#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zky n THR 2 N 0.00 0.03 -4.08 0.00 5.66 -1.26 -4.67 114.28 109.96 2zky n THR 2 Ca 0.00 -0.15 -0.14 0.00 -3.05 0.00 0.00 64.05 60.71 2zky n THR 2 Cb 0.00 0.26 -0.13 0.00 -1.55 0.00 0.00 70.33 68.91 2zky n THR 2 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2zky s LYS 3 N -2.41 0.41 0.09 1.09 1.02 -1.26 -0.16 119.74 118.52 2zky s LYS 3 Ca -0.02 -0.41 -0.06 0.00 0.02 0.00 0.00 55.97 55.50 2zky s LYS 3 Cb 0.04 -0.29 -0.02 0.00 -0.52 0.00 0.00 37.83 37.04 2zky s LYS 3 CO 0.26 0.07 0.12 0.00 -0.92 0.00 0.00 175.35 174.88 2zky s ALA 4 N -0.67 0.16 0.06 5.17 0.00 -0.65 -1.25 121.76 124.58 2zky s ALA 4 Ca -0.04 -0.94 -0.10 0.00 0.00 0.00 0.00 51.96 50.88 2zky s ALA 4 Cb -0.05 0.53 0.00 0.00 0.00 0.00 0.00 23.12 23.60 2zky s ALA 4 CO -0.00 -0.49 0.21 0.54 0.00 0.00 0.00 175.76 176.02 2zky s VAL 5 N -3.92 0.11 -0.08 0.00 0.11 0.38 -0.70 120.40 116.30 2zky s VAL 5 Ca 0.10 -0.95 -0.05 0.00 -2.93 0.00 0.00 61.98 58.16 2zky s VAL 5 Cb 0.06 -1.04 0.04 0.00 -1.53 0.00 0.00 36.38 33.90 2zky s VAL 5 CO -0.07 -0.52 0.20 0.00 -3.33 0.00 0.00 175.10 171.37 2zky s VAL 7 N 0.90 4.25 -0.10 0.00 1.01 -1.26 -0.41 120.40 124.80 2zky s VAL 7 Ca -0.07 -0.69 -0.22 0.00 0.00 0.00 0.00 61.98 61.01 2zky s VAL 7 Cb -0.08 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 2zky s VAL 7 CO -0.05 -0.01 0.64 -0.76 0.00 0.00 0.00 175.10 174.92 2zky s LEU 8 N 1.53 4.28 0.05 3.92 1.43 0.18 -3.92 118.68 126.16 2zky s LEU 8 Ca 0.03 1.05 -0.09 0.00 -1.03 0.00 0.00 54.13 54.09 2zky s LEU 8 Cb -0.18 -2.96 0.00 0.00 0.03 0.00 0.00 46.19 43.08 2zky s LEU 8 CO 0.04 -0.11 0.18 -0.54 0.23 0.00 0.00 176.35 176.15 2zky s LYS 9 N 0.92 0.73 0.00 1.70 1.02 -0.14 -1.75 119.74 122.21 2zky s LYS 9 Ca 0.34 -0.75 0.00 0.00 0.02 0.00 0.00 55.97 55.58 2zky s LYS 9 Cb -0.17 0.30 0.00 0.00 -0.52 0.00 0.00 37.83 37.44 2zky s LYS 9 CO 0.15 -0.21 0.00 0.41 -0.92 0.00 0.00 175.35 174.78 2zky n GLY 10 N 0.46 2.42 0.11 -3.33 0.00 -1.23 -1.73 105.19 101.90 2zky n GLY 10 Ca -0.18 -1.12 0.13 0.00 0.00 0.00 0.00 46.02 44.85 2zky n GLY 10 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2zky n ASP 11 N -1.33 0.75 0.00 1.61 10.43 -1.26 -4.81 116.55 121.93 2zky n ASP 11 Ca 0.00 0.61 0.00 0.00 2.57 0.00 0.00 54.79 57.97 2zky n ASP 11 Cb 0.00 -0.79 0.00 0.00 1.84 0.00 0.00 41.12 42.17 2zky n ASP 11 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2zky n GLY 12 N 0.82 2.73 0.11 0.44 0.00 -1.26 -5.01 105.19 103.02 2zky n GLY 12 Ca 0.04 -2.00 0.14 0.00 0.00 0.00 0.00 46.02 44.21 2zky n GLY 12 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2zky n PRO 13 N 0.00 0.69 -2.00 1.61 -0.04 -1.26 -4.89 135.00 129.10 2zky n PRO 13 Ca 0.00 -0.22 -0.42 0.00 -0.04 0.00 0.00 63.50 62.82 2zky n PRO 13 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.94 2zky n PRO 13 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2zky s VAL 14 N -2.47 3.47 -0.04 0.52 1.01 -1.26 -4.50 120.40 117.13 2zky s VAL 14 Ca 0.29 0.68 -0.20 0.00 0.00 0.00 0.00 61.98 62.76 2zky s VAL 14 Cb 0.20 -3.44 0.04 0.00 0.00 0.00 0.00 36.38 33.18 2zky s VAL 14 CO 0.47 -0.04 0.43 0.00 0.00 0.00 0.00 175.10 175.96 2zky s GLN 15 N 3.59 0.77 -0.07 2.72 -2.07 -1.04 -3.53 119.66 120.04 2zky s GLN 15 Ca 0.73 0.03 -0.32 0.00 -1.82 0.00 0.00 55.36 53.98 2zky s GLN 15 Cb -0.35 0.35 0.14 0.00 -1.09 0.00 0.00 33.01 32.06 2zky s GLN 15 CO 0.30 -0.21 1.37 0.20 -1.32 0.00 0.00 175.29 175.63 2zky s GLY 16 N -1.12 -0.45 -0.11 2.60 0.00 -0.72 -1.23 107.32 106.29 2zky s GLY 16 Ca -0.11 0.90 0.02 0.00 0.00 0.00 0.00 44.72 45.52 2zky s GLY 16 CO 0.06 0.18 -0.17 -0.42 0.00 0.00 0.00 173.10 172.74 2zky s ILE 17 N -2.20 1.61 -0.13 0.90 1.01 -1.14 0.48 121.20 121.73 2zky s ILE 17 Ca 0.14 -0.72 0.02 0.00 0.00 0.00 0.00 60.65 60.10 2zky s ILE 17 Cb 0.06 -1.45 0.00 0.00 0.01 0.00 0.00 42.46 41.08 2zky s ILE 17 CO -0.05 0.46 -0.20 -0.63 0.00 0.00 0.00 174.94 174.52 2zky s ILE 18 N 0.86 2.30 0.12 2.92 -1.09 0.45 -3.03 121.20 123.73 2zky s ILE 18 Ca -0.09 -0.91 -0.02 0.00 -2.23 0.00 0.00 60.65 57.41 2zky s ILE 18 Cb -0.15 -1.93 -0.05 0.00 -1.58 0.00 0.00 42.46 38.75 2zky s ILE 18 CO 0.00 0.54 0.30 0.20 -1.23 0.00 0.00 174.94 174.75 2zky s ASN 19 N 0.65 6.41 -0.02 3.58 0.01 0.95 -0.60 114.94 125.92 2zky s ASN 19 Ca -0.10 0.40 0.03 0.00 -0.71 0.00 0.00 52.86 52.48 2zky s ASN 19 Cb -0.16 -2.01 -0.00 0.00 0.41 0.00 0.00 41.25 39.48 2zky s ASN 19 CO 0.02 0.09 -0.11 -0.36 -1.51 0.00 0.00 177.10 175.23 2zky s PHE 20 N -1.63 1.06 -0.10 2.20 0.08 0.12 -1.61 117.98 118.11 2zky s PHE 20 Ca 0.38 -0.23 -0.06 0.00 0.12 0.00 0.00 56.93 57.14 2zky s PHE 20 Cb -0.12 -0.70 0.04 0.00 -0.57 0.00 0.00 43.02 41.66 2zky s PHE 20 CO 0.27 -0.05 0.24 -2.00 -0.10 0.00 0.00 175.22 173.58 2zky s GLU 21 N -0.11 0.21 -0.31 0.44 2.12 -0.64 -1.64 118.70 118.76 2zky s GLU 21 Ca 0.02 0.49 -0.02 0.00 0.36 0.00 0.00 54.97 55.82 2zky s GLU 21 Cb -0.06 -0.08 0.11 0.00 0.26 0.00 0.00 34.13 34.36 2zky s GLU 21 CO -0.00 -0.14 0.15 -1.14 -0.54 0.00 0.00 175.26 173.58 2zky s GLN 22 N 1.08 0.41 0.49 4.30 0.74 0.77 -1.14 119.66 126.31 2zky s GLN 22 Ca -0.08 -0.87 0.15 0.00 0.05 0.00 0.00 55.36 54.61 2zky s GLN 22 Cb -0.09 -1.40 1.17 0.00 1.10 0.00 0.00 33.01 33.80 2zky s GLN 22 CO -0.07 -1.06 2.09 0.87 -0.55 0.00 0.00 175.29 176.57 2zky h LYS 23 N 7.97 0.16 -4.72 1.67 6.56 -1.81 -3.41 116.57 122.99 2zky h LYS 23 Ca -0.12 -0.01 -0.36 0.00 -1.06 0.00 0.00 60.65 59.09 2zky h LYS 23 Cb 1.00 -0.04 -0.26 0.00 -0.57 0.00 0.00 32.23 32.36 2zky h LYS 23 CO 0.41 0.10 -0.77 -1.21 -2.06 0.00 0.00 179.45 175.93 2zky s GLU 24 N -5.19 0.66 0.60 3.15 0.41 -1.26 -5.03 118.70 112.04 2zky s GLU 24 Ca -0.06 -0.47 0.38 0.00 -0.41 0.00 0.00 54.97 54.42 2zky s GLU 24 Cb 0.18 -0.60 1.85 0.00 -1.78 0.00 0.00 34.13 33.77 2zky s GLU 24 CO 0.70 0.15 2.16 0.66 -0.49 0.00 0.00 175.26 178.45 2zky h SER 25 N 5.45 0.00 -0.24 -0.19 4.64 -1.92 -1.09 113.55 120.20 2zky h SER 25 Ca -0.33 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.98 2zky h SER 25 Cb 1.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 2zky h SER 25 CO 0.47 0.01 -0.00 -0.46 -0.87 0.00 0.00 176.83 175.97 2zky n ASN 26 N -3.11 3.57 -4.82 4.97 6.94 -1.26 -4.94 115.26 116.60 2zky n ASN 26 Ca -0.01 -3.10 -0.25 0.00 -0.02 0.00 0.00 54.58 51.20 2zky n ASN 26 Cb 0.20 -0.54 0.01 0.00 -2.36 0.00 0.00 39.78 37.09 2zky n ASN 26 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2zky n GLY 27 N -0.69 2.69 3.75 4.83 0.00 -0.41 -5.13 105.19 110.22 2zky n GLY 27 Ca 0.22 -2.29 -0.29 0.00 0.00 0.00 0.00 46.02 43.65 2zky n GLY 27 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2zky s PRO 28 N -4.26 1.06 -0.13 1.61 0.02 -1.26 -4.88 135.00 127.16 2zky s PRO 28 Ca 0.33 0.46 0.03 0.00 0.02 0.00 0.00 61.00 61.84 2zky s PRO 28 Cb -0.03 -1.81 0.01 0.00 0.02 0.00 0.00 34.50 32.69 2zky s PRO 28 CO 0.21 -2.29 -0.22 0.08 -0.33 0.00 0.00 177.00 174.45 2zky s VAL 29 N -3.13 2.02 -0.09 3.83 1.01 0.15 -4.45 120.40 119.76 2zky s VAL 29 Ca 0.64 -0.96 -0.18 0.00 0.00 0.00 0.00 61.98 61.47 2zky s VAL 29 Cb -0.16 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.39 2zky s VAL 29 CO 0.55 0.54 0.50 -0.54 0.00 0.00 0.00 175.10 176.15 2zky s LYS 30 N 0.77 4.30 -0.19 2.72 1.02 -0.29 -1.17 119.74 126.89 2zky s LYS 30 Ca -0.08 0.50 0.01 0.00 0.02 0.00 0.00 55.97 56.42 2zky s LYS 30 Cb -0.16 -3.40 0.03 0.00 -0.52 0.00 0.00 37.83 33.78 2zky s LYS 30 CO -0.01 0.24 -0.16 0.08 -0.92 0.00 0.00 175.35 174.59 2zky s VAL 31 N 0.32 1.87 0.11 3.17 1.01 0.16 -1.62 120.40 125.42 2zky s VAL 31 Ca 0.27 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 61.18 2zky s VAL 31 Cb -0.16 -1.79 0.01 0.00 0.00 0.00 0.00 36.38 34.44 2zky s VAL 31 CO 0.12 0.38 0.26 -1.66 0.00 0.00 0.00 175.10 174.20 2zky s TRP 32 N 1.34 0.10 -5.00 5.22 -2.14 -0.63 -0.12 118.94 117.70 2zky s TRP 32 Ca 0.02 -0.50 0.00 0.00 2.66 0.00 0.00 56.10 58.29 2zky s TRP 32 Cb -0.14 0.02 0.00 0.00 -3.10 0.00 0.00 33.47 30.25 2zky s TRP 32 CO -0.11 -0.61 0.00 0.41 -2.66 0.00 0.00 176.95 173.98 2zky n GLY 33 N -0.12 0.23 3.21 3.67 0.00 -0.67 -0.03 105.19 111.47 2zky n GLY 33 Ca -0.14 -1.37 -0.12 0.00 0.00 0.00 0.00 46.02 44.38 2zky n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2zky s SER 34 N -4.00 -0.12 -0.11 1.61 1.04 -1.17 0.24 113.70 111.19 2zky s SER 34 Ca 0.00 -0.07 0.01 0.00 0.48 0.00 0.00 55.95 56.37 2zky s SER 34 Cb 0.00 0.30 0.02 0.00 0.10 0.00 0.00 66.02 66.44 2zky s SER 34 CO 0.00 -0.48 -0.12 -0.63 0.98 0.00 0.00 173.24 172.99 2zky s ILE 35 N -1.70 1.29 0.39 -1.02 1.01 -0.04 -2.89 121.20 118.25 2zky s ILE 35 Ca -0.11 -0.49 0.08 0.00 0.00 0.00 0.00 60.65 60.12 2zky s ILE 35 Cb -0.04 -1.23 -0.01 0.00 0.01 0.00 0.00 42.46 41.19 2zky s ILE 35 CO 0.02 0.41 0.43 -1.59 0.00 0.00 0.00 174.94 174.20 2zky s LYS 36 N 1.27 2.72 -0.20 2.79 -2.85 -0.36 -0.89 119.74 122.22 2zky s LYS 36 Ca -0.02 -1.35 0.00 0.00 -1.00 0.00 0.00 55.97 53.60 2zky s LYS 36 Cb -0.14 -2.56 0.00 0.00 -2.06 0.00 0.00 37.83 33.08 2zky s LYS 36 CO -0.05 -0.14 0.00 0.41 0.10 0.00 0.00 175.35 175.67 2zky n GLY 37 N -1.62 0.53 3.64 0.59 0.00 -0.77 -2.48 105.19 105.08 2zky n GLY 37 Ca 0.04 -0.87 -0.35 0.00 0.00 0.00 0.00 46.02 44.83 2zky n GLY 37 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2zky s LEU 38 N -0.43 3.86 0.48 0.99 1.43 -0.58 -4.35 118.68 120.08 2zky s LEU 38 Ca 0.00 0.08 -0.24 0.00 -1.03 0.00 0.00 54.13 52.95 2zky s LEU 38 Cb 0.00 -1.99 -0.08 0.00 0.03 0.00 0.00 46.19 44.16 2zky s LEU 38 CO 0.00 0.15 1.30 0.35 0.23 0.00 0.00 176.35 178.38 2zky n THR 39 N 3.68 3.07 -1.59 5.49 -2.24 -1.26 -4.14 114.28 117.29 2zky n THR 39 Ca -0.16 -0.50 -0.46 0.00 -2.27 0.00 0.00 64.05 60.66 2zky n THR 39 Cb 0.52 -1.61 -0.02 0.00 -2.10 0.00 0.00 70.33 67.12 2zky n THR 39 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2zky n GLU 40 N -0.40 1.33 0.00 -0.78 2.13 -1.26 -4.68 120.64 116.98 2zky n GLU 40 Ca 0.08 0.47 0.00 0.00 0.66 0.00 0.00 57.16 58.37 2zky n GLU 40 Cb 0.42 -1.90 0.00 0.00 0.27 0.00 0.00 31.44 30.23 2zky n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2zky n GLY 41 N 1.58 0.69 3.84 8.31 0.00 -0.37 -4.93 105.19 114.30 2zky n GLY 41 Ca 0.12 -2.08 -0.37 0.00 0.00 0.00 0.00 46.02 43.69 2zky n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2zky s LEU 42 N 0.00 4.42 -0.02 0.99 1.43 -1.26 -0.49 118.68 123.76 2zky s LEU 42 Ca 0.00 1.05 0.00 0.00 -1.03 0.00 0.00 54.13 54.15 2zky s LEU 42 Cb 0.00 -2.95 0.02 0.00 0.03 0.00 0.00 46.19 43.29 2zky s LEU 42 CO 0.00 0.22 0.00 -1.00 0.23 0.00 0.00 176.35 175.80 2zky s HIS 43 N -1.26 0.20 0.44 0.29 3.76 -0.37 -2.82 115.29 115.52 2zky s HIS 43 Ca 0.31 0.03 -0.26 0.00 -0.15 0.00 0.00 55.06 54.99 2zky s HIS 43 Cb -0.16 -0.28 -0.09 0.00 1.11 0.00 0.00 32.58 33.16 2zky s HIS 43 CO 0.17 -0.08 1.44 0.20 -0.85 0.00 0.00 174.74 175.62 2zky s GLY 44 N 0.74 2.92 -0.31 -2.22 0.00 -0.59 -0.62 107.32 107.24 2zky s GLY 44 Ca -0.07 1.49 -0.02 0.00 0.00 0.00 0.00 44.72 46.13 2zky s GLY 44 CO -0.02 2.12 0.12 -0.12 0.00 0.00 0.00 173.10 175.20 2zky s PHE 45 N -1.19 1.24 0.14 1.90 5.36 0.00 -0.07 117.98 125.37 2zky s PHE 45 Ca 0.60 -1.49 0.05 0.00 -0.96 0.00 0.00 56.93 55.13 2zky s PHE 45 Cb -0.44 -1.44 -0.04 0.00 -0.34 0.00 0.00 43.02 40.76 2zky s PHE 45 CO 0.58 -0.86 -0.11 -1.01 -1.46 0.00 0.00 175.22 172.35 2zky s HIS 46 N 1.69 1.30 -0.35 10.12 3.76 -0.79 -2.67 115.29 128.35 2zky s HIS 46 Ca 0.10 -0.68 -0.12 0.00 -0.15 0.00 0.00 55.06 54.21 2zky s HIS 46 Cb -0.17 -0.67 -0.01 0.00 1.11 0.00 0.00 32.58 32.84 2zky s HIS 46 CO -0.27 0.11 0.23 0.08 -0.85 0.00 0.00 174.74 174.04 2zky s VAL 47 N -2.86 5.12 0.40 -0.90 1.01 -0.36 -0.05 120.40 122.75 2zky s VAL 47 Ca 0.13 -0.35 -0.03 0.00 0.00 0.00 0.00 61.98 61.74 2zky s VAL 47 Cb -0.00 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 2zky s VAL 47 CO 0.02 -0.05 0.65 -1.00 0.00 0.00 0.00 175.10 174.72 2zky s HIS 48 N 1.69 3.52 0.15 5.22 3.76 0.17 -0.55 115.29 129.26 2zky s HIS 48 Ca 0.05 0.58 -0.19 0.00 -0.15 0.00 0.00 55.06 55.36 2zky s HIS 48 Cb -0.18 -2.09 0.05 0.00 1.11 0.00 0.00 32.58 31.47 2zky s HIS 48 CO 0.09 -0.04 1.67 1.49 -0.85 0.00 0.00 174.74 177.10 2zky h GLU 49 N 0.63 -0.04 -5.87 1.40 4.81 -0.07 -2.72 114.58 112.72 2zky h GLU 49 Ca -0.48 0.00 -0.67 0.00 -0.13 0.00 0.00 59.36 58.08 2zky h GLU 49 Cb 1.21 0.01 -0.10 0.00 0.63 0.00 0.00 28.75 30.49 2zky h GLU 49 CO 0.62 -0.03 -0.56 -0.06 -0.73 0.00 0.00 179.01 178.25 2zky s PHE 50 N -6.20 3.36 -0.62 0.92 0.08 -0.50 -4.63 117.98 110.39 2zky s PHE 50 Ca -0.14 0.31 -0.03 0.00 0.12 0.00 0.00 56.93 57.19 2zky s PHE 50 Cb 0.13 -1.82 0.15 0.00 -0.57 0.00 0.00 43.02 40.91 2zky s PHE 50 CO 0.70 0.59 2.52 0.41 -0.10 0.00 0.00 175.22 179.34 2zky n GLY 51 N 1.74 4.76 3.21 4.36 0.00 -1.07 -3.20 105.19 114.99 2zky n GLY 51 Ca -0.17 -2.08 -0.35 0.00 0.00 0.00 0.00 46.02 43.42 2zky n GLY 51 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2zky s ASP 52 N -0.09 4.68 -0.23 1.61 3.68 -1.26 -4.95 116.67 120.11 2zky s ASP 52 Ca 0.56 -1.03 0.13 0.00 2.13 0.00 0.00 52.55 54.34 2zky s ASP 52 Cb 0.39 -1.71 0.53 0.00 -1.45 0.00 0.00 42.92 40.67 2zky s ASP 52 CO -0.27 -0.20 1.46 -3.20 0.13 0.00 0.00 175.17 173.10 2zky n ASN 53 N 4.68 3.40 0.00 -0.34 2.85 -1.26 -2.54 115.26 122.04 2zky n ASN 53 Ca -0.15 -3.31 0.07 0.00 -0.11 0.00 0.00 54.58 51.08 2zky n ASN 53 Cb 0.45 -0.59 0.48 0.00 1.24 0.00 0.00 39.78 41.36 2zky n ASN 53 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 2zky h THR 54 N 1.49 1.02 -1.50 -0.44 1.35 -1.93 -2.55 112.91 110.36 2zky h THR 54 Ca 0.11 -0.15 -0.56 0.00 -0.55 0.00 0.00 66.41 65.26 2zky h THR 54 Cb 1.60 0.54 -0.42 0.00 -1.73 0.00 0.00 68.15 68.14 2zky h THR 54 CO 0.33 0.08 -0.79 0.00 -0.25 0.00 0.00 175.52 174.89 2zky n ALA 55 N -2.50 4.80 -0.63 6.62 0.00 -1.26 -5.06 120.51 122.48 2zky n ALA 55 Ca 0.05 -4.18 0.00 0.00 0.00 0.00 0.00 53.44 49.30 2zky n ALA 55 Cb 0.17 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.01 2zky n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zky n GLY 56 N -0.40 -0.58 0.17 0.00 0.00 -0.96 -3.24 105.19 100.18 2zky n GLY 56 Ca 0.34 -1.07 0.12 0.00 0.00 0.00 0.00 46.02 45.41 2zky n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zky h THR 58 N 0.00 1.26 0.00 0.00 2.02 -1.88 -2.78 112.91 111.53 2zky h THR 58 Ca 0.00 -0.93 0.00 0.00 0.77 0.00 0.00 66.41 66.25 2zky h THR 58 Cb 0.04 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 2zky h THR 58 CO 0.00 0.36 0.00 -1.54 0.37 0.00 0.00 175.52 174.71 2zky n SER 59 N -4.24 0.00 0.10 4.18 3.41 -1.08 -2.91 113.62 113.08 2zky n SER 59 Ca 0.06 0.24 0.10 0.00 -0.26 0.00 0.00 58.87 59.01 2zky n SER 59 Cb 0.24 -0.37 0.45 0.00 -0.26 0.00 0.00 64.21 64.26 2zky n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2zky n ALA 60 N -1.37 1.55 -0.25 7.33 0.00 -1.05 -4.54 120.51 122.17 2zky n ALA 60 Ca 0.06 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2zky n ALA 60 Cb 0.15 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.27 2zky n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zky n GLY 61 N -0.24 -1.09 3.77 0.00 0.00 -1.15 -1.41 105.19 105.07 2zky n GLY 61 Ca 0.02 -1.22 -0.27 0.00 0.00 0.00 0.00 46.02 44.54 2zky n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2zky n PRO 62 N -0.11 -1.04 -1.79 1.61 -0.04 -1.26 -4.65 135.00 127.72 2zky n PRO 62 Ca 0.00 -2.13 -0.41 0.00 -0.04 0.00 0.00 63.50 60.91 2zky n PRO 62 Cb 0.00 -1.20 -0.02 0.00 -0.04 0.00 0.00 33.50 32.24 2zky n PRO 62 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2zky s HIS 63 N -3.67 2.77 -0.30 0.54 3.76 -1.26 0.40 115.29 117.53 2zky s HIS 63 Ca 0.72 0.79 -0.35 0.00 -0.15 0.00 0.00 55.06 56.07 2zky s HIS 63 Cb -0.02 -4.05 -0.11 0.00 1.11 0.00 0.00 32.58 29.50 2zky s HIS 63 CO 0.50 -3.54 2.10 0.34 -0.85 0.00 0.00 174.74 173.29 2zky n PHE 64 N 2.22 1.78 -3.19 1.40 -0.00 0.29 -4.42 117.46 115.53 2zky n PHE 64 Ca 0.08 0.24 -0.22 0.00 -0.00 0.00 0.00 57.45 57.55 2zky n PHE 64 Cb 0.38 -2.55 -0.05 0.00 -0.00 0.00 0.00 39.48 37.25 2zky n PHE 64 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 2zky n ASN 65 N 9.02 1.26 0.31 -2.13 5.15 -1.26 -1.94 115.26 125.68 2zky n ASN 65 Ca 0.36 -2.99 0.20 0.00 -0.60 0.00 0.00 54.58 51.55 2zky n ASN 65 Cb 0.24 -0.63 1.04 0.00 -0.53 0.00 0.00 39.78 39.90 2zky n ASN 65 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2zky h PRO 66 N 3.55 0.00 -0.33 1.20 0.13 -1.95 -2.24 132.00 132.36 2zky h PRO 66 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2zky h PRO 66 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 2zky h PRO 66 CO 0.55 0.01 0.00 1.28 -0.23 0.00 0.00 178.00 179.62 2zky n LEU 67 N -3.25 2.93 -3.84 1.56 4.77 -1.26 -4.96 117.00 112.95 2zky n LEU 67 Ca -0.02 -1.26 -0.28 0.00 -0.03 0.00 0.00 56.01 54.42 2zky n LEU 67 Cb 0.13 -0.21 0.03 0.00 -2.33 0.00 0.00 43.42 41.04 2zky n LEU 67 CO 0.23 0.63 0.10 -1.20 -1.33 0.00 0.00 177.39 175.82 2zky n SER 68 N 1.15 -4.35 -5.01 -1.43 7.64 -0.84 -4.99 113.62 105.79 2zky n SER 68 Ca 0.18 -0.76 -0.21 0.00 1.01 0.00 0.00 58.87 59.10 2zky n SER 68 Cb 0.52 -4.07 0.05 0.00 -1.01 0.00 0.00 64.21 59.70 2zky n SER 68 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2zky s ARG 69 N -6.46 2.32 0.39 1.43 0.52 -1.26 -5.11 118.95 110.78 2zky s ARG 69 Ca 0.54 -1.69 -0.06 0.00 -0.52 0.00 0.00 55.73 54.00 2zky s ARG 69 Cb -0.26 -2.55 -0.05 0.00 0.52 0.00 0.00 34.95 32.61 2zky s ARG 69 CO 0.81 -0.78 0.68 0.15 0.02 0.00 0.00 175.30 176.19 2zky s LYS 70 N -4.57 3.63 0.63 3.54 1.02 -1.26 -4.75 119.74 117.97 2zky s LYS 70 Ca 0.56 0.15 -0.19 0.00 0.02 0.00 0.00 55.97 56.52 2zky s LYS 70 Cb -0.05 -2.49 -0.02 0.00 -0.52 0.00 0.00 37.83 34.75 2zky s LYS 70 CO 0.35 0.01 1.31 -1.58 -0.92 0.00 0.00 175.35 174.52 2zky s HIS 71 N -2.39 2.09 0.02 3.18 5.65 0.14 -3.07 115.29 120.91 2zky s HIS 71 Ca 0.47 1.46 -0.01 0.00 0.25 0.00 0.00 55.06 57.23 2zky s HIS 71 Cb -0.10 -3.72 0.00 0.00 -1.18 0.00 0.00 32.58 27.58 2zky s HIS 71 CO 0.36 -2.95 0.06 0.41 -0.65 0.00 0.00 174.74 171.96 2zky n GLY 72 N 0.88 1.69 3.94 1.59 0.00 -1.25 -4.43 105.19 107.61 2zky n GLY 72 Ca 0.15 -0.99 -0.24 0.00 0.00 0.00 0.00 46.02 44.94 2zky n GLY 72 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2zky s GLY 73 N -1.43 1.39 0.57 -0.02 0.00 -1.25 -4.69 107.32 101.89 2zky s GLY 73 Ca 0.01 -0.89 0.27 0.00 0.00 0.00 0.00 44.72 44.11 2zky s GLY 73 CO 0.01 -0.83 2.06 -0.56 0.00 0.00 0.00 173.10 173.78 2zky h PRO 74 N 0.88 0.00 0.00 2.90 0.13 -1.87 -0.31 132.00 133.73 2zky h PRO 74 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2zky h PRO 74 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2zky h PRO 74 CO 0.62 0.00 -0.09 1.63 -0.23 0.00 0.00 178.00 179.93 2zky n LYS 75 N -3.95 0.16 -1.61 0.86 5.02 -1.26 -4.89 118.16 112.49 2zky n LYS 75 Ca 0.03 0.11 -0.33 0.00 -2.02 0.00 0.00 58.31 56.11 2zky n LYS 75 Cb 0.39 -1.67 0.06 0.00 -0.02 0.00 0.00 35.03 33.80 2zky n LYS 75 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2zky s ASP 76 N -3.87 4.84 -0.08 4.39 1.11 -0.13 -4.97 116.67 117.97 2zky s ASP 76 Ca 0.11 2.02 -0.14 0.00 0.18 0.00 0.00 52.55 54.73 2zky s ASP 76 Cb 0.15 -2.55 -0.29 0.00 1.07 0.00 0.00 42.92 41.30 2zky s ASP 76 CO 0.59 -1.81 0.63 1.05 1.18 0.00 0.00 175.17 176.81 2zky h GLU 77 N -0.23 0.32 -5.36 8.23 -0.00 -1.90 -3.41 114.58 112.23 2zky h GLU 77 Ca -0.46 -0.54 -0.64 0.00 -0.00 0.00 0.00 59.36 57.71 2zky h GLU 77 Cb 1.25 0.20 -0.15 0.00 -0.00 0.00 0.00 28.75 30.05 2zky h GLU 77 CO 0.53 1.26 0.64 -2.00 -0.00 0.00 0.00 179.01 179.44 2zky s GLU 78 N -2.52 3.24 0.12 1.06 2.56 -1.26 -4.96 118.70 116.93 2zky s GLU 78 Ca -0.18 -1.06 -0.21 0.00 0.00 0.00 0.00 54.97 53.52 2zky s GLU 78 Cb 0.05 -4.43 0.05 0.00 2.00 0.00 0.00 34.13 31.80 2zky s GLU 78 CO 0.81 -1.82 0.52 -0.98 -0.56 0.00 0.00 175.26 173.23 2zky s ARG 79 N 3.77 1.14 0.39 4.30 1.04 -1.17 -3.79 118.95 124.62 2zky s ARG 79 Ca 0.25 -0.47 -0.24 0.00 -1.04 0.00 0.00 55.73 54.23 2zky s ARG 79 Cb -0.14 0.52 -0.09 0.00 -2.04 0.00 0.00 34.95 33.20 2zky s ARG 79 CO 0.05 -0.46 1.01 -1.01 -0.04 0.00 0.00 175.30 174.85 2zky s HIS 80 N -3.38 3.36 0.48 5.89 3.76 -1.24 -4.75 115.29 119.42 2zky s HIS 80 Ca -0.00 1.67 0.16 0.00 -0.15 0.00 0.00 55.06 56.74 2zky s HIS 80 Cb 0.00 -3.05 1.17 0.00 1.11 0.00 0.00 32.58 31.81 2zky s HIS 80 CO -0.09 -0.38 2.05 0.28 -0.85 0.00 0.00 174.74 175.75 2zky h VAL 81 N 2.24 0.92 -0.38 -0.90 2.07 -1.82 -0.90 116.25 117.48 2zky h VAL 81 Ca -0.48 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 66.97 2zky h VAL 81 Cb 1.21 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2zky h VAL 81 CO 0.63 0.04 0.00 0.61 0.02 0.00 0.00 177.57 178.86 2zky n GLY 82 N -1.55 1.84 3.49 2.17 0.00 -0.82 -4.33 105.19 105.99 2zky n GLY 82 Ca 0.04 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 2zky n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2zky s ASP 83 N -0.68 6.27 0.00 1.61 1.01 -0.35 -1.22 116.67 123.31 2zky s ASP 83 Ca 0.31 -1.04 0.21 0.00 0.71 0.00 0.00 52.55 52.74 2zky s ASP 83 Cb 0.21 -2.47 0.57 0.00 1.01 0.00 0.00 42.92 42.24 2zky s ASP 83 CO 0.14 -1.50 1.48 0.18 0.21 0.00 0.00 175.17 175.68 2zky n LEU 84 N 8.12 3.52 0.00 1.23 4.77 -1.09 -3.74 117.00 129.80 2zky n LEU 84 Ca 0.06 -1.72 0.00 0.00 -0.03 0.00 0.00 56.01 54.32 2zky n LEU 84 Cb 0.47 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2zky n LEU 84 CO 0.64 0.86 0.00 0.61 -1.33 0.00 0.00 177.39 178.17 2zky n GLY 85 N 1.55 0.62 3.40 -0.72 0.00 -1.24 -4.78 105.19 104.02 2zky n GLY 85 Ca 0.22 -0.78 -0.22 0.00 0.00 0.00 0.00 46.02 45.24 2zky n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2zky s ASN 86 N -4.00 3.07 0.25 1.61 0.01 -1.26 -0.82 114.94 113.80 2zky s ASN 86 Ca 0.00 -1.00 0.11 0.00 -0.71 0.00 0.00 52.86 51.25 2zky s ASN 86 Cb 0.00 -0.21 -0.05 0.00 0.41 0.00 0.00 41.25 41.40 2zky s ASN 86 CO 0.00 -0.05 -0.19 0.68 -1.51 0.00 0.00 177.10 176.03 2zky s VAL 87 N -2.64 2.28 -0.21 1.60 -7.23 0.21 -4.88 120.40 109.54 2zky s VAL 87 Ca 0.25 -2.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.10 2zky s VAL 87 Cb -0.03 -2.21 0.02 0.00 0.56 0.00 0.00 36.38 34.72 2zky s VAL 87 CO 0.11 -0.43 -0.15 -0.89 -0.31 0.00 0.00 175.10 173.43 2zky s THR 88 N -2.55 2.35 -0.13 5.32 2.01 -1.26 -1.24 115.64 120.14 2zky s THR 88 Ca 0.27 -0.99 -0.21 0.00 0.31 0.00 0.00 61.69 61.07 2zky s THR 88 Cb -0.04 -2.09 -0.03 0.00 0.01 0.00 0.00 72.50 70.35 2zky s THR 88 CO 0.12 0.40 0.63 0.00 -0.69 0.00 0.00 174.62 175.08 2zky s ALA 89 N 1.29 3.45 1.09 7.40 0.00 0.36 -4.05 121.76 131.30 2zky s ALA 89 Ca 0.02 -0.09 -0.15 0.00 0.00 0.00 0.00 51.96 51.74 2zky s ALA 89 Cb -0.15 -2.90 0.21 0.00 0.00 0.00 0.00 23.12 20.28 2zky s ALA 89 CO -0.09 -0.27 0.97 -0.40 0.00 0.00 0.00 175.76 175.97 2zky n ASP 90 N 4.29 -0.77 0.23 0.00 3.85 0.09 -1.24 116.55 122.99 2zky n ASP 90 Ca -0.02 -1.23 0.16 0.00 -0.71 0.00 0.00 54.79 52.99 2zky n ASP 90 Cb 0.51 -0.80 0.80 0.00 -1.35 0.00 0.00 41.12 40.27 2zky n ASP 90 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.20 176.26 2zky h LYS 91 N 0.00 0.00 -0.75 0.11 2.10 -1.97 -1.89 116.57 114.18 2zky h LYS 91 Ca -0.33 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.31 2zky h LYS 91 Cb 0.96 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.29 2zky h LYS 91 CO 0.23 0.00 0.01 -0.25 -2.00 0.00 0.00 179.45 177.44 2zky n ASP 92 N -2.64 3.93 -1.57 7.07 8.00 -1.26 -4.88 116.55 125.19 2zky n ASP 92 Ca -0.01 -2.59 -0.18 0.00 0.71 0.00 0.00 54.79 52.72 2zky n ASP 92 Cb 0.11 -0.62 -0.06 0.00 -0.02 0.00 0.00 41.12 40.54 2zky n ASP 92 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2zky n ALA 93 N 0.37 -0.34 -3.27 2.24 0.00 -0.71 -4.85 120.51 113.95 2zky n ALA 93 Ca 0.18 0.26 -0.33 0.00 0.00 0.00 0.00 53.44 53.55 2zky n ALA 93 Cb 0.85 -1.89 -0.16 0.00 0.00 0.00 0.00 19.45 18.25 2zky n ALA 93 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2zky s VAL 94 N -2.73 2.47 -0.37 0.00 1.01 -1.26 -1.53 120.40 117.99 2zky s VAL 94 Ca 0.00 -0.86 -0.10 0.00 0.00 0.00 0.00 61.98 61.02 2zky s VAL 94 Cb 0.00 -2.00 0.03 0.00 0.00 0.00 0.00 36.38 34.41 2zky s VAL 94 CO 0.00 0.54 0.18 0.00 0.00 0.00 0.00 175.10 175.82 2zky s ALA 95 N 0.49 3.22 -0.48 5.51 0.00 -0.06 -0.73 121.76 129.70 2zky s ALA 95 Ca -0.13 -1.72 -0.23 0.00 0.00 0.00 0.00 51.96 49.89 2zky s ALA 95 Cb -0.17 -2.52 0.03 0.00 0.00 0.00 0.00 23.12 20.47 2zky s ALA 95 CO 0.05 -1.36 0.80 -0.51 0.00 0.00 0.00 175.76 174.74 2zky s ASP 96 N 1.52 6.36 0.08 0.00 1.01 -1.26 -0.86 116.67 123.53 2zky s ASP 96 Ca 0.01 -0.29 -0.21 0.00 0.71 0.00 0.00 52.55 52.77 2zky s ASP 96 Cb -0.19 -2.38 -0.07 0.00 1.01 0.00 0.00 42.92 41.29 2zky s ASP 96 CO 0.06 -0.99 0.63 -0.69 0.21 0.00 0.00 175.17 174.38 2zky s VAL 97 N 3.36 4.67 -0.29 -1.27 1.01 0.14 -4.84 120.40 123.18 2zky s VAL 97 Ca 0.28 1.35 0.02 0.00 0.00 0.00 0.00 61.98 63.63 2zky s VAL 97 Cb -0.13 -3.97 0.19 0.00 0.00 0.00 0.00 36.38 32.47 2zky s VAL 97 CO 0.20 0.52 0.58 -0.55 0.00 0.00 0.00 175.10 175.85 2zky s SER 98 N -0.96 -1.37 0.04 3.32 0.15 -1.24 -1.67 113.70 111.96 2zky s SER 98 Ca 0.31 0.46 0.01 0.00 0.70 0.00 0.00 55.95 57.44 2zky s SER 98 Cb -0.20 2.02 -0.03 0.00 -1.71 0.00 0.00 66.02 66.10 2zky s SER 98 CO 0.21 -0.29 -0.06 -0.63 1.20 0.00 0.00 173.24 173.67 2zky s ILE 99 N 2.82 0.41 -0.06 6.45 1.01 0.83 -4.99 121.20 127.66 2zky s ILE 99 Ca 0.15 -1.20 0.02 0.00 0.00 0.00 0.00 60.65 59.62 2zky s ILE 99 Cb -0.12 -0.72 0.01 0.00 0.01 0.00 0.00 42.46 41.64 2zky s ILE 99 CO -0.24 -0.53 -0.11 -0.70 0.00 0.00 0.00 174.94 173.36 2zky s GLU 100 N -2.04 1.50 0.01 2.79 2.12 -1.26 0.38 118.70 122.21 2zky s GLU 100 Ca -0.07 -0.35 0.01 0.00 0.36 0.00 0.00 54.97 54.92 2zky s GLU 100 Cb -0.06 -1.27 -0.01 0.00 0.26 0.00 0.00 34.13 33.04 2zky s GLU 100 CO -0.02 0.01 -0.05 0.34 -0.54 0.00 0.00 175.26 175.01 2zky s ASP 101 N 0.69 0.55 0.00 -1.70 -1.08 -0.32 -4.95 116.67 109.87 2zky s ASP 101 Ca -0.14 -0.18 0.14 0.00 -0.52 0.00 0.00 52.55 51.86 2zky s ASP 101 Cb -0.15 -0.03 0.16 0.00 -1.46 0.00 0.00 42.92 41.43 2zky s ASP 101 CO 0.03 -0.01 1.01 -1.20 0.52 0.00 0.00 175.17 175.52 2zky n SER 102 N 2.64 2.35 -0.12 -0.34 7.64 -1.26 -0.67 113.62 123.85 2zky n SER 102 Ca -0.15 -1.66 -0.22 0.00 1.01 0.00 0.00 58.87 57.85 2zky n SER 102 Cb 0.58 -0.04 -0.12 0.00 -1.01 0.00 0.00 64.21 63.62 2zky n SER 102 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2zky n VAL 103 N 0.82 1.53 -1.49 0.44 0.31 -1.26 -4.94 118.33 113.74 2zky n VAL 103 Ca 0.09 -0.50 -0.30 0.00 -0.01 0.00 0.00 64.34 63.62 2zky n VAL 103 Cb 0.38 -1.62 0.09 0.00 -0.91 0.00 0.00 33.84 31.79 2zky n VAL 103 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 2zky s ILE 104 N -2.51 3.12 0.15 2.52 -4.36 -1.26 -4.85 121.20 114.01 2zky s ILE 104 Ca -0.35 0.37 -0.15 0.00 -0.26 0.00 0.00 60.65 60.26 2zky s ILE 104 Cb 0.10 -3.06 0.03 0.00 1.25 0.00 0.00 42.46 40.78 2zky s ILE 104 CO 0.58 -0.48 0.41 -0.55 0.24 0.00 0.00 174.94 175.15 2zky s SER 105 N -3.79 -0.19 0.00 4.36 0.15 -1.06 -4.72 113.70 108.44 2zky s SER 105 Ca 0.61 -0.45 0.23 0.00 0.70 0.00 0.00 55.95 57.04 2zky s SER 105 Cb -0.15 0.49 0.65 0.00 -1.71 0.00 0.00 66.02 65.31 2zky s SER 105 CO 0.55 -0.91 1.55 0.18 1.20 0.00 0.00 173.24 175.81 2zky n LEU 106 N -0.25 3.97 -3.56 3.45 4.77 -1.26 -1.36 117.00 122.77 2zky n LEU 106 Ca -0.13 -1.98 -0.10 0.00 -0.03 0.00 0.00 56.01 53.76 2zky n LEU 106 Cb 0.63 -0.49 -0.02 0.00 -2.33 0.00 0.00 43.42 41.21 2zky n LEU 106 CO 0.18 0.99 0.43 -0.94 -1.33 0.00 0.00 177.39 176.72 2zky s SER 107 N -1.01 -0.47 0.10 -1.43 1.04 -1.26 -4.45 113.70 106.22 2zky s SER 107 Ca 0.50 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.74 2zky s SER 107 Cb 0.26 0.64 0.00 0.00 0.10 0.00 0.00 66.02 67.02 2zky s SER 107 CO 0.34 -1.08 0.00 0.61 0.98 0.00 0.00 173.24 174.09 2zky n GLY 108 N -0.40 -1.90 0.39 7.32 0.00 -1.26 -3.74 105.19 105.60 2zky n GLY 108 Ca -0.13 -1.37 0.20 0.00 0.00 0.00 0.00 46.02 44.72 2zky n GLY 108 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2zky h ASP 109 N 0.00 0.10 -0.59 1.61 3.04 -2.01 -0.78 116.42 117.78 2zky h ASP 109 Ca 0.00 0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.80 2zky h ASP 109 Cb 0.00 -0.01 0.00 0.00 -1.04 0.00 0.00 39.33 38.28 2zky h ASP 109 CO 0.00 0.05 0.00 1.41 -2.04 0.00 0.00 179.24 178.66 2zky n HIS 110 N -4.39 1.46 -1.66 4.15 8.25 -1.26 -5.00 115.22 116.77 2zky n HIS 110 Ca 0.12 -0.64 -0.46 0.00 -0.26 0.00 0.00 57.72 56.48 2zky n HIS 110 Cb 0.63 -0.27 -0.04 0.00 1.12 0.00 0.00 29.99 31.43 2zky n HIS 110 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2zky n ILE 112 N 2.65 0.00 -1.90 0.00 -5.35 -0.46 -4.90 119.36 109.40 2zky n ILE 112 Ca 0.15 -0.26 -0.42 0.00 -0.27 0.00 0.00 62.75 61.95 2zky n ILE 112 Cb 0.29 1.15 -0.03 0.00 -1.74 0.00 0.00 39.64 39.31 2zky n ILE 112 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2zky s ILE 113 N -2.17 2.51 0.00 7.28 1.01 -1.26 -1.58 121.20 126.98 2zky s ILE 113 Ca 0.12 0.37 0.00 0.00 0.00 0.00 0.00 60.65 61.14 2zky s ILE 113 Cb 0.14 -3.24 0.00 0.00 0.01 0.00 0.00 42.46 39.37 2zky s ILE 113 CO 0.51 0.03 0.00 0.61 0.00 0.00 0.00 174.94 176.09 2zky n GLY 114 N 3.69 0.66 2.46 6.18 0.00 0.75 -5.00 105.19 113.93 2zky n GLY 114 Ca 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.00 2zky n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2zky n ARG 115 N -2.00 0.90 -4.60 1.61 1.74 -0.61 -2.60 116.66 111.10 2zky n ARG 115 Ca 0.00 -2.14 -0.33 0.00 -0.77 0.00 0.00 57.85 54.60 2zky n ARG 115 Cb 0.00 0.11 -0.12 0.00 -1.02 0.00 0.00 32.46 31.43 2zky n ARG 115 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2zky s THR 116 N -1.61 3.56 -0.13 0.55 2.01 -1.03 -0.69 115.64 118.31 2zky s THR 116 Ca 0.26 -0.50 -0.14 0.00 0.31 0.00 0.00 61.69 61.62 2zky s THR 116 Cb -0.02 -2.50 -0.05 0.00 0.01 0.00 0.00 72.50 69.94 2zky s THR 116 CO 0.16 0.54 0.32 -0.22 -0.69 0.00 0.00 174.62 174.73 2zky s LEU 117 N -0.06 4.30 -0.03 4.42 2.96 -0.48 0.46 118.68 130.25 2zky s LEU 117 Ca -0.00 0.61 0.03 0.00 -0.22 0.00 0.00 54.13 54.55 2zky s LEU 117 Cb -0.13 -2.42 -0.00 0.00 0.50 0.00 0.00 46.19 44.14 2zky s LEU 117 CO 0.03 0.15 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.41 2zky s VAL 118 N 0.10 0.98 -0.22 1.68 1.01 0.93 -2.31 120.40 122.57 2zky s VAL 118 Ca 0.19 -0.48 -0.06 0.00 0.00 0.00 0.00 61.98 61.63 2zky s VAL 118 Cb -0.14 -0.85 -0.02 0.00 0.00 0.00 0.00 36.38 35.37 2zky s VAL 118 CO 0.06 0.29 0.01 0.54 0.00 0.00 0.00 175.10 176.01 2zky s VAL 119 N 0.08 3.97 0.54 2.92 0.11 -0.34 -1.89 120.40 125.79 2zky s VAL 119 Ca -0.02 -0.30 -0.02 0.00 -2.93 0.00 0.00 61.98 58.71 2zky s VAL 119 Cb -0.09 -2.82 0.02 0.00 -1.53 0.00 0.00 36.38 31.96 2zky s VAL 119 CO 0.01 0.40 0.80 -1.00 -3.33 0.00 0.00 175.10 171.98 2zky s HIS 120 N 1.27 3.11 0.05 1.54 3.76 0.90 -1.72 115.29 124.20 2zky s HIS 120 Ca 0.04 0.31 -0.22 0.00 -0.15 0.00 0.00 55.06 55.05 2zky s HIS 120 Cb -0.15 -2.64 -0.13 0.00 1.11 0.00 0.00 32.58 30.77 2zky s HIS 120 CO 0.01 -0.74 1.47 1.49 -0.85 0.00 0.00 174.74 176.13 2zky h GLU 121 N 0.04 0.23 -5.61 1.40 4.81 -0.94 -3.37 114.58 111.14 2zky h GLU 121 Ca -0.45 -0.08 -0.62 0.00 -0.13 0.00 0.00 59.36 58.08 2zky h GLU 121 Cb 1.27 -0.02 -0.09 0.00 0.63 0.00 0.00 28.75 30.54 2zky h GLU 121 CO 0.57 0.48 -0.45 0.15 -0.73 0.00 0.00 179.01 179.03 2zky s LYS 122 N -4.94 2.20 0.71 1.92 1.02 -0.24 -4.87 119.74 115.54 2zky s LYS 122 Ca -0.14 -2.14 -0.14 0.00 0.02 0.00 0.00 55.97 53.56 2zky s LYS 122 Cb 0.05 -1.81 0.03 0.00 -0.52 0.00 0.00 37.83 35.58 2zky s LYS 122 CO 0.71 -0.37 1.14 0.00 -0.92 0.00 0.00 175.35 175.91 2zky s ALA 123 N -2.77 2.29 -0.26 5.17 0.00 -1.13 -1.55 121.76 123.51 2zky s ALA 123 Ca 0.24 0.61 -0.13 0.00 0.00 0.00 0.00 51.96 52.68 2zky s ALA 123 Cb 0.01 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 2zky s ALA 123 CO 0.14 -1.59 0.28 0.34 0.00 0.00 0.00 175.76 174.93 2zky s ASP 124 N -2.53 6.18 0.00 0.00 3.68 -1.26 -3.83 116.67 118.91 2zky s ASP 124 Ca 0.68 0.19 0.10 0.00 2.13 0.00 0.00 52.55 55.66 2zky s ASP 124 Cb -0.23 -2.17 0.61 0.00 -1.45 0.00 0.00 42.92 39.69 2zky s ASP 124 CO 0.45 -0.09 1.25 -0.90 0.13 0.00 0.00 175.17 176.02 2zky n ASP 125 N 4.96 0.00 -3.05 -0.34 3.85 0.15 -4.87 116.55 117.24 2zky n ASP 125 Ca -0.11 -1.33 -0.21 0.00 -0.71 0.00 0.00 54.79 52.43 2zky n ASP 125 Cb 0.51 0.00 0.01 0.00 -1.35 0.00 0.00 41.12 40.29 2zky n ASP 125 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 2zky n LEU 126 N -0.69 -1.75 -0.19 -2.12 4.77 -1.26 -2.00 117.00 113.75 2zky n LEU 126 Ca 0.08 -0.23 -0.03 0.00 -0.03 0.00 0.00 56.01 55.80 2zky n LEU 126 Cb 0.04 -2.36 -0.01 0.00 -2.33 0.00 0.00 43.42 38.75 2zky n LEU 126 CO 0.06 0.10 -0.02 0.61 -1.33 0.00 0.00 177.39 176.81 2zky n GLY 127 N -1.18 0.58 0.79 -0.72 0.00 -1.23 -3.77 105.19 99.65 2zky n GLY 127 Ca -0.07 -0.47 0.07 0.00 0.00 0.00 0.00 46.02 45.55 2zky n GLY 127 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2zky n LYS 128 N -2.53 2.51 0.00 1.61 5.02 -0.85 -4.65 118.16 119.27 2zky n LYS 128 Ca -0.03 -2.84 0.14 0.00 -2.02 0.00 0.00 58.31 53.56 2zky n LYS 128 Cb 0.13 -1.79 0.67 0.00 -0.02 0.00 0.00 35.03 34.03 2zky n LYS 128 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2zky n GLY 129 N -0.75 -1.42 1.75 0.72 0.00 -1.26 -4.95 105.19 99.29 2zky n GLY 129 Ca 0.22 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2zky n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zky n GLY 130 N 1.42 0.56 3.35 -0.02 0.00 -1.26 -4.99 105.19 104.25 2zky n GLY 130 Ca 0.10 -0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.96 2zky n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2zky s ASN 131 N -2.00 1.08 0.15 1.61 2.20 -1.26 -5.07 114.94 111.65 2zky s ASN 131 Ca 0.00 -1.57 -0.14 0.00 -0.94 0.00 0.00 52.86 50.21 2zky s ASN 131 Cb 0.00 0.56 0.03 0.00 -2.00 0.00 0.00 41.25 39.83 2zky s ASN 131 CO 0.00 -1.10 1.71 -0.08 -2.94 0.00 0.00 177.10 174.69 2zky h GLU 132 N 2.22 0.70 -0.63 3.55 4.81 -1.99 -2.75 114.58 120.48 2zky h GLU 132 Ca -0.28 -0.12 0.16 0.00 -0.13 0.00 0.00 59.36 58.99 2zky h GLU 132 Cb 1.24 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.47 2zky h GLU 132 CO 0.40 0.62 0.44 1.49 -0.73 0.00 0.00 179.01 181.23 2zky h GLU 133 N 0.62 0.14 -0.01 1.92 4.57 -1.99 -1.09 114.58 118.74 2zky h GLU 133 Ca 0.16 -0.01 -0.18 0.00 -1.18 0.00 0.00 59.36 58.15 2zky h GLU 133 Cb 0.18 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 2zky h GLU 133 CO -0.01 0.10 -0.80 1.03 -1.18 0.00 0.00 179.01 178.14 2zky h SER 134 N 0.15 0.20 -0.04 1.04 0.87 -1.83 0.14 113.55 114.08 2zky h SER 134 Ca 0.30 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 2zky h SER 134 Cb 0.99 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.89 2zky h SER 134 CO -0.04 0.91 0.00 0.35 -0.53 0.00 0.00 176.83 177.52 2zky n THR 135 N -3.69 0.04 0.01 2.23 -2.24 -0.45 -2.22 114.28 107.96 2zky n THR 135 Ca -0.03 -0.15 -0.02 0.00 -2.27 0.00 0.00 64.05 61.59 2zky n THR 135 Cb 0.76 0.03 -0.01 0.00 -2.10 0.00 0.00 70.33 69.00 2zky n THR 135 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2zky n LYS 136 N -0.33 0.11 0.00 -0.78 5.02 -1.00 0.24 118.16 121.42 2zky n LYS 136 Ca 0.19 0.04 0.06 0.00 -2.02 0.00 0.00 58.31 56.58 2zky n LYS 136 Cb 0.22 -0.62 0.02 0.00 -0.02 0.00 0.00 35.03 34.63 2zky n LYS 136 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2zky n THR 137 N -3.51 0.00 -1.23 -0.18 -2.24 0.44 -4.64 114.28 102.93 2zky n THR 137 Ca -0.03 -0.43 -0.08 0.00 -2.27 0.00 0.00 64.05 61.24 2zky n THR 137 Cb 0.11 1.19 -0.03 0.00 -2.10 0.00 0.00 70.33 69.49 2zky n THR 137 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2zky n GLY 138 N 0.85 0.92 2.40 3.38 0.00 -0.85 -2.84 105.19 109.05 2zky n GLY 138 Ca 0.06 -0.29 -0.18 0.00 0.00 0.00 0.00 46.02 45.60 2zky n GLY 138 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2zky n ASN 139 N -0.20 -5.03 0.00 1.61 3.02 -1.20 -0.68 115.26 112.79 2zky n ASN 139 Ca -0.08 0.27 0.09 0.00 -0.03 0.00 0.00 54.58 54.83 2zky n ASN 139 Cb 0.36 -4.36 0.50 0.00 -0.61 0.00 0.00 39.78 35.67 2zky n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2zky n ALA 140 N -0.37 2.09 -0.13 5.41 0.00 -1.13 -4.78 120.51 121.59 2zky n ALA 140 Ca -0.20 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2zky n ALA 140 Cb 0.63 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.79 2zky n ALA 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zky n GLY 141 N 0.13 -1.27 3.65 0.00 0.00 -1.26 -1.08 105.19 105.36 2zky n GLY 141 Ca 0.12 -1.26 -0.30 0.00 0.00 0.00 0.00 46.02 44.58 2zky n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2zky s SER 142 N -4.00 2.79 -0.51 1.61 1.04 -1.26 -4.60 113.70 108.77 2zky s SER 142 Ca 0.00 1.71 -0.19 0.00 0.48 0.00 0.00 55.95 57.95 2zky s SER 142 Cb 0.00 -2.34 0.06 0.00 0.10 0.00 0.00 66.02 63.84 2zky s SER 142 CO 0.00 -3.10 0.63 -0.13 0.98 0.00 0.00 173.24 171.61 2zky s ARG 143 N -4.74 3.12 0.14 4.02 0.52 -1.26 -0.94 118.95 119.81 2zky s ARG 143 Ca 0.65 -0.89 0.05 0.00 -0.52 0.00 0.00 55.73 55.02 2zky s ARG 143 Cb -0.21 -4.10 -0.14 0.00 0.52 0.00 0.00 34.95 31.03 2zky s ARG 143 CO 0.59 -1.23 1.31 -0.07 0.02 0.00 0.00 175.30 175.92 2zky h LEU 144 N 9.71 0.09 -7.00 2.53 3.38 -1.64 -3.47 115.31 118.91 2zky h LEU 144 Ca -0.27 -0.09 0.07 0.00 0.09 0.00 0.00 57.88 57.67 2zky h LEU 144 Cb 1.09 -0.03 -0.17 0.00 0.09 0.00 0.00 40.66 41.64 2zky h LEU 144 CO 0.97 1.01 0.44 0.00 0.09 0.00 0.00 178.44 180.95 2zky s ALA 145 N -2.86 -1.82 0.38 1.53 0.00 -1.20 -4.12 121.76 113.67 2zky s ALA 145 Ca -0.00 1.12 -0.16 0.00 0.00 0.00 0.00 51.96 52.92 2zky s ALA 145 Cb 0.10 0.16 0.06 0.00 0.00 0.00 0.00 23.12 23.44 2zky s ALA 145 CO 0.82 -0.57 0.82 0.00 0.00 0.00 0.00 175.76 176.83 2zky s GLY 147 N -3.11 -0.20 0.16 0.00 0.00 -0.98 -0.97 107.32 102.22 2zky s GLY 147 Ca 0.16 2.00 -0.27 0.00 0.00 0.00 0.00 44.72 46.61 2zky s GLY 147 CO 0.11 0.80 0.82 0.14 0.00 0.00 0.00 173.10 174.98 2zky s VAL 148 N -1.76 4.38 -0.27 1.40 1.01 -1.26 -1.38 120.40 122.52 2zky s VAL 148 Ca 0.06 1.80 -0.26 0.00 0.00 0.00 0.00 61.98 63.58 2zky s VAL 148 Cb -0.01 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.19 2zky s VAL 148 CO -0.04 0.47 0.92 -0.63 0.00 0.00 0.00 175.10 175.82 2zky s ILE 149 N -0.87 4.72 0.25 2.22 1.01 0.13 -4.53 121.20 124.14 2zky s ILE 149 Ca 0.38 1.61 0.11 0.00 0.00 0.00 0.00 60.65 62.76 2zky s ILE 149 Cb -0.23 -4.23 -0.05 0.00 0.01 0.00 0.00 42.46 37.96 2zky s ILE 149 CO 0.27 -0.22 -0.18 -0.83 0.00 0.00 0.00 174.94 173.97 2zky s GLY 150 N 1.44 1.82 0.31 6.18 0.00 -0.41 -0.18 107.32 116.48 2zky s GLY 150 Ca 0.38 -1.78 -0.29 0.00 0.00 0.00 0.00 44.72 43.03 2zky s GLY 150 CO 0.10 -1.85 1.39 -0.42 0.00 0.00 0.00 173.10 172.32 2zky s ILE 151 N -2.27 2.56 0.18 0.90 1.01 -1.26 -0.47 121.20 121.86 2zky s ILE 151 Ca 0.28 0.53 0.07 0.00 0.00 0.00 0.00 60.65 61.53 2zky s ILE 151 Cb -0.06 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 39.03 2zky s ILE 151 CO 0.14 0.11 -0.14 0.00 0.00 0.00 0.00 174.94 175.05 2zky s ALA 152 N -0.72 1.89 -2.00 9.38 0.00 -0.38 -4.75 121.76 125.18 2zky s ALA 152 Ca 0.54 -1.57 0.21 0.00 0.00 0.00 0.00 51.96 51.13 2zky s ALA 152 Cb -0.42 -0.08 1.28 0.00 0.00 0.00 0.00 23.12 23.89 2zky s ALA 152 CO 0.51 0.08 1.65 0.94 0.00 0.00 0.00 175.76 178.94