#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zyz h ASP 2 N 0.00 -0.23 -0.53 7.83 5.19 -2.04 -3.36 116.42 123.27 2zyz h ASP 2 Ca 0.00 0.01 -0.09 0.00 -0.62 0.00 0.00 57.03 56.33 2zyz h ASP 2 Cb 0.00 0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.55 2zyz h ASP 2 CO 0.00 -0.07 0.00 1.62 -3.12 0.00 0.00 179.24 177.67 2zyz h VAL 3 N -0.47 1.26 -0.05 -1.35 3.04 -2.05 -0.12 116.25 116.50 2zyz h VAL 3 Ca -0.03 -1.11 -0.00 0.00 -1.01 0.00 0.00 66.70 64.55 2zyz h VAL 3 Cb 0.21 0.82 -0.00 0.00 -2.01 0.00 0.00 31.29 30.31 2zyz h VAL 3 CO 0.05 0.40 0.02 -0.07 -1.01 0.00 0.00 177.57 176.96 2zyz h LEU 4 N 0.90 0.07 -0.97 3.16 3.38 -1.98 -1.68 115.31 118.20 2zyz h LEU 4 Ca 0.16 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 58.02 2zyz h LEU 4 Cb 0.52 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.19 2zyz h LEU 4 CO 0.03 0.21 0.63 1.56 0.09 0.00 0.00 178.44 180.96 2zyz h GLN 5 N -0.07 1.17 -0.16 1.13 4.20 -1.62 -2.09 115.11 117.66 2zyz h GLN 5 Ca 0.02 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 2zyz h GLN 5 Cb 0.16 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 2zyz h GLN 5 CO -0.00 0.77 0.01 1.49 -0.67 0.00 0.00 178.83 180.43 2zyz h GLU 6 N 1.21 0.23 -0.37 1.46 4.57 -0.81 -1.84 114.58 119.02 2zyz h GLU 6 Ca 0.39 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.54 2zyz h GLU 6 Cb 0.03 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 2zyz h GLU 6 CO -0.13 0.24 0.23 1.96 -1.18 0.00 0.00 179.01 180.13 2zyz h GLN 7 N 0.23 0.50 -0.27 1.92 1.08 -0.58 -1.60 115.11 116.38 2zyz h GLN 7 Ca 0.06 -0.04 -0.11 0.00 -1.45 0.00 0.00 58.65 57.11 2zyz h GLN 7 Cb 0.14 -0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 27.46 2zyz h GLN 7 CO 0.00 0.35 -0.24 0.28 -0.95 0.00 0.00 178.83 178.26 2zyz h VAL 8 N 0.51 1.31 -0.39 -0.54 2.07 -1.33 -1.65 116.25 116.22 2zyz h VAL 8 Ca 0.14 -1.40 -0.02 0.00 0.82 0.00 0.00 66.70 66.24 2zyz h VAL 8 Cb -0.03 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 2zyz h VAL 8 CO -0.03 0.44 0.19 -0.26 0.02 0.00 0.00 177.57 177.93 2zyz h PHE 9 N 0.37 0.57 -0.67 1.57 0.04 -1.31 -1.15 116.94 116.36 2zyz h PHE 9 Ca 0.05 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 2zyz h PHE 9 Cb 0.80 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.74 2zyz h PHE 9 CO 0.07 0.48 0.42 0.87 -0.60 0.00 0.00 178.31 179.56 2zyz h LYS 10 N 0.50 0.90 -0.30 1.51 1.57 -1.30 -1.52 116.57 117.93 2zyz h LYS 10 Ca 0.14 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.81 2zyz h LYS 10 Cb 0.13 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2zyz h LYS 10 CO -0.02 0.63 0.05 0.22 -0.57 0.00 0.00 179.45 179.76 2zyz h ASP 11 N 0.92 0.48 -0.64 0.86 3.58 -0.95 -2.04 116.42 118.62 2zyz h ASP 11 Ca 0.24 -0.26 -0.05 0.00 0.42 0.00 0.00 57.03 57.38 2zyz h ASP 11 Cb -0.06 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 40.84 2zyz h ASP 11 CO -0.05 0.62 0.21 -0.07 -2.88 0.00 0.00 179.24 177.08 2zyz h LEU 12 N 0.32 0.92 -0.10 2.28 3.38 -1.04 -2.49 115.31 118.58 2zyz h LEU 12 Ca 0.09 -0.20 0.03 0.00 0.09 0.00 0.00 57.88 57.89 2zyz h LEU 12 Cb 0.35 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2zyz h LEU 12 CO 0.01 0.87 -0.06 0.11 0.09 0.00 0.00 178.44 179.46 2zyz h LYS 13 N 0.91 -0.05 -0.78 1.13 1.57 -1.23 -0.68 116.57 117.44 2zyz h LYS 13 Ca 0.21 0.00 0.23 0.00 -1.87 0.00 0.00 60.65 59.22 2zyz h LYS 13 Cb 0.27 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 2zyz h LYS 13 CO -0.01 -0.03 0.67 0.66 -0.57 0.00 0.00 179.45 180.17 2zyz h SER 14 N -0.05 0.00 -0.50 0.86 4.64 -1.16 -0.63 113.55 116.70 2zyz h SER 14 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2zyz h SER 14 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2zyz h SER 14 CO -0.14 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.36 2zyz n ARG 15 N -3.92 2.32 -1.34 4.77 1.74 -0.40 -4.91 116.66 114.92 2zyz n ARG 15 Ca 0.16 -2.03 -0.00 0.00 -0.77 0.00 0.00 57.85 55.21 2zyz n ARG 15 Cb 0.95 -1.46 -0.00 0.00 -1.02 0.00 0.00 32.46 30.93 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 1.41 0.39 3.84 -0.13 0.00 -0.24 -5.06 105.19 105.40 2zyz n GLY 16 Ca 0.19 -1.01 -0.33 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.02 3.35 -0.00 1.61 0.40 -0.41 -4.68 117.98 116.23 2zyz s PHE 17 Ca 0.00 1.38 0.04 0.00 -0.60 0.00 0.00 56.93 57.75 2zyz s PHE 17 Cb 0.00 -2.67 -0.03 0.00 0.51 0.00 0.00 43.02 40.82 2zyz s PHE 17 CO 0.00 -0.02 -0.10 0.21 0.70 0.00 0.00 175.22 176.01 2zyz s LYS 18 N -3.15 2.46 -0.05 0.44 2.36 -0.45 -4.31 119.74 117.04 2zyz s LYS 18 Ca 0.58 -0.76 -0.27 0.00 -2.55 0.00 0.00 55.97 52.97 2zyz s LYS 18 Cb -0.10 -2.42 -0.03 0.00 -1.05 0.00 0.00 37.83 34.23 2zyz s LYS 18 CO 0.17 0.60 0.85 0.42 1.55 0.00 0.00 175.35 178.94 2zyz s ILE 19 N -0.92 4.94 -0.26 5.43 -1.09 -1.26 -1.13 121.20 126.91 2zyz s ILE 19 Ca 0.15 1.76 -0.15 0.00 -2.23 0.00 0.00 60.65 60.18 2zyz s ILE 19 Cb -0.11 -4.18 -0.12 0.00 -1.58 0.00 0.00 42.46 36.47 2zyz s ILE 19 CO 0.05 0.17 -0.30 -0.38 -1.23 0.00 0.00 174.94 173.25 2zyz n ILE 20 N 3.98 1.53 -3.66 2.92 2.08 0.09 -4.98 119.36 121.32 2zyz n ILE 20 Ca 0.03 -0.28 -0.11 0.00 0.56 0.00 0.00 62.75 62.94 2zyz n ILE 20 Cb 0.51 -1.96 -0.08 0.00 -0.75 0.00 0.00 39.64 37.36 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 -2.54 0.70 -0.27 0.38 2.12 -1.13 -4.99 118.70 112.97 2zyz s GLU 21 Ca -0.36 0.98 -0.16 0.00 0.36 0.00 0.00 54.97 55.78 2zyz s GLU 21 Cb 0.13 0.26 -0.03 0.00 0.26 0.00 0.00 34.13 34.74 2zyz s GLU 21 CO 0.49 -0.11 0.43 -1.14 -0.54 0.00 0.00 175.26 174.38 2zyz s GLN 22 N 0.84 4.04 0.13 4.30 2.00 -1.26 -0.89 119.66 128.82 2zyz s GLN 22 Ca -0.04 0.15 0.22 0.00 -2.00 0.00 0.00 55.36 53.69 2zyz s GLN 22 Cb -0.05 -3.65 -0.11 0.00 0.80 0.00 0.00 33.01 30.00 2zyz s GLN 22 CO -0.07 -0.31 0.86 1.28 -0.50 0.00 0.00 175.29 176.56 2zyz n LEU 23 N 5.41 0.58 -3.63 3.68 4.77 -0.48 -4.99 117.00 122.35 2zyz n LEU 23 Ca -0.07 0.23 0.04 0.00 -0.03 0.00 0.00 56.01 56.18 2zyz n LEU 23 Cb 0.50 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2zyz n LEU 23 CO 0.38 -0.12 1.21 -0.62 -1.33 0.00 0.00 177.39 176.91 2zyz s ASP 24 N -5.11 -0.01 -0.32 -1.43 -1.08 -1.08 -4.97 116.67 102.69 2zyz s ASP 24 Ca -0.03 -0.02 -0.37 0.00 -0.52 0.00 0.00 52.55 51.61 2zyz s ASP 24 Cb 0.11 0.02 -0.13 0.00 -1.46 0.00 0.00 42.92 41.46 2zyz s ASP 24 CO 0.83 -0.04 2.02 -0.67 0.52 0.00 0.00 175.17 177.83 2zyz n ASP 25 N -0.57 2.23 0.00 -0.34 2.03 -1.26 -3.00 116.55 115.64 2zyz n ASP 25 Ca -0.08 0.69 0.00 0.00 0.52 0.00 0.00 54.79 55.92 2zyz n ASP 25 Cb 0.63 -1.21 0.00 0.00 -0.72 0.00 0.00 41.12 39.82 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 7.15 0.00 -4.96 -0.67 5.02 -1.26 -4.97 118.16 118.47 2zyz n LYS 26 Ca 0.36 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.33 2zyz n LYS 26 Cb 0.18 -2.17 -0.17 0.00 -0.02 0.00 0.00 35.03 32.86 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 -3.69 2.18 0.17 -0.18 1.01 -1.16 -1.17 121.20 118.35 2zyz s ILE 27 Ca 0.00 -0.96 -0.13 0.00 0.00 0.00 0.00 60.65 59.55 2zyz s ILE 27 Cb 0.00 -1.85 0.01 0.00 0.01 0.00 0.00 42.46 40.63 2zyz s ILE 27 CO 0.00 0.55 0.39 0.72 0.00 0.00 0.00 174.94 176.60 2zyz s PHE 28 N 0.53 0.10 -0.11 3.97 -0.12 -0.77 -1.38 117.98 120.19 2zyz s PHE 28 Ca -0.14 -0.45 -0.02 0.00 -0.05 0.00 0.00 56.93 56.28 2zyz s PHE 28 Cb -0.17 0.17 -0.03 0.00 -0.63 0.00 0.00 43.02 42.36 2zyz s PHE 28 CO 0.05 -0.79 -0.05 0.42 -0.05 0.00 0.00 175.22 174.80 2zyz s ILE 29 N -3.90 3.83 0.10 -4.49 1.01 -0.07 -0.76 121.20 116.92 2zyz s ILE 29 Ca 0.11 -0.41 -0.01 0.00 0.00 0.00 0.00 60.65 60.35 2zyz s ILE 29 Cb 0.01 -2.62 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 2zyz s ILE 29 CO -0.03 0.55 0.01 0.00 0.00 0.00 0.00 174.94 175.47 2zyz s ALA 30 N -0.22 0.75 -0.03 9.38 0.00 -1.01 -0.73 121.76 129.90 2zyz s ALA 30 Ca 0.04 -1.37 0.01 0.00 0.00 0.00 0.00 51.96 50.63 2zyz s ALA 30 Cb -0.13 0.57 0.02 0.00 0.00 0.00 0.00 23.12 23.59 2zyz s ALA 30 CO 0.02 -0.42 -0.01 -2.00 0.00 0.00 0.00 175.76 173.36 2zyz s GLU 31 N -3.98 0.34 0.00 0.00 2.12 -0.28 -1.38 118.70 115.52 2zyz s GLU 31 Ca 0.17 0.04 0.00 0.00 0.36 0.00 0.00 54.97 55.53 2zyz s GLU 31 Cb 0.08 -0.48 0.00 0.00 0.26 0.00 0.00 34.13 33.98 2zyz s GLU 31 CO -0.03 -0.11 0.00 1.17 -0.54 0.00 0.00 175.26 175.75 2zyz n LYS 32 N 3.99 0.00 -0.06 4.30 4.81 -1.26 -1.34 118.16 128.61 2zyz n LYS 32 Ca -0.25 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.03 2zyz n LYS 32 Cb 0.51 0.00 -0.13 0.00 0.02 0.00 0.00 35.03 35.43 2zyz n LYS 32 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 2zyz h LYS 33 N 0.00 0.04 -5.50 1.64 1.57 -1.96 -3.47 116.57 108.89 2zyz h LYS 33 Ca 0.00 -0.07 -0.64 0.00 -1.87 0.00 0.00 60.65 58.07 2zyz h LYS 33 Cb 0.00 0.03 -0.11 0.00 0.08 0.00 0.00 32.23 32.23 2zyz h LYS 33 CO 0.00 1.03 -0.49 -1.83 -0.57 0.00 0.00 179.45 177.60 2zyz s GLU 34 N -2.27 2.17 0.07 3.15 -1.05 -1.26 -5.12 118.70 114.39 2zyz s GLU 34 Ca -0.20 -2.21 -0.22 0.00 -0.15 0.00 0.00 54.97 52.19 2zyz s GLU 34 Cb -0.01 -1.71 -0.06 0.00 -0.44 0.00 0.00 34.13 31.90 2zyz s GLU 34 CO 0.69 -0.33 0.66 1.03 0.95 0.00 0.00 175.26 178.27 2zyz s ARG 35 N -3.93 4.37 0.16 -4.83 0.52 -1.26 -4.40 118.95 109.58 2zyz s ARG 35 Ca 0.20 0.90 0.10 0.00 -0.52 0.00 0.00 55.73 56.41 2zyz s ARG 35 Cb 0.02 -3.29 -0.04 0.00 0.52 0.00 0.00 34.95 32.16 2zyz s ARG 35 CO 0.11 0.49 -0.22 0.71 0.02 0.00 0.00 175.30 176.41 2zyz s TYR 36 N -0.70 2.07 -0.31 -0.53 1.51 -0.48 -4.28 117.35 114.62 2zyz s TYR 36 Ca 0.33 -0.41 -0.14 0.00 -1.01 0.00 0.00 57.07 55.85 2zyz s TYR 36 Cb -0.20 -1.05 -0.03 0.00 -0.11 0.00 0.00 41.96 40.57 2zyz s TYR 36 CO 0.21 0.39 0.30 -1.17 -1.11 0.00 0.00 175.55 174.16 2zyz s LEU 37 N -2.50 4.29 -0.07 -1.29 2.96 -0.35 -2.40 118.68 119.32 2zyz s LEU 37 Ca 0.16 -0.13 -0.09 0.00 -0.22 0.00 0.00 54.13 53.85 2zyz s LEU 37 Cb -0.08 -2.26 -0.05 0.00 0.50 0.00 0.00 46.19 44.31 2zyz s LEU 37 CO 0.08 -0.22 0.23 -0.36 -1.32 0.00 0.00 176.35 174.75 2zyz s PHE 38 N 1.90 3.63 -0.08 5.38 0.40 0.06 -1.15 117.98 128.12 2zyz s PHE 38 Ca 0.10 0.66 0.01 0.00 -0.60 0.00 0.00 56.93 57.10 2zyz s PHE 38 Cb -0.16 -2.04 0.02 0.00 0.51 0.00 0.00 43.02 41.35 2zyz s PHE 38 CO 0.11 0.70 -0.08 -0.47 0.70 0.00 0.00 175.22 176.18 2zyz s TYR 39 N -1.08 1.31 -0.14 0.36 5.04 -0.48 -1.84 117.35 120.52 2zyz s TYR 39 Ca 0.19 -0.56 -0.16 0.00 -2.44 0.00 0.00 57.07 54.10 2zyz s TYR 39 Cb -0.13 -1.07 -0.04 0.00 0.35 0.00 0.00 41.96 41.07 2zyz s TYR 39 CO 0.08 -0.38 0.40 0.08 -1.34 0.00 0.00 175.55 174.40 2zyz s VAL 40 N 1.26 5.23 -0.18 3.14 1.01 -0.31 -0.45 120.40 130.10 2zyz s VAL 40 Ca -0.04 0.79 0.01 0.00 0.00 0.00 0.00 61.98 62.74 2zyz s VAL 40 Cb -0.14 -3.74 0.03 0.00 0.00 0.00 0.00 36.38 32.53 2zyz s VAL 40 CO -0.03 0.34 -0.15 -0.04 0.00 0.00 0.00 175.10 175.22 2zyz s MET 41 N 0.66 2.42 -0.00 2.72 -1.94 -0.17 -4.91 119.30 118.07 2zyz s MET 41 Ca 0.22 -0.77 -0.21 0.00 -1.71 0.00 0.00 55.69 53.22 2zyz s MET 41 Cb -0.14 -2.38 -0.05 0.00 2.01 0.00 0.00 34.83 34.26 2zyz s MET 41 CO 0.08 -0.31 0.62 0.08 -0.01 0.00 0.00 175.02 175.48 2zyz s VAL 42 N 1.38 4.89 -0.12 -6.03 1.01 -1.26 -1.01 120.40 119.26 2zyz s VAL 42 Ca 0.02 1.29 -0.40 0.00 0.00 0.00 0.00 61.98 62.89 2zyz s VAL 42 Cb -0.14 -3.95 -0.18 0.00 0.00 0.00 0.00 36.38 32.10 2zyz s VAL 42 CO -0.10 0.41 1.38 1.21 0.00 0.00 0.00 175.10 178.00 2zyz n GLU 43 N 2.76 0.58 0.00 2.72 2.13 -0.05 -1.49 120.64 127.29 2zyz n GLU 43 Ca -0.06 0.21 0.00 0.00 0.66 0.00 0.00 57.16 57.97 2zyz n GLU 43 Cb 0.51 -1.79 0.00 0.00 0.27 0.00 0.00 31.44 30.43 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 2.79 1.46 3.31 8.31 0.00 -1.26 -4.82 105.19 114.98 2zyz n GLY 44 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.34 4.56 0.38 1.61 1.01 -0.56 -5.07 120.40 119.99 2zyz s VAL 45 Ca 0.00 -1.25 -0.24 0.00 0.00 0.00 0.00 61.98 60.50 2zyz s VAL 45 Cb 0.00 -3.74 -0.10 0.00 0.00 0.00 0.00 36.38 32.53 2zyz s VAL 45 CO 0.00 -0.50 0.95 -0.70 0.00 0.00 0.00 175.10 174.85 2zyz s GLU 46 N 1.50 4.41 -0.04 2.72 2.56 -1.26 -4.67 118.70 123.91 2zyz s GLU 46 Ca 0.03 1.23 0.02 0.00 0.00 0.00 0.00 54.97 56.25 2zyz s GLU 46 Cb -0.23 -2.49 0.01 0.00 2.00 0.00 0.00 34.13 33.42 2zyz s GLU 46 CO 0.04 0.12 -0.08 0.14 -0.56 0.00 0.00 175.26 174.92 2zyz s VAL 47 N -1.90 0.78 0.79 3.70 -7.23 -1.26 -5.13 120.40 110.15 2zyz s VAL 47 Ca 0.56 -0.30 -0.14 0.00 -1.81 0.00 0.00 61.98 60.29 2zyz s VAL 47 Cb -0.14 -0.73 0.03 0.00 0.56 0.00 0.00 36.38 36.09 2zyz s VAL 47 CO 0.18 0.27 0.82 0.35 -0.31 0.00 0.00 175.10 176.41 2zyz n THR 48 N 3.73 1.73 -0.05 5.32 -2.24 -1.26 -4.81 114.28 116.70 2zyz n THR 48 Ca -0.22 -0.29 0.02 0.00 -2.27 0.00 0.00 64.05 61.29 2zyz n THR 48 Cb 0.52 -0.94 0.35 0.00 -2.10 0.00 0.00 70.33 68.16 2zyz n THR 48 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2zyz h ILE 49 N -0.75 1.15 -0.86 2.28 6.09 -2.00 -2.02 117.51 121.40 2zyz h ILE 49 Ca -0.46 -0.39 0.00 0.00 -1.37 0.00 0.00 64.86 62.65 2zyz h ILE 49 Cb 1.32 0.53 -0.04 0.00 0.47 0.00 0.00 36.82 39.09 2zyz h ILE 49 CO 0.43 0.17 0.55 1.56 -3.07 0.00 0.00 178.15 177.78 2zyz h GLN 50 N 0.65 1.14 -0.25 2.19 7.50 -1.98 0.05 115.11 124.41 2zyz h GLN 50 Ca 0.17 -0.08 -0.01 0.00 0.50 0.00 0.00 58.65 59.23 2zyz h GLN 50 Cb 0.03 -0.25 -0.01 0.00 0.05 0.00 0.00 27.48 27.30 2zyz h GLN 50 CO -0.03 0.78 0.13 1.15 -1.50 0.00 0.00 178.83 179.36 2zyz h THR 51 N 1.17 1.13 -0.63 -0.54 2.02 -1.72 -0.31 112.91 114.04 2zyz h THR 51 Ca 0.31 -0.37 -0.03 0.00 0.77 0.00 0.00 66.41 67.09 2zyz h THR 51 Cb -0.10 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.21 2zyz h THR 51 CO -0.06 0.13 0.26 0.25 0.37 0.00 0.00 175.52 176.47 2zyz h LEU 52 N 0.28 0.85 -1.12 2.58 5.85 -1.15 -2.47 115.31 120.13 2zyz h LEU 52 Ca 0.09 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2zyz h LEU 52 Cb 0.09 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.87 2zyz h LEU 52 CO -0.01 0.78 0.43 -0.07 -0.34 0.00 0.00 178.44 179.23 2zyz h LEU 53 N 0.87 0.93 -0.67 2.25 3.38 -0.70 -1.76 115.31 119.61 2zyz h LEU 53 Ca 0.21 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2zyz h LEU 53 Cb 0.18 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2zyz h LEU 53 CO -0.02 0.73 0.43 -1.28 0.09 0.00 0.00 178.44 178.39 2zyz h SER 54 N 1.06 0.78 -0.40 -0.43 0.87 -0.64 -0.86 113.55 113.92 2zyz h SER 54 Ca 0.27 -0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.74 2zyz h SER 54 Cb -0.00 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.74 2zyz h SER 54 CO -0.05 0.58 0.03 0.58 -0.53 0.00 0.00 176.83 177.45 2zyz h VAL 55 N 0.91 1.25 -0.81 2.23 2.07 -0.98 -0.18 116.25 120.74 2zyz h VAL 55 Ca 0.24 -0.94 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 2zyz h VAL 55 Cb -0.08 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 2zyz h VAL 55 CO -0.05 0.32 0.50 0.40 0.02 0.00 0.00 177.57 178.76 2zyz h ILE 56 N 0.53 1.22 -0.59 4.57 2.04 -1.16 -1.85 117.51 122.26 2zyz h ILE 56 Ca 0.12 -0.46 -0.08 0.00 1.00 0.00 0.00 64.86 65.44 2zyz h ILE 56 Cb 0.42 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 2zyz h ILE 56 CO 0.01 0.23 0.06 -1.13 0.00 0.00 0.00 178.15 177.32 2zyz h ASN 57 N 1.10 0.97 -0.96 1.72 -0.00 -0.83 -1.95 115.58 115.63 2zyz h ASN 57 Ca 0.29 -0.28 0.13 0.00 -0.00 0.00 0.00 56.30 56.44 2zyz h ASN 57 Cb -0.07 -0.26 -0.09 0.00 -0.00 0.00 0.00 38.32 37.91 2zyz h ASN 57 CO -0.06 1.01 0.58 -0.03 -0.00 0.00 0.00 177.43 178.93 2zyz h MET 58 N 0.90 0.86 -0.60 6.67 4.05 -0.41 -0.52 114.93 125.88 2zyz h MET 58 Ca 0.17 -0.05 -0.06 0.00 -0.28 0.00 0.00 59.70 59.48 2zyz h MET 58 Cb 0.47 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 31.05 2zyz h MET 58 CO 0.02 0.57 0.13 0.78 0.23 0.00 0.00 176.91 178.64 2zyz h GLY 59 N 0.88 1.02 0.91 1.39 0.00 -0.60 0.88 103.07 107.56 2zyz h GLY 59 Ca 0.49 -0.62 -0.02 0.00 0.00 0.00 0.00 47.33 47.18 2zyz h GLY 59 CO -0.29 0.58 0.11 0.83 0.00 0.00 0.00 176.54 177.76 2zyz h GLU 60 N 0.91 0.43 -0.57 4.80 5.08 -0.97 0.15 114.58 124.41 2zyz h GLU 60 Ca 0.19 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 2zyz h GLU 60 Cb 0.35 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 2zyz h GLU 60 CO 0.00 0.46 0.19 1.15 -1.00 0.00 0.00 179.01 179.82 2zyz h THR 61 N 0.31 1.22 -0.05 1.13 2.02 -0.51 -1.97 112.91 115.06 2zyz h THR 61 Ca 0.09 -0.73 0.00 0.00 0.77 0.00 0.00 66.41 66.54 2zyz h THR 61 Cb 0.20 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 2zyz h THR 61 CO -0.01 0.28 0.00 0.18 0.37 0.00 0.00 175.52 176.35 2zyz n LEU 62 N -4.30 1.44 -3.89 2.58 4.32 0.25 -4.96 117.00 112.43 2zyz n LEU 62 Ca 0.05 -0.51 -0.27 0.00 -0.02 0.00 0.00 56.01 55.25 2zyz n LEU 62 Cb 0.19 -0.02 0.01 0.00 -1.62 0.00 0.00 43.42 41.98 2zyz n LEU 62 CO 0.39 0.25 -0.02 -1.20 -1.22 0.00 0.00 177.39 175.60 2zyz n SER 63 N 0.13 -2.82 -4.02 -1.43 7.64 -0.49 -5.02 113.62 107.61 2zyz n SER 63 Ca 0.19 -0.86 -0.17 0.00 1.01 0.00 0.00 58.87 59.04 2zyz n SER 63 Cb 0.33 -3.67 -0.14 0.00 -1.01 0.00 0.00 64.21 59.72 2zyz n SER 63 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2zyz s MET 64 N -6.46 0.60 0.63 1.43 -1.94 0.41 -5.01 119.30 108.98 2zyz s MET 64 Ca 0.37 -0.38 -0.17 0.00 -1.71 0.00 0.00 55.69 53.79 2zyz s MET 64 Cb -0.19 -0.56 -0.01 0.00 2.01 0.00 0.00 34.83 36.08 2zyz s MET 64 CO 0.85 0.14 1.18 -1.25 -0.01 0.00 0.00 175.02 175.93 2zyz s PRO 65 N -0.49 2.78 -0.14 2.03 0.04 -1.26 -4.38 135.00 133.58 2zyz s PRO 65 Ca 0.01 1.70 -0.05 0.00 0.04 0.00 0.00 61.00 62.70 2zyz s PRO 65 Cb -0.04 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 2zyz s PRO 65 CO -0.00 -1.33 0.05 0.08 0.04 0.00 0.00 177.00 175.84 2zyz s VAL 66 N -1.85 4.67 -0.09 -0.36 1.01 -1.26 -1.21 120.40 121.31 2zyz s VAL 66 Ca 0.74 -0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.66 2zyz s VAL 66 Cb -0.27 -3.05 0.01 0.00 0.00 0.00 0.00 36.38 33.07 2zyz s VAL 66 CO 0.37 0.53 -0.16 -0.69 0.00 0.00 0.00 175.10 175.15 2zyz s VAL 67 N -0.21 1.52 -0.21 2.92 1.01 -0.30 -2.56 120.40 122.57 2zyz s VAL 67 Ca 0.07 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.18 2zyz s VAL 67 Cb -0.12 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 2zyz s VAL 67 CO 0.02 0.44 0.57 -0.76 0.00 0.00 0.00 175.10 175.37 2zyz s LEU 68 N 0.75 4.13 -0.42 3.92 1.43 0.07 -1.38 118.68 127.18 2zyz s LEU 68 Ca -0.12 0.73 -0.15 0.00 -1.03 0.00 0.00 54.13 53.56 2zyz s LEU 68 Cb -0.16 -2.79 0.03 0.00 0.03 0.00 0.00 46.19 43.30 2zyz s LEU 68 CO 0.02 -0.24 0.32 0.00 0.23 0.00 0.00 176.35 176.69 2zyz s ALA 69 N 1.87 3.48 -0.21 4.21 0.00 0.41 -1.95 121.76 129.56 2zyz s ALA 69 Ca 0.26 -1.74 -0.15 0.00 0.00 0.00 0.00 51.96 50.33 2zyz s ALA 69 Cb -0.16 -2.92 -0.04 0.00 0.00 0.00 0.00 23.12 20.00 2zyz s ALA 69 CO 0.10 -1.50 0.37 -0.51 0.00 0.00 0.00 175.76 174.22 2zyz s LEU 70 N 1.72 4.15 -0.13 0.00 1.43 0.33 -1.00 118.68 125.18 2zyz s LEU 70 Ca 0.06 0.47 0.02 0.00 -1.03 0.00 0.00 54.13 53.65 2zyz s LEU 70 Cb -0.19 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.56 2zyz s LEU 70 CO 0.10 -0.06 -0.21 -0.69 0.23 0.00 0.00 176.35 175.72 2zyz s VAL 71 N 1.29 2.22 0.99 -1.59 1.01 -0.18 -1.35 120.40 122.79 2zyz s VAL 71 Ca 0.18 -0.94 -0.13 0.00 0.00 0.00 0.00 61.98 61.08 2zyz s VAL 71 Cb -0.15 -1.88 0.18 0.00 0.00 0.00 0.00 36.38 34.53 2zyz s VAL 71 CO 0.08 0.55 1.12 -0.94 0.00 0.00 0.00 175.10 175.91 2zyz s SER 72 N 0.64 2.74 0.46 3.32 1.04 -0.24 -0.87 113.70 120.78 2zyz s SER 72 Ca -0.11 0.96 0.31 0.00 0.48 0.00 0.00 55.95 57.60 2zyz s SER 72 Cb -0.16 -1.51 1.36 0.00 0.10 0.00 0.00 66.02 65.81 2zyz s SER 72 CO 0.02 -3.03 1.92 -0.55 0.98 0.00 0.00 173.24 172.58 2zyz h ASN 73 N -1.83 0.00 -0.01 7.02 7.08 -1.91 -2.06 115.58 123.88 2zyz h ASN 73 Ca -0.51 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.71 2zyz h ASN 73 Cb 1.32 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.56 2zyz h ASN 73 CO 0.56 0.00 0.00 -0.90 -2.08 0.00 0.00 177.43 175.01 2zyz n ASP 74 N -2.77 2.29 0.00 6.14 5.68 -1.26 -5.03 116.55 121.59 2zyz n ASP 74 Ca 0.01 -2.81 0.00 0.00 -0.50 0.00 0.00 54.79 51.49 2zyz n ASP 74 Cb 0.24 -0.32 0.00 0.00 -1.14 0.00 0.00 41.12 39.90 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 -1.18 1.21 3.76 6.12 0.00 -0.77 -5.09 105.19 109.23 2zyz n GLY 75 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 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 4.84 -0.12 2.61 2.01 -1.26 -4.82 115.64 116.90 2zyz s THR 76 Ca 0.00 1.39 0.01 0.00 0.31 0.00 0.00 61.69 63.40 2zyz s THR 76 Cb 0.00 -4.00 -0.01 0.00 0.01 0.00 0.00 72.50 68.49 2zyz s THR 76 CO 0.00 0.40 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.49 2zyz s VAL 77 N -0.12 2.97 -0.02 3.82 1.01 -1.26 -1.08 120.40 125.72 2zyz s VAL 77 Ca 0.34 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.66 2zyz s VAL 77 Cb -0.19 -2.23 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 2zyz s VAL 77 CO 0.19 0.53 -0.12 -0.89 0.00 0.00 0.00 175.10 174.82 2zyz s THR 78 N 0.26 0.95 -0.07 3.92 2.01 -0.46 -4.96 115.64 117.29 2zyz s THR 78 Ca -0.10 -0.50 0.03 0.00 0.31 0.00 0.00 61.69 61.43 2zyz s THR 78 Cb -0.16 -0.81 -0.02 0.00 0.01 0.00 0.00 72.50 71.52 2zyz s THR 78 CO 0.06 0.28 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.81 2zyz s TYR 79 N -0.15 2.74 -0.05 4.92 1.51 -1.26 -0.51 117.35 124.54 2zyz s TYR 79 Ca 0.02 -0.27 0.05 0.00 -1.01 0.00 0.00 57.07 55.86 2zyz s TYR 79 Cb -0.06 -1.69 -0.01 0.00 -0.11 0.00 0.00 41.96 40.10 2zyz s TYR 79 CO -0.00 0.09 -0.20 0.71 -1.11 0.00 0.00 175.55 175.04 2zyz s TYR 80 N -0.46 1.97 0.51 2.71 1.51 -0.82 -4.98 117.35 117.79 2zyz s TYR 80 Ca 0.06 -0.58 -0.22 0.00 -1.01 0.00 0.00 57.07 55.32 2zyz s TYR 80 Cb -0.12 -1.31 -0.06 0.00 -0.11 0.00 0.00 41.96 40.36 2zyz s TYR 80 CO 0.02 -0.19 1.24 0.71 -1.11 0.00 0.00 175.55 176.22 2zyz s TYR 81 N -0.02 2.61 0.02 2.71 1.51 -1.26 -0.75 117.35 122.17 2zyz s TYR 81 Ca -0.04 1.48 0.01 0.00 -1.01 0.00 0.00 57.07 57.50 2zyz s TYR 81 Cb -0.12 -3.54 -0.01 0.00 -0.11 0.00 0.00 41.96 38.18 2zyz s TYR 81 CO 0.03 -2.08 -0.04 0.54 -1.11 0.00 0.00 175.55 172.89 2zyz s VAL 82 N -1.47 0.24 0.09 0.71 0.11 -1.06 -4.88 120.40 114.14 2zyz s VAL 82 Ca 0.68 -0.65 -0.11 0.00 -2.93 0.00 0.00 61.98 58.97 2zyz s VAL 82 Cb -0.33 -0.31 0.01 0.00 -1.53 0.00 0.00 36.38 34.22 2zyz s VAL 82 CO 0.39 -0.27 0.25 0.00 -3.33 0.00 0.00 175.10 172.14 2zyz s ARG 83 N -0.98 0.87 -0.14 1.54 1.70 -1.26 -4.27 118.95 116.41 2zyz s ARG 83 Ca -0.08 -0.81 -0.26 0.00 -0.47 0.00 0.00 55.73 54.11 2zyz s ARG 83 Cb -0.07 0.37 -0.02 0.00 -0.57 0.00 0.00 34.95 34.66 2zyz s ARG 83 CO -0.00 -0.29 0.84 0.21 -1.08 0.00 0.00 175.30 174.97 2zyz s LYS 84 N -3.55 4.34 0.23 3.89 2.20 -1.26 -5.04 119.74 120.54 2zyz s LYS 84 Ca 0.02 1.05 -0.28 0.00 -0.36 0.00 0.00 55.97 56.41 2zyz s LYS 84 Cb 0.03 -3.55 -0.09 0.00 -1.51 0.00 0.00 37.83 32.71 2zyz s LYS 84 CO -0.10 -0.26 0.89 0.42 -0.36 0.00 0.00 175.35 175.94 2zyz s ILE 85 N 1.91 4.19 -0.46 5.43 1.01 -1.26 -5.02 121.20 127.00 2zyz s ILE 85 Ca 0.40 1.92 0.01 0.00 0.00 0.00 0.00 60.65 62.97 2zyz s ILE 85 Cb -0.17 -4.22 0.12 0.00 0.01 0.00 0.00 42.46 38.20 2zyz s ILE 85 CO 0.14 0.45 0.22 -0.13 0.00 0.00 0.00 174.94 175.62 2zyz s ARG 86 N -1.31 1.95 -0.26 2.79 0.52 -1.26 -5.07 118.95 116.32 2zyz s ARG 86 Ca 0.41 -2.15 -0.29 0.00 -0.52 0.00 0.00 55.73 53.17 2zyz s ARG 86 Cb -0.24 -3.45 0.01 0.00 0.52 0.00 0.00 34.95 31.79 2zyz s ARG 86 CO 0.29 -1.06 1.08 -1.17 0.02 0.00 0.00 175.30 174.45 2zyz s LEU 87 N 0.52 4.05 0.59 2.53 2.96 -1.26 -5.00 118.68 123.07 2zyz s LEU 87 Ca 0.13 1.29 -0.17 0.00 -0.22 0.00 0.00 54.13 55.16 2zyz s LEU 87 Cb -0.22 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.90 2zyz s LEU 87 CO -0.04 -0.76 1.11 -2.16 -1.32 0.00 0.00 176.35 173.19 2zyz s PRO 88 N 3.39 3.15 0.57 0.98 0.04 -1.26 -5.01 135.00 136.87 2zyz s PRO 88 Ca 0.46 1.49 -0.20 0.00 0.04 0.00 0.00 61.00 62.79 2zyz s PRO 88 Cb -0.15 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 2zyz s PRO 88 CO 0.10 -0.99 1.09 -2.13 0.04 0.00 0.00 177.00 175.11 2zyz n ARG 89 N -1.77 1.14 -2.88 4.56 0.63 -1.26 -4.91 116.66 112.18 2zyz n ARG 89 Ca 0.11 0.43 -0.43 0.00 -0.92 0.00 0.00 57.85 57.04 2zyz n ARG 89 Cb 0.52 -2.28 -0.04 0.00 0.45 0.00 0.00 32.46 31.10 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 -1.13 6.54 0.58 6.15 2.47 -1.26 -4.91 114.94 123.37 2zyz s ASN 90 Ca 0.74 0.25 0.29 0.00 0.42 0.00 0.00 52.86 54.56 2zyz s ASN 90 Cb -0.43 -2.43 1.74 0.00 -1.45 0.00 0.00 41.25 38.68 2zyz s ASN 90 CO 0.48 -0.90 2.22 -0.29 -3.72 0.00 0.00 177.10 174.89 2zyz h ILE 91 N 5.92 0.56 -0.07 -5.21 6.09 -2.06 -2.60 117.51 120.14 2zyz h ILE 91 Ca -0.24 -0.10 0.00 0.00 -1.37 0.00 0.00 64.86 63.15 2zyz h ILE 91 Cb 1.08 1.06 0.00 0.00 0.47 0.00 0.00 36.82 39.43 2zyz h ILE 91 CO 0.98 0.02 0.00 -1.22 -3.07 0.00 0.00 178.15 174.86 2zyz n TYR 92 N -3.85 0.08 -1.64 2.19 4.02 -1.26 -4.92 117.16 111.79 2zyz n TYR 92 Ca -0.03 -0.04 -0.48 0.00 -0.01 0.00 0.00 57.90 57.34 2zyz n TYR 92 Cb 0.11 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.38 2zyz n TYR 92 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2zyz n ALA 93 N 0.22 0.47 -1.77 -0.72 0.00 -0.98 -4.92 120.51 112.81 2zyz n ALA 93 Ca 0.18 0.47 -0.40 0.00 0.00 0.00 0.00 53.44 53.68 2zyz n ALA 93 Cb 0.34 -2.24 -0.02 0.00 0.00 0.00 0.00 19.45 17.53 2zyz n ALA 93 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2zyz s GLU 94 N 0.58 4.37 0.31 0.00 0.41 -1.26 -5.00 118.70 118.11 2zyz s GLU 94 Ca 0.79 2.15 -0.28 0.00 -0.41 0.00 0.00 54.97 57.23 2zyz s GLU 94 Cb -0.77 -3.06 -0.13 0.00 -1.78 0.00 0.00 34.13 28.38 2zyz s GLU 94 CO 0.43 -0.15 1.05 0.00 -0.49 0.00 0.00 175.26 176.09 2zyz n ALA 95 N 0.80 0.05 0.12 5.21 0.00 -1.26 -5.25 120.51 120.18 2zyz n ALA 95 Ca 0.00 0.37 0.01 0.00 0.00 0.00 0.00 53.44 53.82 2zyz n ALA 95 Cb 0.42 -2.06 0.01 0.00 0.00 0.00 0.00 19.45 17.82 2zyz n ALA 95 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78