1daz s ALA 22 Ca 0.08 -1.01 -0.14 0.00 0.00 0.00 0.00 51.96 50.88 1daz s ALA 22 Cb -0.12 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.99 1daz s ALA 22 CO 0.01 -0.02 0.34 -1.17 0.00 0.00 0.00 175.76 174.92 1daz s LEU 23 N -2.06 4.14 -0.42 0.00 2.96 0.66 -0.73 118.68 123.24 1daz s LEU 23 Ca -0.01 0.41 -0.29 0.00 -0.22 0.00 0.00 54.13 54.01 1daz s LEU 23 Cb -0.06 -2.41 0.02 0.00 0.50 0.00 0.00 46.19 44.24 1daz s LEU 23 CO -0.00 -0.05 1.25 -0.76 -1.32 0.00 0.00 176.35 175.47 1daz s LEU 24 N 1.28 3.68 -0.33 -0.68 1.43 -0.25 -0.76 118.68 123.05 1daz s LEU 24 Ca 0.16 0.74 0.02 0.00 -1.03 0.00 0.00 54.13 54.02 1daz s LEU 24 Cb -0.14 -3.54 0.09 0.00 0.03 0.00 0.00 46.19 42.62 1daz s LEU 24 CO 0.07 -1.25 0.03 -0.62 0.23 0.00 0.00 176.35 174.81 1daz s ASP 25 N 2.91 4.78 0.36 2.29 -1.08 -0.34 -4.77 116.67 120.83 1daz s ASP 25 Ca 0.53 -1.88 0.27 0.00 -0.52 0.00 0.00 52.55 50.96 1daz s ASP 25 Cb -0.11 -1.65 1.08 0.00 -1.46 0.00 0.00 42.92 40.78 1daz s ASP 25 CO 0.29 -0.35 1.81 0.71 0.52 0.00 0.00 175.17 178.15 1daz h THR 26 N 6.60 0.00 -0.29 1.71 1.35 -1.94 -2.42 112.91 117.92 1daz h THR 26 Ca -0.11 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1daz h THR 26 Cb 1.03 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.69 1daz h THR 26 CO 0.53 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.41 1daz n GLY 27 N 0.16 0.72 3.40 5.82 0.00 -1.26 -4.82 105.19 109.21 1daz n GLY 27 Ca 0.02 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 45.22 1daz n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1daz s ALA 28 N -1.63 2.84 0.21 4.61 0.00 -0.91 -4.99 121.76 121.90 1daz s ALA 28 Ca 0.32 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.36 1daz s ALA 28 Cb 0.17 -1.53 0.15 0.00 0.00 0.00 0.00 23.12 21.90 1daz s ALA 28 CO 0.24 -0.01 1.49 -0.44 0.00 0.00 0.00 175.76 177.04 1daz h ASP 29 N 7.22 0.23 -0.91 0.00 3.32 -1.87 0.94 116.42 125.34 1daz h ASP 29 Ca -0.33 -0.16 -0.64 0.00 0.02 0.00 0.00 57.03 55.92 1daz h ASP 29 Cb 1.19 -0.07 -0.12 0.00 0.22 0.00 0.00 39.33 40.55 1daz h ASP 29 CO 0.60 0.88 -0.52 -1.81 -1.72 0.00 0.00 179.24 176.67 1daz s ASP 30 N -6.90 4.14 -0.19 6.45 1.01 -1.26 -2.53 116.67 117.38 1daz s ASP 30 Ca -0.03 -1.46 -0.04 0.00 0.71 0.00 0.00 52.55 51.73 1daz s ASP 30 Cb 0.11 0.12 -0.02 0.00 1.01 0.00 0.00 42.92 44.14 1daz s ASP 30 CO 0.81 -0.72 -0.04 -0.89 0.21 0.00 0.00 175.17 174.54 1daz s THR 31 N -2.78 3.61 -0.14 -1.27 2.01 -1.26 -2.60 115.64 113.20 1daz s THR 31 Ca 0.21 -0.43 0.01 0.00 0.31 0.00 0.00 61.69 61.79 1daz s THR 31 Cb 0.04 -2.62 0.02 0.00 0.01 0.00 0.00 72.50 69.95 1daz s THR 31 CO 0.12 0.44 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.64 1daz s VAL 32 N 1.03 1.65 0.02 3.82 1.01 -0.19 -0.81 120.40 126.94 1daz s VAL 32 Ca 0.01 -0.70 0.05 0.00 0.00 0.00 0.00 61.98 61.34 1daz s VAL 32 Cb -0.15 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.68 1daz s VAL 32 CO 0.01 0.47 -0.11 -0.63 0.00 0.00 0.00 175.10 174.84 1daz s ILE 33 N 1.25 3.33 0.54 2.22 -1.09 0.58 -0.34 121.20 127.68 1daz s ILE 33 Ca 0.00 -0.95 -0.20 0.00 -2.23 0.00 0.00 60.65 57.27 1daz s ILE 33 Cb -0.14 -2.44 -0.08 0.00 -1.58 0.00 0.00 42.46 38.23 1daz s ILE 33 CO -0.07 0.36 0.88 -1.84 -1.23 0.00 0.00 174.94 173.03 1daz n GLU 34 N 1.50 0.95 -1.73 2.79 0.28 -1.26 -2.04 120.64 121.13 1daz n GLU 34 Ca -0.15 0.36 -0.64 0.00 -0.16 0.00 0.00 57.16 56.56 1daz n GLU 34 Cb 0.52 -2.02 -0.09 0.00 1.43 0.00 0.00 31.44 31.29 1daz n GLU 34 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1daz n GLU 35 N -0.42 0.41 -3.74 3.44 4.07 -0.97 -4.59 120.64 118.83 1daz n GLU 35 Ca 0.12 0.15 -0.13 0.00 -0.06 0.00 0.00 57.16 57.23 1daz n GLU 35 Cb 0.45 -1.72 -0.09 0.00 -0.06 0.00 0.00 31.44 30.02 1daz n GLU 35 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1daz s MET 36 N 3.12 0.58 -1.36 5.31 0.23 -1.26 -5.01 119.30 120.92 1daz s MET 36 Ca 1.02 0.15 -0.13 0.00 -1.03 0.00 0.00 55.69 55.70 1daz s MET 36 Cb -1.34 0.27 -0.03 0.00 -1.53 0.00 0.00 34.83 32.19 1daz s MET 36 CO 0.76 -0.13 2.39 0.43 -2.03 0.00 0.00 175.02 176.43 1daz n SER 37 N 1.98 5.20 -4.72 -1.18 7.64 -1.26 -4.94 113.62 116.34 1daz n SER 37 Ca -0.18 -2.69 -0.42 0.00 1.01 0.00 0.00 58.87 56.60 1daz n SER 37 Cb 0.57 -1.50 -0.03 0.00 -1.01 0.00 0.00 64.21 62.24 1daz n SER 37 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1daz s LEU 38 N 1.26 4.39 0.68 -3.43 2.96 -1.26 -5.02 118.68 118.26 1daz s LEU 38 Ca 0.54 2.05 -0.11 0.00 -0.22 0.00 0.00 54.13 56.40 1daz s LEU 38 Cb 0.15 -3.58 -0.00 0.00 0.50 0.00 0.00 46.19 43.25 1daz s LEU 38 CO -0.05 -0.45 1.06 -2.16 -1.32 0.00 0.00 176.35 173.44 1daz s PRO 39 N 0.83 3.07 0.00 0.98 0.04 -1.26 -4.98 135.00 133.68 1daz s PRO 39 Ca 0.58 0.73 0.00 0.00 0.04 0.00 0.00 61.00 62.34 1daz s PRO 39 Cb -0.30 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.22 1daz s PRO 39 CO 0.30 -0.94 0.00 0.41 0.04 0.00 0.00 177.00 176.81 1daz n GLY 40 N -2.52 1.07 3.79 0.56 0.00 -1.26 -5.03 105.19 101.79 1daz n GLY 40 Ca 0.07 -2.19 -0.36 0.00 0.00 0.00 0.00 46.02 43.53 1daz n GLY 40 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1daz s ARG 41 N -1.29 4.40 0.20 1.61 6.06 -1.26 -5.06 118.95 123.60 1daz s ARG 41 Ca 0.00 1.36 -0.12 0.00 -2.50 0.00 0.00 55.73 54.47 1daz s ARG 41 Cb 0.00 -2.63 -0.00 0.00 0.06 0.00 0.00 34.95 32.38 1daz s ARG 41 CO 0.00 0.10 0.39 1.67 -2.50 0.00 0.00 175.30 174.95 1daz s TRP 42 N -1.71 0.31 -0.03 5.12 1.48 -1.26 -4.56 118.94 118.28 1daz s TRP 42 Ca 0.54 -0.66 0.02 0.00 -1.06 0.00 0.00 56.10 54.94 1daz s TRP 42 Cb -0.18 0.09 0.01 0.00 -1.16 0.00 0.00 33.47 32.23 1daz s TRP 42 CO 0.23 -0.84 -0.09 0.21 -4.06 0.00 0.00 176.95 172.40 1daz s LYS 43 N -3.97 1.06 0.09 3.25 2.20 -0.72 -4.90 119.74 116.74 1daz s LYS 43 Ca 0.18 -0.30 -0.30 0.00 -0.36 0.00 0.00 55.97 55.18 1daz s LYS 43 Cb 0.01 -0.97 -0.06 0.00 -1.51 0.00 0.00 37.83 35.30 1daz s LYS 43 CO 0.03 0.08 1.11 -1.25 -0.36 0.00 0.00 175.35 174.96 1daz s PRO 44 N 0.33 4.52 0.23 4.03 0.04 -1.26 -0.08 135.00 142.81 1daz s PRO 44 Ca -0.06 1.66 0.00 0.00 0.04 0.00 0.00 61.00 62.65 1daz s PRO 44 Cb -0.10 -3.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.05 1daz s PRO 44 CO 0.01 -0.09 0.17 0.96 0.04 0.00 0.00 177.00 178.09 1daz s ILE 45 N 0.59 0.00 -0.07 0.56 -4.36 -0.40 -4.92 121.20 112.60 1daz s ILE 45 Ca 0.54 -1.98 0.04 0.00 -0.26 0.00 0.00 60.65 58.98 1daz s ILE 45 Cb -0.27 -2.49 0.00 0.00 1.25 0.00 0.00 42.46 40.95 1daz s ILE 45 CO 0.31 0.00 -0.18 -0.04 0.24 0.00 0.00 174.94 175.26 1daz s MET 46 N -4.01 2.22 0.10 0.37 -1.94 -1.26 -1.25 119.30 113.53 1daz s MET 46 Ca 0.39 -0.65 0.09 0.00 -1.71 0.00 0.00 55.69 53.81 1daz s MET 46 Cb 0.06 -1.79 -0.03 0.00 2.01 0.00 0.00 34.83 35.08 1daz s MET 46 CO 0.15 0.16 -0.24 0.96 -0.01 0.00 0.00 175.02 176.04 1daz s ILE 47 N 0.34 1.95 0.31 2.53 -4.36 -0.70 -4.95 121.20 116.33 1daz s ILE 47 Ca -0.13 -1.56 0.03 0.00 -0.26 0.00 0.00 60.65 58.74 1daz s ILE 47 Cb -0.15 -1.73 -0.04 0.00 1.25 0.00 0.00 42.46 41.79 1daz s ILE 47 CO 0.05 0.08 0.16 -0.83 0.24 0.00 0.00 174.94 174.63 1daz s GLY 48 N -1.80 2.12 0.00 6.27 0.00 -1.26 -0.62 107.32 112.03 1daz s GLY 48 Ca 0.10 -1.73 0.00 0.00 0.00 0.00 0.00 44.72 43.09 1daz s GLY 48 CO 0.04 -1.61 0.00 0.61 0.00 0.00 0.00 173.10 172.14 1daz n GLY 49 N -0.62 1.38 3.74 0.20 0.00 -0.64 -4.99 105.19 104.27 1daz n GLY 49 Ca 0.01 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 1daz n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1daz s ILE 50 N -0.85 2.11 0.00 -0.61 -1.09 -1.26 -2.22 121.20 117.27 1daz s ILE 50 Ca 0.00 0.08 0.00 0.00 -2.23 0.00 0.00 60.65 58.50 1daz s ILE 50 Cb 0.00 -3.05 0.00 0.00 -1.58 0.00 0.00 42.46 37.83 1daz s ILE 50 CO 0.00 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.33 1daz n GLY 51 N 2.90 3.23 0.00 6.18 0.00 -1.26 -4.93 105.19 111.31 1daz n GLY 51 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1daz n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1daz n GLY 52 N -1.51 0.70 3.65 -0.02 0.00 -0.94 -5.10 105.19 101.96 1daz n GLY 52 Ca 0.00 -1.94 -0.24 0.00 0.00 0.00 0.00 46.02 43.83 1daz n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1daz s PHE 53 N -2.02 2.74 0.04 1.61 0.40 -1.26 -1.61 117.98 117.88 1daz s PHE 53 Ca 0.00 -0.19 0.02 0.00 -0.60 0.00 0.00 56.93 56.16 1daz s PHE 53 Cb 0.00 -1.27 -0.02 0.00 0.51 0.00 0.00 43.02 42.24 1daz s PHE 53 CO 0.00 0.57 -0.07 0.96 0.70 0.00 0.00 175.22 177.38 1daz s ILE 54 N -2.06 0.51 -0.03 0.64 -4.36 0.21 -4.97 121.20 111.13 1daz s ILE 54 Ca 0.29 -1.09 -0.24 0.00 -0.26 0.00 0.00 60.65 59.35 1daz s ILE 54 Cb -0.08 -0.61 -0.04 0.00 1.25 0.00 0.00 42.46 42.99 1daz s ILE 54 CO 0.19 -0.40 0.74 -0.54 0.24 0.00 0.00 174.94 175.17 1daz s LYS 55 N -1.63 4.46 0.12 0.37 1.02 -1.26 -1.73 119.74 121.09 1daz s LYS 55 Ca -0.10 0.97 0.01 0.00 0.02 0.00 0.00 55.97 56.87 1daz s LYS 55 Cb -0.10 -3.43 -0.04 0.00 -0.52 0.00 0.00 37.83 33.74 1daz s LYS 55 CO 0.00 0.11 -0.03 0.14 -0.92 0.00 0.00 175.35 174.65 1daz s VAL 56 N 0.62 0.55 -0.22 3.17 -7.23 -0.38 -4.43 120.40 112.48 1daz s VAL 56 Ca 0.39 -1.93 -0.09 0.00 -1.81 0.00 0.00 61.98 58.55 1daz s VAL 56 Cb -0.19 -1.83 -0.04 0.00 0.56 0.00 0.00 36.38 34.88 1daz s VAL 56 CO 0.20 -0.73 0.11 -0.13 -0.31 0.00 0.00 175.10 174.24 1daz s ARG 57 N -3.90 3.99 -0.29 4.82 0.52 0.24 -1.28 118.95 123.06 1daz s ARG 57 Ca 0.16 -0.32 -0.16 0.00 -0.52 0.00 0.00 55.73 54.89 1daz s ARG 57 Cb 0.06 -3.38 -0.02 0.00 0.52 0.00 0.00 34.95 32.13 1daz s ARG 57 CO -0.02 0.13 0.44 -1.14 0.02 0.00 0.00 175.30 174.73 1daz s GLN 58 N 0.81 3.90 -0.12 3.54 0.74 0.89 -1.01 119.66 128.41 1daz s GLN 58 Ca 0.06 0.03 -0.01 0.00 0.05 0.00 0.00 55.36 55.48 1daz s GLN 58 Cb -0.13 -3.70 -0.02 0.00 1.10 0.00 0.00 33.01 30.25 1daz s GLN 58 CO 0.02 -0.40 -0.09 0.71 -0.55 0.00 0.00 175.29 174.98 1daz s TYR 59 N 2.20 2.90 0.15 1.67 1.51 -0.30 -1.76 117.35 123.72 1daz s TYR 59 Ca 0.17 -0.38 0.01 0.00 -1.01 0.00 0.00 57.07 55.86 1daz s TYR 59 Cb -0.16 -1.85 -0.04 0.00 -0.11 0.00 0.00 41.96 39.81 1daz s TYR 59 CO 0.11 -0.04 0.30 -0.51 -1.11 0.00 0.00 175.55 174.30 1daz s ASP 60 N 0.10 6.36 -1.42 2.29 -0.00 -1.26 -0.99 116.67 121.74 1daz s ASP 60 Ca -0.03 0.26 -0.10 0.00 -0.00 0.00 0.00 52.55 52.67 1daz s ASP 60 Cb -0.14 -1.95 0.04 0.00 -0.00 0.00 0.00 42.92 40.87 1daz s ASP 60 CO 0.04 0.04 1.06 0.00 -0.00 0.00 0.00 175.17 176.31 1daz n GLN 61 N -0.45 -6.65 -3.12 8.23 1.13 -1.13 -4.92 117.38 110.47 1daz n GLN 61 Ca -0.06 0.72 -0.39 0.00 -1.94 0.00 0.00 57.00 55.32 1daz n GLN 61 Cb 0.53 -5.67 -0.05 0.00 0.11 0.00 0.00 30.24 25.16 1daz n GLN 61 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1daz s ILE 62 N -3.34 5.08 0.13 5.09 -1.09 0.88 -4.73 121.20 123.22 1daz s ILE 62 Ca 0.55 1.29 -0.30 0.00 -2.23 0.00 0.00 60.65 59.96 1daz s ILE 62 Cb -0.26 -3.97 -0.06 0.00 -1.58 0.00 0.00 42.46 36.59 1daz s ILE 62 CO 0.78 0.25 0.95 -0.63 -1.23 0.00 0.00 174.94 175.07 1daz s ILE 63 N 0.88 4.44 -0.13 2.92 1.09 -1.26 -1.37 121.20 127.77 1daz s ILE 63 Ca 0.34 2.07 -0.08 0.00 -1.10 0.00 0.00 60.65 61.87 1daz s ILE 63 Cb -0.17 -4.32 0.05 0.00 -1.06 0.00 0.00 42.46 36.96 1daz s ILE 63 CO 0.15 0.35 0.32 -0.51 -0.10 0.00 0.00 174.94 175.15 1daz s ILE 64 N -0.18 -0.03 -0.23 2.92 2.07 0.06 -4.45 121.20 121.35 1daz s ILE 64 Ca 0.46 0.11 -0.09 0.00 -1.41 0.00 0.00 60.65 59.72 1daz s ILE 64 Cb -0.24 -0.49 -0.04 0.00 0.13 0.00 0.00 42.46 41.83 1daz s ILE 64 CO 0.30 0.04 0.12 -0.70 -1.91 0.00 0.00 174.94 172.79 1daz s GLU 65 N 1.19 3.94 -0.28 3.50 2.12 -0.36 -0.89 118.70 127.92 1daz s GLU 65 Ca -0.08 -0.34 -0.00 0.00 0.36 0.00 0.00 54.97 54.90 1daz s GLU 65 Cb -0.09 -3.41 0.05 0.00 0.26 0.00 0.00 34.13 30.94 1daz s GLU 65 CO -0.09 0.05 -0.05 0.42 -0.54 0.00 0.00 175.26 175.05 1daz s ILE 66 N 1.04 2.69 -1.50 -3.70 1.01 0.18 -0.88 121.20 120.05 1daz s ILE 66 Ca 0.06 -1.40 -0.09 0.00 0.00 0.00 0.00 60.65 59.21 1daz s ILE 66 Cb -0.14 -2.53 0.06 0.00 0.01 0.00 0.00 42.46 39.87 1daz s ILE 66 CO 0.04 -0.02 0.76 0.00 0.00 0.00 0.00 174.94 175.71 1daz n ALA 67 N 4.57 -1.59 -0.17 9.38 0.00 -0.64 -0.42 120.51 131.64 1daz n ALA 67 Ca -0.14 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1daz n ALA 67 Cb 0.44 -3.09 0.00 0.00 0.00 0.00 0.00 19.45 16.79 1daz n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1daz n GLY 68 N -1.67 1.98 3.60 0.00 0.00 -1.26 -5.01 105.19 102.82 1daz n GLY 68 Ca -0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1daz n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1daz s HIS 69 N -2.93 3.23 0.41 1.61 4.02 0.44 -5.07 115.29 116.99 1daz s HIS 69 Ca 0.00 0.22 -0.24 0.00 1.02 0.00 0.00 55.06 56.06 1daz s HIS 69 Cb 0.00 -2.44 -0.09 0.00 -1.02 0.00 0.00 32.58 29.04 1daz s HIS 69 CO 0.00 -0.17 1.07 0.15 1.02 0.00 0.00 174.74 176.81 1daz s LYS 70 N 1.82 4.11 0.17 1.40 1.02 -1.26 0.50 119.74 127.50 1daz s LYS 70 Ca 0.10 1.56 -0.20 0.00 0.02 0.00 0.00 55.97 57.44 1daz s LYS 70 Cb -0.16 -2.53 0.05 0.00 -0.52 0.00 0.00 37.83 34.67 1daz s LYS 70 CO 0.10 -0.20 0.56 0.00 -0.92 0.00 0.00 175.35 174.90 1daz s ALA 71 N -1.63 -1.31 -0.11 5.17 0.00 -0.07 -4.80 121.76 119.01 1daz s ALA 71 Ca 0.58 0.17 -0.05 0.00 0.00 0.00 0.00 51.96 52.66 1daz s ALA 71 Cb -0.23 0.84 0.05 0.00 0.00 0.00 0.00 23.12 23.78 1daz s ALA 71 CO 0.29 -0.78 0.25 -1.50 0.00 0.00 0.00 175.76 174.02 1daz s ILE 72 N -3.80 -0.17 0.00 0.00 2.07 -1.26 -0.76 121.20 117.27 1daz s ILE 72 Ca 0.04 0.20 0.00 0.00 -1.41 0.00 0.00 60.65 59.48 1daz s ILE 72 Cb -0.01 -0.40 0.00 0.00 0.13 0.00 0.00 42.46 42.18 1daz s ILE 72 CO -0.09 0.08 0.00 0.61 -1.91 0.00 0.00 174.94 173.64 1daz n GLY 73 N 4.64 1.37 3.71 1.50 0.00 -0.47 -4.87 105.19 111.07 1daz n GLY 73 Ca -0.18 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 1daz n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1daz s THR 74 N -2.32 4.89 -0.07 2.61 2.01 -1.26 -0.08 115.64 121.42 1daz s THR 74 Ca 0.00 1.95 0.03 0.00 0.31 0.00 0.00 61.69 63.98 1daz s THR 74 Cb 0.00 -4.27 0.01 0.00 0.01 0.00 0.00 72.50 68.25 1daz s THR 74 CO 0.00 0.16 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.25 1daz s VAL 75 N 1.11 1.33 -0.14 3.82 1.01 -0.16 -4.48 120.40 122.89 1daz s VAL 75 Ca 0.49 -0.61 -0.07 0.00 0.00 0.00 0.00 61.98 61.79 1daz s VAL 75 Cb -0.20 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1daz s VAL 75 CO 0.25 0.40 0.13 -0.76 0.00 0.00 0.00 175.10 175.11 1daz s LEU 76 N 0.47 4.28 -0.10 3.92 1.43 0.01 -1.14 118.68 127.54 1daz s LEU 76 Ca -0.13 0.38 0.03 0.00 -1.03 0.00 0.00 54.13 53.39 1daz s LEU 76 Cb -0.15 -2.05 0.01 0.00 0.03 0.00 0.00 46.19 44.02 1daz s LEU 76 CO 0.04 0.35 -0.19 -0.69 0.23 0.00 0.00 176.35 176.09 1daz s VAL 77 N -0.68 1.71 -0.01 -1.59 1.01 -0.18 -0.31 120.40 120.35 1daz s VAL 77 Ca 0.13 -0.80 -0.06 0.00 0.00 0.00 0.00 61.98 61.25 1daz s VAL 77 Cb -0.12 -1.51 0.02 0.00 0.00 0.00 0.00 36.38 34.77 1daz s VAL 77 CO 0.02 0.48 0.27 0.61 0.00 0.00 0.00 175.10 176.49 1daz n GLY 78 N 3.79 0.43 2.43 4.51 0.00 -0.87 -0.59 105.19 114.90 1daz n GLY 78 Ca -0.20 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.74 1daz n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1daz n PRO 79 N -0.20 2.26 -2.91 1.61 -0.04 -1.26 -2.30 135.00 132.16 1daz n PRO 79 Ca 0.01 -1.42 -0.38 0.00 -0.04 0.00 0.00 63.50 61.67 1daz n PRO 79 Cb 0.12 -2.37 -0.06 0.00 -0.04 0.00 0.00 33.50 31.15 1daz n PRO 79 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1daz s THR 80 N 2.69 4.30 0.16 0.52 -1.32 -1.26 -4.96 115.64 115.77 1daz s THR 80 Ca 0.48 1.75 0.33 0.00 -1.21 0.00 0.00 61.69 63.04 1daz s THR 80 Cb 0.15 -4.11 0.38 0.00 -1.51 0.00 0.00 72.50 67.41 1daz s THR 80 CO -0.03 0.38 2.00 1.55 -2.21 0.00 0.00 174.62 176.32 1daz h PRO 81 N 3.88 0.00 -3.26 7.08 0.13 -1.98 -3.45 132.00 134.41 1daz h PRO 81 Ca -0.47 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.51 1daz h PRO 81 Cb 1.20 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.10 1daz h PRO 81 CO 0.66 0.03 -0.43 0.08 -0.23 0.00 0.00 178.00 178.11 1daz s VAL 82 N -3.73 0.04 0.00 1.56 1.01 -1.26 -5.11 120.40 112.91 1daz s VAL 82 Ca 0.00 -0.32 -0.30 0.00 0.00 0.00 0.00 61.98 61.36 1daz s VAL 82 Cb 0.10 -0.42 -0.05 0.00 0.00 0.00 0.00 36.38 36.01 1daz s VAL 82 CO 0.54 -0.17 1.34 0.20 0.00 0.00 0.00 175.10 177.01 1daz s ASN 83 N -0.65 6.91 -0.12 3.32 0.01 -1.26 -4.77 114.94 118.38 1daz s ASN 83 Ca -0.07 2.05 0.02 0.00 -0.71 0.00 0.00 52.86 54.15 1daz s ASN 83 Cb -0.04 -2.56 0.01 0.00 0.41 0.00 0.00 41.25 39.07 1daz s ASN 83 CO 0.01 -0.66 -0.18 -0.63 -1.51 0.00 0.00 177.10 174.13 1daz s ILE 84 N 2.13 1.72 -0.37 0.60 1.01 0.54 -0.25 121.20 126.58 1daz s ILE 84 Ca 0.62 -0.78 -0.15 0.00 0.00 0.00 0.00 60.65 60.34 1daz s ILE 84 Cb -0.30 -1.54 -0.00 0.00 0.01 0.00 0.00 42.46 40.62 1daz s ILE 84 CO 0.26 0.48 0.32 -0.63 0.00 0.00 0.00 174.94 175.37 1daz s ILE 85 N 0.88 5.22 0.52 2.92 -1.09 0.06 -1.02 121.20 128.69 1daz s ILE 85 Ca -0.08 -0.24 0.01 0.00 -2.23 0.00 0.00 60.65 58.12 1daz s ILE 85 Cb -0.15 -3.83 0.10 0.00 -1.58 0.00 0.00 42.46 36.99 1daz s ILE 85 CO -0.01 -0.15 0.72 0.61 -1.23 0.00 0.00 174.94 174.88 1daz n GLY 86 N 5.07 0.93 0.34 6.18 0.00 -1.07 -1.20 105.19 115.44 1daz n GLY 86 Ca -0.10 -2.05 0.12 0.00 0.00 0.00 0.00 46.02 43.99 1daz n GLY 86 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1daz h ARG 87 N 0.00 0.24 -0.34 1.61 3.08 -0.85 -0.68 114.38 117.44 1daz h ARG 87 Ca -0.24 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 59.87 1daz h ARG 87 Cb 0.92 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.90 1daz h ARG 87 CO 0.27 0.16 0.24 -2.95 -1.07 0.00 0.00 179.97 176.62 1daz h ASN 88 N 0.25 0.12 0.00 7.04 -1.07 -1.76 -1.90 115.58 118.26 1daz h ASN 88 Ca 0.20 0.00 -0.32 0.00 0.07 0.00 0.00 56.30 56.25 1daz h ASN 88 Cb 0.49 -0.03 -0.06 0.00 -2.07 0.00 0.00 38.32 36.65 1daz h ASN 88 CO -0.04 0.08 -2.22 0.18 0.07 0.00 0.00 177.43 175.50 1daz n LEU 89 N -4.47 0.51 -0.16 6.14 4.77 -0.78 -4.31 117.00 118.70 1daz n LEU 89 Ca 0.05 -0.02 0.02 0.00 -0.03 0.00 0.00 56.01 56.03 1daz n LEU 89 Cb 0.32 0.23 0.30 0.00 -2.33 0.00 0.00 43.42 41.94 1daz n LEU 89 CO 0.35 0.51 1.22 -0.07 -1.33 0.00 0.00 177.39 178.07 1daz h LEU 90 N 0.00 0.74 -1.02 2.23 3.38 -0.93 -0.89 115.31 118.82 1daz h LEU 90 Ca -0.48 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.40 1daz h LEU 90 Cb 2.03 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 42.59 1daz h LEU 90 CO 0.01 0.53 -0.11 0.71 0.09 0.00 0.00 178.44 179.67 1daz h THR 91 N 0.87 1.24 -0.16 0.22 1.35 -1.57 -1.30 112.91 113.57 1daz h THR 91 Ca 0.25 -1.05 -0.09 0.00 -0.55 0.00 0.00 66.41 64.98 1daz h THR 91 Cb -0.04 1.10 -0.01 0.00 -1.73 0.00 0.00 68.15 67.46 1daz h THR 91 CO -0.06 0.35 -0.29 1.56 -0.25 0.00 0.00 175.52 176.82 1daz h GLN 92 N 0.54 0.30 -0.47 4.72 4.20 -1.36 -2.43 115.11 120.60 1daz h GLN 92 Ca 0.10 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1daz h GLN 92 Cb 0.51 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.27 1daz h GLN 92 CO 0.03 0.57 0.00 0.44 -0.67 0.00 0.00 178.83 179.20 1daz n ILE 93 N -4.12 0.62 -2.65 2.54 -5.35 -0.97 -4.94 119.36 104.50 1daz n ILE 93 Ca -0.01 -0.63 -0.16 0.00 -0.27 0.00 0.00 62.75 61.68 1daz n ILE 93 Cb 0.40 0.32 0.02 0.00 -1.74 0.00 0.00 39.64 38.64 1daz n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1daz n GLY 94 N 1.25 -0.23 3.76 3.28 0.00 -0.92 -5.00 105.19 107.34 1daz n GLY 94 Ca 0.16 -0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 1daz n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1daz s ALA 95 N -2.93 3.30 0.11 4.61 0.00 -0.51 -5.03 121.76 121.29 1daz s ALA 95 Ca 0.15 0.62 0.01 0.00 0.00 0.00 0.00 51.96 52.74 1daz s ALA 95 Cb -0.07 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 1daz s ALA 95 CO 0.19 0.15 -0.02 0.95 0.00 0.00 0.00 175.76 177.03 1daz s THR 96 N -1.33 0.45 -0.13 0.00 -4.23 -1.26 -4.72 115.64 104.41 1daz s THR 96 Ca 0.45 -1.91 -0.05 0.00 -1.18 0.00 0.00 61.69 59.00 1daz s THR 96 Cb -0.24 -1.81 -0.04 0.00 1.34 0.00 0.00 72.50 71.75 1daz s THR 96 CO 0.30 -0.74 0.04 -0.76 -0.54 0.00 0.00 174.62 172.93 1daz s LEU 97 N -3.04 3.77 -0.03 4.79 1.43 -1.26 -5.10 118.68 119.24 1daz s LEU 97 Ca 0.16 0.15 0.01 0.00 -1.03 0.00 0.00 54.13 53.41 1daz s LEU 97 Cb 0.07 -1.91 0.02 0.00 0.03 0.00 0.00 46.19 44.40 1daz s LEU 97 CO -0.03 0.29 -0.02 0.20 0.23 0.00 0.00 176.35 177.02 1daz s ASN 98 N -0.32 0.51 0.00 2.29 -0.87 -1.26 -5.30 114.94 109.99 1daz s ASN 98 Ca 0.08 -0.05 0.00 0.00 -1.57 0.00 0.00 52.86 51.32 1daz s ASN 98 Cb -0.12 -0.22 0.00 0.00 -0.02 0.00 0.00 41.25 40.89 1daz s ASN 98 CO 0.02 -0.06 0.00 2.22 -2.57 0.00 0.00 177.10 176.71