#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zyz s ASP 2 N 0.00 4.47 0.40 7.83 -1.08 -1.26 -5.00 116.67 122.03 2zyz s ASP 2 Ca 0.00 -1.91 0.15 0.00 -0.52 0.00 0.00 52.55 50.27 2zyz s ASP 2 Cb 0.00 -1.37 0.83 0.00 -1.46 0.00 0.00 42.92 40.93 2zyz s ASP 2 CO 0.00 -0.37 1.87 1.62 0.52 0.00 0.00 175.17 178.81 2zyz h VAL 3 N 6.58 1.15 -0.05 1.11 3.04 -2.05 -0.83 116.25 125.21 2zyz h VAL 3 Ca -0.08 -1.12 -0.03 0.00 -1.01 0.00 0.00 66.70 64.45 2zyz h VAL 3 Cb 1.02 1.62 0.00 0.00 -2.01 0.00 0.00 31.29 31.92 2zyz h VAL 3 CO 0.50 0.31 -0.08 -0.07 -1.01 0.00 0.00 177.57 177.22 2zyz h LEU 4 N 0.00 0.15 -1.37 3.16 3.38 -1.97 -2.52 115.31 116.14 2zyz h LEU 4 Ca -0.00 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.41 2zyz h LEU 4 Cb 0.59 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 2zyz h LEU 4 CO 0.04 0.68 0.37 1.56 0.09 0.00 0.00 178.44 181.18 2zyz h GLN 5 N -0.37 0.79 0.00 1.13 4.20 -1.95 -2.29 115.11 116.63 2zyz h GLN 5 Ca 0.00 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 2zyz h GLN 5 Cb 0.65 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.26 2zyz h GLN 5 CO 0.02 0.54 -0.04 1.49 -0.67 0.00 0.00 178.83 180.17 2zyz h GLU 6 N 0.81 0.00 -0.11 1.46 4.57 -0.92 -1.36 114.58 119.03 2zyz h GLU 6 Ca 0.22 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.33 2zyz h GLU 6 Cb -0.06 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.52 2zyz h GLU 6 CO -0.04 0.04 -0.22 1.96 -1.18 0.00 0.00 179.01 179.56 2zyz h GLN 7 N 0.00 0.19 -0.02 1.92 1.08 -0.98 -1.72 115.11 115.58 2zyz h GLN 7 Ca -0.00 -0.06 -0.00 0.00 -1.45 0.00 0.00 58.65 57.14 2zyz h GLN 7 Cb 0.07 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.48 2zyz h GLN 7 CO 0.01 0.41 -0.00 0.28 -0.95 0.00 0.00 178.83 178.58 2zyz h VAL 8 N 0.18 1.27 -0.44 -0.54 2.07 -1.31 -1.73 116.25 115.76 2zyz h VAL 8 Ca 0.03 -0.82 0.04 0.00 0.82 0.00 0.00 66.70 66.77 2zyz h VAL 8 Cb 0.50 1.78 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 2zyz h VAL 8 CO 0.03 0.22 0.20 -0.26 0.02 0.00 0.00 177.57 177.78 2zyz h PHE 9 N -0.29 0.36 -0.39 1.57 0.04 -1.39 -1.19 116.94 115.65 2zyz h PHE 9 Ca 0.01 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.80 2zyz h PHE 9 Cb 0.35 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.38 2zyz h PHE 9 CO 0.04 0.17 0.25 0.87 -0.60 0.00 0.00 178.31 179.05 2zyz h LYS 10 N 0.40 0.50 0.27 1.51 1.57 -1.33 -0.64 116.57 118.86 2zyz h LYS 10 Ca 0.19 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2zyz h LYS 10 Cb 0.13 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.33 2zyz h LYS 10 CO -0.16 0.33 -0.14 0.22 -0.57 0.00 0.00 179.45 179.14 2zyz h ASP 11 N 0.52 -0.33 -0.75 0.86 3.58 -0.87 -1.80 116.42 117.64 2zyz h ASP 11 Ca 0.14 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.58 2zyz h ASP 11 Cb -0.05 0.09 -0.04 0.00 1.72 0.00 0.00 39.33 41.05 2zyz h ASP 11 CO -0.04 -0.23 0.37 -0.07 -2.88 0.00 0.00 179.24 176.40 2zyz h LEU 12 N -0.37 0.98 -1.25 2.28 3.38 -1.10 -2.61 115.31 116.61 2zyz h LEU 12 Ca -0.04 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 2zyz h LEU 12 Cb 0.29 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2zyz h LEU 12 CO 0.06 0.82 -0.22 0.11 0.09 0.00 0.00 178.44 179.30 2zyz h LYS 13 N 1.08 0.24 0.00 1.13 1.57 -0.87 -2.29 116.57 117.42 2zyz h LYS 13 Ca 0.26 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2zyz h LYS 13 Cb 0.10 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.38 2zyz h LYS 13 CO -0.03 0.45 0.00 0.66 -0.57 0.00 0.00 179.45 179.96 2zyz h SER 14 N 0.22 0.00 0.00 0.86 4.64 -0.93 -2.95 113.55 115.39 2zyz h SER 14 Ca 0.04 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2zyz h SER 14 Cb 0.51 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2zyz h SER 14 CO 0.03 0.00 -0.35 0.54 -0.87 0.00 0.00 176.83 176.19 2zyz n ARG 15 N -2.77 1.48 -0.61 4.77 1.74 -0.92 -4.98 116.66 115.37 2zyz n ARG 15 Ca -0.01 -3.07 0.00 0.00 -0.77 0.00 0.00 57.85 54.01 2zyz n ARG 15 Cb 0.16 -1.57 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 2zyz n ARG 15 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2zyz n GLY 16 N -1.20 0.67 3.77 -0.13 0.00 -1.11 -5.05 105.19 102.14 2zyz n GLY 16 Ca 0.18 -0.22 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 2zyz n GLY 16 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2zyz s PHE 17 N -2.00 3.43 -0.12 1.61 0.08 -0.91 -4.68 117.98 115.39 2zyz s PHE 17 Ca 0.00 1.69 -0.05 0.00 0.12 0.00 0.00 56.93 58.69 2zyz s PHE 17 Cb 0.00 -3.16 -0.04 0.00 -0.57 0.00 0.00 43.02 39.25 2zyz s PHE 17 CO 0.00 -0.50 0.05 0.21 -0.10 0.00 0.00 175.22 174.88 2zyz s LYS 18 N -2.05 3.41 -0.20 0.44 2.36 -0.24 -4.41 119.74 119.05 2zyz s LYS 18 Ca 0.52 -0.33 -0.29 0.00 -2.55 0.00 0.00 55.97 53.33 2zyz s LYS 18 Cb -0.25 -3.01 0.00 0.00 -1.05 0.00 0.00 37.83 33.51 2zyz s LYS 18 CO 0.32 0.58 1.01 0.42 1.55 0.00 0.00 175.35 179.24 2zyz s ILE 19 N -0.52 4.72 -0.19 5.43 -1.09 -1.26 -0.89 121.20 127.41 2zyz s ILE 19 Ca 0.10 1.99 -0.09 0.00 -2.23 0.00 0.00 60.65 60.42 2zyz s ILE 19 Cb -0.12 -4.29 -0.21 0.00 -1.58 0.00 0.00 42.46 36.26 2zyz s ILE 19 CO 0.02 -0.12 0.12 -0.38 -1.23 0.00 0.00 174.94 173.35 2zyz n ILE 20 N 5.11 1.64 -3.63 2.92 2.08 0.16 -4.97 119.36 122.66 2zyz n ILE 20 Ca 0.11 -0.47 -0.12 0.00 0.56 0.00 0.00 62.75 62.82 2zyz n ILE 20 Cb 0.47 -1.75 -0.07 0.00 -0.75 0.00 0.00 39.64 37.54 2zyz n ILE 20 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 2zyz s GLU 21 N -2.50 0.72 -0.27 0.38 2.12 -1.12 -4.97 118.70 113.06 2zyz s GLU 21 Ca -0.28 0.85 -0.10 0.00 0.36 0.00 0.00 54.97 55.79 2zyz s GLU 21 Cb 0.08 0.35 -0.05 0.00 0.26 0.00 0.00 34.13 34.77 2zyz s GLU 21 CO 0.66 -0.09 0.17 -0.65 -0.54 0.00 0.00 175.26 174.81 2zyz s GLN 22 N 0.32 3.94 -0.04 4.30 -0.21 -1.26 -0.38 119.66 126.32 2zyz s GLN 22 Ca 0.01 -0.33 0.17 0.00 0.02 0.00 0.00 55.36 55.23 2zyz s GLN 22 Cb -0.05 -3.58 -0.21 0.00 1.00 0.00 0.00 33.01 30.17 2zyz s GLN 22 CO -0.02 -0.12 0.54 1.28 -2.12 0.00 0.00 175.29 174.86 2zyz n LEU 23 N 4.84 0.53 -3.84 2.90 4.77 -0.07 -4.96 117.00 121.16 2zyz n LEU 23 Ca -0.15 0.24 -0.04 0.00 -0.03 0.00 0.00 56.01 56.03 2zyz n LEU 23 Cb 0.52 0.20 0.01 0.00 -2.33 0.00 0.00 43.42 41.82 2zyz n LEU 23 CO 0.33 0.28 0.73 -1.81 -1.33 0.00 0.00 177.39 175.59 2zyz s ASP 24 N -5.62 -0.04 0.29 -1.43 -0.00 -1.13 -4.99 116.67 103.74 2zyz s ASP 24 Ca -0.06 -0.70 -0.30 0.00 -0.00 0.00 0.00 52.55 51.49 2zyz s ASP 24 Cb 0.08 0.57 -0.13 0.00 -0.00 0.00 0.00 42.92 43.45 2zyz s ASP 24 CO 0.83 -1.11 1.37 -0.67 -0.00 0.00 0.00 175.17 175.59 2zyz n ASP 25 N -1.08 2.85 0.00 0.27 2.03 -1.26 -2.77 116.55 116.59 2zyz n ASP 25 Ca -0.05 1.17 0.00 0.00 0.52 0.00 0.00 54.79 56.43 2zyz n ASP 25 Cb 0.60 -1.47 0.00 0.00 -0.72 0.00 0.00 41.12 39.53 2zyz n ASP 25 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2zyz n LYS 26 N 1.43 0.00 -4.72 -0.67 5.02 -1.26 -4.94 118.16 113.02 2zyz n LYS 26 Ca 0.08 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.07 2zyz n LYS 26 Cb 0.34 -1.63 -0.17 0.00 -0.02 0.00 0.00 35.03 33.55 2zyz n LYS 26 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2zyz s ILE 27 N -1.98 1.76 0.09 -0.18 1.01 -1.12 -1.11 121.20 119.67 2zyz s ILE 27 Ca 0.00 -0.82 -0.15 0.00 0.00 0.00 0.00 60.65 59.68 2zyz s ILE 27 Cb 0.00 -1.56 0.03 0.00 0.01 0.00 0.00 42.46 40.93 2zyz s ILE 27 CO 0.00 0.49 0.36 0.72 0.00 0.00 0.00 174.94 176.51 2zyz s PHE 28 N 0.74 -0.16 -0.13 3.97 -0.71 -0.86 -0.89 117.98 119.94 2zyz s PHE 28 Ca -0.11 -0.07 -0.05 0.00 -1.04 0.00 0.00 56.93 55.66 2zyz s PHE 28 Cb -0.16 0.18 -0.04 0.00 -1.21 0.00 0.00 43.02 41.79 2zyz s PHE 28 CO 0.02 -0.61 0.05 0.42 -1.34 0.00 0.00 175.22 173.75 2zyz s ILE 29 N -3.26 4.67 0.04 -4.49 1.01 0.49 -0.58 121.20 119.09 2zyz s ILE 29 Ca -0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 60.65 60.53 2zyz s ILE 29 Cb 0.01 -3.04 -0.02 0.00 0.01 0.00 0.00 42.46 39.42 2zyz s ILE 29 CO -0.08 0.55 0.03 0.00 0.00 0.00 0.00 174.94 175.44 2zyz s ALA 30 N -0.39 0.20 -0.02 9.38 0.00 -0.93 -0.67 121.76 129.34 2zyz s ALA 30 Ca 0.09 -0.84 0.02 0.00 0.00 0.00 0.00 51.96 51.23 2zyz s ALA 30 Cb -0.12 0.26 0.00 0.00 0.00 0.00 0.00 23.12 23.26 2zyz s ALA 30 CO 0.02 -0.32 -0.06 -2.00 0.00 0.00 0.00 175.76 173.40 2zyz s GLU 31 N -3.02 0.64 -0.37 0.00 2.12 -0.06 -1.48 118.70 116.52 2zyz s GLU 31 Ca -0.01 -0.20 0.05 0.00 0.36 0.00 0.00 54.97 55.16 2zyz s GLU 31 Cb 0.01 -0.63 0.17 0.00 0.26 0.00 0.00 34.13 33.94 2zyz s GLU 31 CO -0.07 0.08 0.47 0.21 -0.54 0.00 0.00 175.26 175.42 2zyz s LYS 32 N 0.16 0.68 0.00 4.30 2.20 -1.26 -1.08 119.74 124.74 2zyz s LYS 32 Ca -0.02 -0.52 0.00 0.00 -0.36 0.00 0.00 55.97 55.07 2zyz s LYS 32 Cb -0.06 -0.38 0.00 0.00 -1.51 0.00 0.00 37.83 35.88 2zyz s LYS 32 CO -0.00 -1.17 0.00 1.63 -0.36 0.00 0.00 175.35 175.44 2zyz n LYS 33 N 4.44 0.00 -3.47 4.03 5.02 -1.26 -4.86 118.16 122.06 2zyz n LYS 33 Ca 0.10 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.25 2zyz n LYS 33 Cb 0.50 -0.80 -0.04 0.00 -0.02 0.00 0.00 35.03 34.67 2zyz n LYS 33 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2zyz s GLU 34 N 0.00 1.12 0.07 1.97 -1.05 -1.26 -5.13 118.70 114.43 2zyz s GLU 34 Ca 0.00 -0.14 -0.23 0.00 -0.15 0.00 0.00 54.97 54.45 2zyz s GLU 34 Cb 0.00 0.52 -0.06 0.00 -0.44 0.00 0.00 34.13 34.15 2zyz s GLU 34 CO 0.00 -0.44 0.70 1.03 0.95 0.00 0.00 175.26 177.50 2zyz s ARG 35 N -2.56 4.43 0.16 -4.83 0.52 -1.26 -4.43 118.95 110.97 2zyz s ARG 35 Ca -0.04 0.96 0.10 0.00 -0.52 0.00 0.00 55.73 56.24 2zyz s ARG 35 Cb -0.01 -3.31 -0.04 0.00 0.52 0.00 0.00 34.95 32.12 2zyz s ARG 35 CO -0.03 0.45 -0.23 0.71 0.02 0.00 0.00 175.30 176.22 2zyz s TYR 36 N -0.59 2.16 -0.30 -0.53 2.02 -0.55 -4.26 117.35 115.30 2zyz s TYR 36 Ca 0.34 -0.39 -0.11 0.00 -0.37 0.00 0.00 57.07 56.54 2zyz s TYR 36 Cb -0.21 -1.11 -0.04 0.00 -0.40 0.00 0.00 41.96 40.21 2zyz s TYR 36 CO 0.22 0.40 0.20 -1.17 -1.57 0.00 0.00 175.55 173.63 2zyz s LEU 37 N -2.45 4.14 -0.10 -1.29 2.96 -0.49 -2.19 118.68 119.26 2zyz s LEU 37 Ca 0.17 -0.16 -0.06 0.00 -0.22 0.00 0.00 54.13 53.86 2zyz s LEU 37 Cb -0.08 -2.11 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 2zyz s LEU 37 CO 0.08 -0.11 0.13 -0.36 -1.32 0.00 0.00 176.35 174.77 2zyz s PHE 38 N 1.74 3.55 -0.16 5.38 0.08 0.26 -1.28 117.98 127.54 2zyz s PHE 38 Ca 0.07 0.48 -0.01 0.00 0.12 0.00 0.00 56.93 57.58 2zyz s PHE 38 Cb -0.16 -1.91 0.04 0.00 -0.57 0.00 0.00 43.02 40.42 2zyz s PHE 38 CO 0.10 0.70 -0.03 -0.47 -0.10 0.00 0.00 175.22 175.43 2zyz s TYR 39 N -1.06 1.44 -0.07 0.36 5.04 -0.60 -2.02 117.35 120.44 2zyz s TYR 39 Ca 0.16 -0.93 -0.26 0.00 -2.44 0.00 0.00 57.07 53.61 2zyz s TYR 39 Cb -0.12 -1.19 -0.03 0.00 0.35 0.00 0.00 41.96 40.97 2zyz s TYR 39 CO 0.06 -0.58 0.81 0.08 -1.34 0.00 0.00 175.55 174.57 2zyz s VAL 40 N 1.72 4.96 -0.29 3.14 1.01 -0.26 -1.41 120.40 129.27 2zyz s VAL 40 Ca 0.01 1.65 0.02 0.00 0.00 0.00 0.00 61.98 63.66 2zyz s VAL 40 Cb -0.15 -4.14 0.07 0.00 0.00 0.00 0.00 36.38 32.16 2zyz s VAL 40 CO -0.07 0.18 -0.05 -0.04 0.00 0.00 0.00 175.10 175.11 2zyz s MET 41 N 1.14 2.13 0.10 2.72 -1.94 -0.09 -4.90 119.30 118.47 2zyz s MET 41 Ca 0.42 -1.44 -0.23 0.00 -1.71 0.00 0.00 55.69 52.72 2zyz s MET 41 Cb -0.18 -3.02 -0.07 0.00 2.01 0.00 0.00 34.83 33.57 2zyz s MET 41 CO 0.20 -0.66 0.70 0.08 -0.01 0.00 0.00 175.02 175.32 2zyz s VAL 42 N 1.09 4.60 0.13 -6.03 1.01 -1.26 -1.52 120.40 118.43 2zyz s VAL 42 Ca -0.04 1.51 -0.35 0.00 0.00 0.00 0.00 61.98 63.09 2zyz s VAL 42 Cb -0.20 -4.05 -0.15 0.00 0.00 0.00 0.00 36.38 31.98 2zyz s VAL 42 CO -0.05 0.49 1.45 1.21 0.00 0.00 0.00 175.10 178.20 2zyz n GLU 43 N 2.00 1.67 0.00 2.72 2.13 -0.12 -1.57 120.64 127.46 2zyz n GLU 43 Ca -0.06 0.60 0.00 0.00 0.66 0.00 0.00 57.16 58.36 2zyz n GLU 43 Cb 0.50 -2.30 0.00 0.00 0.27 0.00 0.00 31.44 29.91 2zyz n GLU 43 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2zyz n GLY 44 N 2.93 1.22 3.30 8.31 0.00 -1.26 -4.82 105.19 114.87 2zyz n GLY 44 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 2zyz n GLY 44 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zyz s VAL 45 N -2.38 4.68 0.15 1.61 1.01 -0.61 -5.05 120.40 119.80 2zyz s VAL 45 Ca 0.00 -1.39 -0.20 0.00 0.00 0.00 0.00 61.98 60.38 2zyz s VAL 45 Cb 0.00 -3.91 -0.07 0.00 0.00 0.00 0.00 36.38 32.40 2zyz s VAL 45 CO 0.00 -0.64 0.66 -1.61 0.00 0.00 0.00 175.10 173.51 2zyz s GLU 46 N 1.51 4.29 0.21 2.72 2.02 -1.26 -4.65 118.70 123.52 2zyz s GLU 46 Ca 0.04 0.86 0.11 0.00 0.02 0.00 0.00 54.97 55.99 2zyz s GLU 46 Cb -0.25 -3.11 -0.04 0.00 0.10 0.00 0.00 34.13 30.82 2zyz s GLU 46 CO 0.03 0.54 -0.21 0.14 0.02 0.00 0.00 175.26 175.77 2zyz s VAL 47 N -1.27 2.23 0.67 2.63 -7.23 -1.26 -5.13 120.40 111.04 2zyz s VAL 47 Ca 0.35 -2.09 -0.14 0.00 -1.81 0.00 0.00 61.98 58.30 2zyz s VAL 47 Cb -0.19 -2.09 0.00 0.00 0.56 0.00 0.00 36.38 34.66 2zyz s VAL 47 CO 0.21 -0.24 1.09 0.42 -0.31 0.00 0.00 175.10 176.27 2zyz s THR 48 N -1.98 3.48 0.38 5.32 -4.23 -1.26 -4.90 115.64 112.45 2zyz s THR 48 Ca 0.22 0.62 0.08 0.00 -1.18 0.00 0.00 61.69 61.43 2zyz s THR 48 Cb -0.07 -3.16 0.30 0.00 1.34 0.00 0.00 72.50 70.91 2zyz s THR 48 CO 0.10 -0.49 1.97 -0.29 -0.54 0.00 0.00 174.62 175.37 2zyz h ILE 49 N -0.18 1.00 -0.57 2.99 6.09 -2.00 -2.39 117.51 122.46 2zyz h ILE 49 Ca -0.46 -0.23 -0.03 0.00 -1.37 0.00 0.00 64.86 62.78 2zyz h ILE 49 Cb 1.23 0.27 -0.03 0.00 0.47 0.00 0.00 36.82 38.77 2zyz h ILE 49 CO 0.55 0.12 0.25 1.56 -3.07 0.00 0.00 178.15 177.56 2zyz h GLN 50 N 0.67 0.83 0.13 2.19 7.50 -1.98 -0.58 115.11 123.86 2zyz h GLN 50 Ca 0.30 -0.13 -0.01 0.00 0.50 0.00 0.00 58.65 59.31 2zyz h GLN 50 Cb 0.31 -0.14 0.00 0.00 0.05 0.00 0.00 27.48 27.69 2zyz h GLN 50 CO -0.10 0.69 -0.06 1.15 -1.50 0.00 0.00 178.83 179.01 2zyz h THR 51 N 0.77 0.88 -0.56 -0.54 2.02 -1.80 -1.59 112.91 112.08 2zyz h THR 51 Ca 0.19 -0.06 0.07 0.00 0.77 0.00 0.00 66.41 67.38 2zyz h THR 51 Cb 0.15 0.92 -0.06 0.00 -1.74 0.00 0.00 68.15 67.43 2zyz h THR 51 CO -0.02 0.01 0.26 0.25 0.37 0.00 0.00 175.52 176.39 2zyz h LEU 52 N -0.21 0.33 -1.56 2.58 5.85 -1.33 -1.68 115.31 119.29 2zyz h LEU 52 Ca -0.02 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 2zyz h LEU 52 Cb 0.16 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 2zyz h LEU 52 CO 0.03 0.22 0.02 -0.07 -0.34 0.00 0.00 178.44 178.29 2zyz h LEU 53 N 0.48 0.27 -0.27 2.25 3.38 -0.91 -1.78 115.31 118.74 2zyz h LEU 53 Ca 0.27 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.11 2zyz h LEU 53 Cb 0.24 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2zyz h LEU 53 CO -0.22 0.31 -0.20 -1.28 0.09 0.00 0.00 178.44 177.14 2zyz h SER 54 N 0.29 0.64 -0.60 -0.43 0.87 -0.41 -0.47 113.55 113.43 2zyz h SER 54 Ca 0.07 -0.44 0.01 0.00 -1.23 0.00 0.00 61.79 60.20 2zyz h SER 54 Cb 0.18 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 2zyz h SER 54 CO 0.00 0.95 0.39 0.58 -0.53 0.00 0.00 176.83 178.22 2zyz h VAL 55 N 0.33 1.13 -0.49 2.23 2.07 -1.14 -0.08 116.25 120.31 2zyz h VAL 55 Ca 0.05 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 2zyz h VAL 55 Cb 0.74 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 2zyz h VAL 55 CO 0.05 0.14 0.25 0.40 0.02 0.00 0.00 177.57 178.44 2zyz h ILE 56 N 0.79 1.18 -1.01 4.57 2.04 -1.13 -1.77 117.51 122.18 2zyz h ILE 56 Ca 0.23 -0.47 0.02 0.00 1.00 0.00 0.00 64.86 65.64 2zyz h ILE 56 Cb -0.06 0.60 -0.05 0.00 -0.74 0.00 0.00 36.82 36.57 2zyz h ILE 56 CO -0.06 0.19 0.66 -1.13 0.00 0.00 0.00 178.15 177.81 2zyz h ASN 57 N 0.64 1.13 -0.67 1.72 -1.24 -0.64 -2.37 115.58 114.15 2zyz h ASN 57 Ca 0.17 -0.02 0.10 0.00 0.71 0.00 0.00 56.30 57.26 2zyz h ASN 57 Cb 0.08 -0.27 -0.07 0.00 0.73 0.00 0.00 38.32 38.78 2zyz h ASN 57 CO -0.03 0.79 0.30 0.24 -1.29 0.00 0.00 177.43 177.45 2zyz h MET 58 N 1.32 0.50 -0.19 6.67 2.86 -0.34 -0.98 114.93 124.77 2zyz h MET 58 Ca 0.39 -0.03 0.04 0.00 -2.06 0.00 0.00 59.70 58.04 2zyz h MET 58 Cb -0.07 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.44 2zyz h MET 58 CO -0.11 0.33 -0.05 0.78 1.06 0.00 0.00 176.91 178.92 2zyz h GLY 59 N 0.52 0.13 0.78 8.32 0.00 -0.83 -0.99 103.07 111.00 2zyz h GLY 59 Ca 0.34 0.07 0.04 0.00 0.00 0.00 0.00 47.33 47.77 2zyz h GLY 59 CO -0.29 -0.08 0.29 0.83 0.00 0.00 0.00 176.54 177.29 2zyz h GLU 60 N -0.01 0.55 0.24 4.80 5.08 -1.07 -0.43 114.58 123.74 2zyz h GLU 60 Ca 0.09 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2zyz h GLU 60 Cb 0.15 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2zyz h GLU 60 CO -0.20 0.36 -0.17 1.15 -1.00 0.00 0.00 179.01 179.15 2zyz h THR 61 N 0.56 0.64 0.00 1.13 2.02 -0.78 -2.54 112.91 113.95 2zyz h THR 61 Ca 0.23 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.41 2zyz h THR 61 Cb 0.10 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.15 2zyz h THR 61 CO -0.14 0.00 0.00 0.18 0.37 0.00 0.00 175.52 175.93 2zyz n LEU 62 N -5.29 0.00 -3.56 2.58 4.32 -0.42 -4.90 117.00 109.73 2zyz n LEU 62 Ca -0.09 0.14 -0.19 0.00 -0.02 0.00 0.00 56.01 55.85 2zyz n LEU 62 Cb 0.21 -0.14 0.06 0.00 -1.62 0.00 0.00 43.42 41.93 2zyz n LEU 62 CO 0.32 -0.04 0.02 -0.24 -1.22 0.00 0.00 177.39 176.24 2zyz n SER 63 N -1.14 -1.69 -3.87 -1.43 2.88 -0.32 -5.03 113.62 103.03 2zyz n SER 63 Ca 0.14 -0.72 -0.16 0.00 -1.33 0.00 0.00 58.87 56.81 2zyz n SER 63 Cb 0.13 -4.59 -0.15 0.00 -0.75 0.00 0.00 64.21 58.84 2zyz n SER 63 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 2zyz s MET 64 N -5.65 0.28 0.46 -1.46 -1.94 -0.35 -5.00 119.30 105.63 2zyz s MET 64 Ca 0.01 -0.01 -0.24 0.00 -1.71 0.00 0.00 55.69 53.74 2zyz s MET 64 Cb -0.00 -0.37 -0.07 0.00 2.01 0.00 0.00 34.83 36.40 2zyz s MET 64 CO 0.77 -0.04 1.26 -1.25 -0.01 0.00 0.00 175.02 175.75 2zyz s PRO 65 N 0.50 3.69 -0.15 2.03 0.04 -1.26 -4.37 135.00 135.49 2zyz s PRO 65 Ca -0.05 2.03 -0.10 0.00 0.04 0.00 0.00 61.00 62.91 2zyz s PRO 65 Cb -0.08 -2.50 -0.05 0.00 0.04 0.00 0.00 34.50 31.91 2zyz s PRO 65 CO -0.01 -0.68 0.20 0.08 0.04 0.00 0.00 177.00 176.63 2zyz s VAL 66 N -1.38 5.38 -0.09 -0.36 1.01 -1.26 -1.40 120.40 122.30 2zyz s VAL 66 Ca 0.63 0.34 0.02 0.00 0.00 0.00 0.00 61.98 62.97 2zyz s VAL 66 Cb -0.35 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.53 2zyz s VAL 66 CO 0.43 0.50 -0.14 -0.69 0.00 0.00 0.00 175.10 175.20 2zyz s VAL 67 N -0.18 1.33 -0.18 2.92 1.01 -0.41 -2.41 120.40 122.47 2zyz s VAL 67 Ca 0.14 -0.56 -0.19 0.00 0.00 0.00 0.00 61.98 61.37 2zyz s VAL 67 Cb -0.12 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 2zyz s VAL 67 CO 0.03 0.40 0.54 -0.76 0.00 0.00 0.00 175.10 175.31 2zyz s LEU 68 N 0.85 4.17 -0.40 3.92 1.43 0.08 -1.56 118.68 127.17 2zyz s LEU 68 Ca -0.10 0.75 -0.12 0.00 -1.03 0.00 0.00 54.13 53.62 2zyz s LEU 68 Cb -0.15 -2.76 0.04 0.00 0.03 0.00 0.00 46.19 43.35 2zyz s LEU 68 CO 0.01 -0.17 0.26 0.00 0.23 0.00 0.00 176.35 176.68 2zyz s ALA 69 N 1.50 3.36 -0.13 4.21 0.00 -0.50 -1.31 121.76 128.88 2zyz s ALA 69 Ca 0.26 -1.84 -0.18 0.00 0.00 0.00 0.00 51.96 50.20 2zyz s ALA 69 Cb -0.16 -2.73 -0.04 0.00 0.00 0.00 0.00 23.12 20.20 2zyz s ALA 69 CO 0.10 -1.49 0.48 -0.51 0.00 0.00 0.00 175.76 174.35 2zyz s LEU 70 N 1.57 4.26 -0.12 0.00 1.43 0.52 -0.91 118.68 125.44 2zyz s LEU 70 Ca 0.03 0.81 0.02 0.00 -1.03 0.00 0.00 54.13 53.96 2zyz s LEU 70 Cb -0.20 -2.70 0.01 0.00 0.03 0.00 0.00 46.19 43.33 2zyz s LEU 70 CO 0.07 -0.02 -0.18 -0.69 0.23 0.00 0.00 176.35 175.76 2zyz s VAL 71 N 0.73 1.71 0.91 -1.59 1.01 -0.57 -1.47 120.40 121.13 2zyz s VAL 71 Ca 0.26 -0.77 -0.12 0.00 0.00 0.00 0.00 61.98 61.35 2zyz s VAL 71 Cb -0.15 -1.53 0.14 0.00 0.00 0.00 0.00 36.38 34.83 2zyz s VAL 71 CO 0.10 0.48 1.10 -0.94 0.00 0.00 0.00 175.10 175.85 2zyz s SER 72 N 0.88 3.39 0.24 3.32 1.04 -0.26 -0.95 113.70 121.36 2zyz s SER 72 Ca -0.08 1.27 0.19 0.00 0.48 0.00 0.00 55.95 57.81 2zyz s SER 72 Cb -0.15 -1.94 0.92 0.00 0.10 0.00 0.00 66.02 64.94 2zyz s SER 72 CO -0.01 -2.66 1.57 -0.46 0.98 0.00 0.00 173.24 172.66 2zyz n ASN 73 N -3.87 0.47 -1.36 7.02 0.23 -1.26 -1.90 115.26 114.60 2zyz n ASN 73 Ca 0.06 0.68 0.03 0.00 -0.53 0.00 0.00 54.58 54.82 2zyz n ASN 73 Cb 0.57 -0.76 0.08 0.00 -2.08 0.00 0.00 39.78 37.59 2zyz n ASN 73 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2zyz n ASP 74 N -2.09 1.45 0.00 0.53 5.68 -1.26 -5.02 116.55 115.84 2zyz n ASP 74 Ca 0.00 -2.68 0.00 0.00 -0.50 0.00 0.00 54.79 51.61 2zyz n ASP 74 Cb 0.09 -0.39 0.00 0.00 -1.14 0.00 0.00 41.12 39.68 2zyz n ASP 74 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2zyz n GLY 75 N -0.15 1.12 3.75 6.12 0.00 -0.80 -5.08 105.19 110.15 2zyz n GLY 75 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 2zyz n GLY 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2zyz s THR 76 N -2.00 4.66 -0.12 2.61 2.01 -1.26 -4.79 115.64 116.76 2zyz s THR 76 Ca 0.00 1.66 0.01 0.00 0.31 0.00 0.00 61.69 63.66 2zyz s THR 76 Cb 0.00 -4.13 -0.02 0.00 0.01 0.00 0.00 72.50 68.37 2zyz s THR 76 CO 0.00 0.39 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.49 2zyz s VAL 77 N -0.23 3.03 0.00 3.82 1.01 -1.26 -1.10 120.40 125.67 2zyz s VAL 77 Ca 0.38 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.71 2zyz s VAL 77 Cb -0.21 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 2zyz s VAL 77 CO 0.24 0.54 -0.09 -0.89 0.00 0.00 0.00 175.10 174.89 2zyz s THR 78 N 0.17 0.72 -0.09 3.92 2.01 -0.54 -4.97 115.64 116.86 2zyz s THR 78 Ca -0.08 -0.51 0.01 0.00 0.31 0.00 0.00 61.69 61.43 2zyz s THR 78 Cb -0.15 -0.63 -0.02 0.00 0.01 0.00 0.00 72.50 71.71 2zyz s THR 78 CO 0.05 0.12 -0.13 -0.31 -0.69 0.00 0.00 174.62 173.66 2zyz s TYR 79 N -0.39 2.79 -0.04 4.92 1.51 -1.26 -0.35 117.35 124.52 2zyz s TYR 79 Ca 0.02 -0.38 0.06 0.00 -1.01 0.00 0.00 57.07 55.76 2zyz s TYR 79 Cb -0.04 -1.75 -0.01 0.00 -0.11 0.00 0.00 41.96 40.04 2zyz s TYR 79 CO -0.00 0.00 -0.22 0.71 -1.11 0.00 0.00 175.55 174.93 2zyz s TYR 80 N -0.18 2.10 0.48 2.71 2.02 -0.43 -4.98 117.35 119.08 2zyz s TYR 80 Ca 0.00 -0.58 -0.22 0.00 -0.37 0.00 0.00 57.07 55.90 2zyz s TYR 80 Cb -0.13 -1.38 -0.07 0.00 -0.40 0.00 0.00 41.96 39.97 2zyz s TYR 80 CO 0.03 -0.17 1.17 0.71 -1.57 0.00 0.00 175.55 175.72 2zyz s TYR 81 N -0.16 2.79 0.01 2.71 1.51 -1.26 -0.74 117.35 122.21 2zyz s TYR 81 Ca -0.01 1.53 -0.00 0.00 -1.01 0.00 0.00 57.07 57.58 2zyz s TYR 81 Cb -0.12 -3.38 -0.01 0.00 -0.11 0.00 0.00 41.96 38.33 2zyz s TYR 81 CO 0.02 -1.60 -0.02 0.54 -1.11 0.00 0.00 175.55 173.38 2zyz s VAL 82 N -1.58 0.08 0.05 0.71 0.11 -1.01 -4.87 120.40 113.88 2zyz s VAL 82 Ca 0.66 -0.65 -0.15 0.00 -2.93 0.00 0.00 61.98 58.91 2zyz s VAL 82 Cb -0.28 -0.19 0.03 0.00 -1.53 0.00 0.00 36.38 34.40 2zyz s VAL 82 CO 0.34 -0.36 0.34 0.00 -3.33 0.00 0.00 175.10 172.09 2zyz s ARG 83 N -1.04 0.87 -0.24 1.54 1.70 -1.26 -4.26 118.95 116.25 2zyz s ARG 83 Ca -0.11 -0.50 -0.23 0.00 -0.47 0.00 0.00 55.73 54.42 2zyz s ARG 83 Cb -0.07 0.38 -0.01 0.00 -0.57 0.00 0.00 34.95 34.68 2zyz s ARG 83 CO -0.01 -0.29 0.76 0.21 -1.08 0.00 0.00 175.30 174.89 2zyz s LYS 84 N -2.70 4.17 0.26 3.89 2.20 -1.26 -5.02 119.74 121.28 2zyz s LYS 84 Ca -0.04 0.81 -0.30 0.00 -0.36 0.00 0.00 55.97 56.08 2zyz s LYS 84 Cb -0.00 -3.63 -0.09 0.00 -1.51 0.00 0.00 37.83 32.59 2zyz s LYS 84 CO -0.04 -0.45 1.11 0.42 -0.36 0.00 0.00 175.35 176.03 2zyz s ILE 85 N 2.61 3.53 -0.53 5.43 1.01 -1.26 -5.01 121.20 126.98 2zyz s ILE 85 Ca 0.32 1.49 0.00 0.00 0.00 0.00 0.00 60.65 62.46 2zyz s ILE 85 Cb -0.15 -3.95 0.14 0.00 0.01 0.00 0.00 42.46 38.50 2zyz s ILE 85 CO 0.08 0.33 0.30 -0.13 0.00 0.00 0.00 174.94 175.53 2zyz s ARG 86 N -1.20 2.17 -0.20 2.79 3.00 -1.26 -5.06 118.95 119.18 2zyz s ARG 86 Ca 0.46 -2.39 -0.29 0.00 0.00 0.00 0.00 55.73 53.51 2zyz s ARG 86 Cb -0.32 -3.52 -0.00 0.00 0.00 0.00 0.00 34.95 31.11 2zyz s ARG 86 CO 0.40 -1.11 1.18 -1.17 0.00 0.00 0.00 175.30 174.60 2zyz s LEU 87 N 0.14 4.13 0.68 2.53 2.96 -1.26 -4.98 118.68 122.88 2zyz s LEU 87 Ca 0.15 1.54 -0.11 0.00 -0.22 0.00 0.00 54.13 55.49 2zyz s LEU 87 Cb -0.22 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 42.93 2zyz s LEU 87 CO -0.03 -0.75 1.06 -2.16 -1.32 0.00 0.00 176.35 173.15 2zyz s PRO 88 N 3.43 3.08 0.37 0.98 0.04 -1.26 -5.00 135.00 136.64 2zyz s PRO 88 Ca 0.51 0.80 -0.26 0.00 0.04 0.00 0.00 61.00 62.08 2zyz s PRO 88 Cb -0.19 -2.02 -0.12 0.00 0.04 0.00 0.00 34.50 32.22 2zyz s PRO 88 CO 0.12 -0.96 1.08 -2.13 0.04 0.00 0.00 177.00 175.15 2zyz n ARG 89 N -3.01 1.55 -2.06 4.56 0.63 -1.26 -4.90 116.66 112.16 2zyz n ARG 89 Ca 0.07 0.55 -0.42 0.00 -0.92 0.00 0.00 57.85 57.13 2zyz n ARG 89 Cb 0.54 -2.07 -0.03 0.00 0.45 0.00 0.00 32.46 31.35 2zyz n ARG 89 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 2zyz s ASN 90 N -0.59 6.72 0.32 6.15 3.04 -1.26 -4.90 114.94 124.41 2zyz s ASN 90 Ca 0.60 2.43 0.05 0.00 0.04 0.00 0.00 52.86 55.97 2zyz s ASN 90 Cb -0.59 -2.58 0.53 0.00 -1.54 0.00 0.00 41.25 37.07 2zyz s ASN 90 CO 0.59 -0.75 1.79 -0.29 -3.04 0.00 0.00 177.10 175.40 2zyz h ILE 91 N 4.32 1.24 -0.56 -5.21 2.10 -2.05 -2.85 117.51 114.50 2zyz h ILE 91 Ca -0.42 -1.08 -0.16 0.00 1.08 0.00 0.00 64.86 64.29 2zyz h ILE 91 Cb 1.20 1.25 -0.09 0.00 -1.09 0.00 0.00 36.82 38.09 2zyz h ILE 91 CO 0.89 0.34 0.20 -1.22 -1.08 0.00 0.00 178.15 177.29 2zyz n TYR 92 N -4.18 1.86 0.12 2.19 4.02 -1.26 -5.33 117.16 114.57 2zyz n TYR 92 Ca -0.00 -0.93 0.01 0.00 -0.01 0.00 0.00 57.90 56.97 2zyz n TYR 92 Cb 0.34 -0.56 0.06 0.00 -0.02 0.00 0.00 39.34 39.17 2zyz n TYR 92 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85