#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zvn n GLY 1 N 0.00 2.12 3.70 5.00 0.00 -1.26 -4.95 105.19 109.80 1zvn n GLY 1 Ca 0.00 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 1zvn n GLY 1 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1zvn s TRP 2 N -1.12 2.78 -0.31 1.61 0.52 -1.26 -4.96 118.94 116.20 1zvn s TRP 2 Ca 0.45 0.58 -0.17 0.00 0.02 0.00 0.00 56.10 56.98 1zvn s TRP 2 Cb 0.23 -3.85 -0.02 0.00 -1.15 0.00 0.00 33.47 28.68 1zvn s TRP 2 CO 0.30 -3.27 0.47 0.08 0.02 0.00 0.00 176.95 174.56 1zvn s VAL 3 N 2.01 5.07 0.00 4.03 1.01 -1.26 -4.91 120.40 126.35 1zvn s VAL 3 Ca 0.70 0.52 0.00 0.00 0.00 0.00 0.00 61.98 63.20 1zvn s VAL 3 Cb -0.39 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.14 1zvn s VAL 3 CO 0.31 -0.04 0.00 0.79 0.00 0.00 0.00 175.10 176.15 1zvn n TRP 4 N 5.57 0.00 -1.16 5.22 7.02 -1.26 -4.86 117.44 127.97 1zvn n TRP 4 Ca -0.06 0.00 -0.28 0.00 -1.02 0.00 0.00 57.50 56.15 1zvn n TRP 4 Cb 0.50 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 29.30 1zvn n TRP 4 CO 0.00 0.00 0.00 0.27 -2.02 0.00 0.00 177.69 175.94 1zvn n ASN 5 N -1.13 7.22 -3.83 -0.99 6.94 -1.26 -4.77 115.26 117.44 1zvn n ASN 5 Ca 0.00 -2.52 -0.12 0.00 -0.02 0.00 0.00 54.58 51.92 1zvn n ASN 5 Cb 0.00 -1.48 -0.12 0.00 -2.36 0.00 0.00 39.78 35.83 1zvn n ASN 5 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1zvn s GLN 6 N 1.77 0.27 0.19 -3.83 -2.07 -1.26 -1.12 119.66 113.62 1zvn s GLN 6 Ca 0.67 0.09 0.10 0.00 -1.82 0.00 0.00 55.36 54.40 1zvn s GLN 6 Cb 0.23 0.12 -0.04 0.00 -1.09 0.00 0.00 33.01 32.23 1zvn s GLN 6 CO -0.04 -0.05 -0.16 -0.06 -1.32 0.00 0.00 175.29 173.67 1zvn s PHE 7 N -0.26 2.47 -0.09 9.60 0.40 0.54 -4.96 117.98 125.68 1zvn s PHE 7 Ca -0.03 -0.29 0.02 0.00 -0.60 0.00 0.00 56.93 56.03 1zvn s PHE 7 Cb -0.03 -1.21 0.01 0.00 0.51 0.00 0.00 43.02 42.31 1zvn s PHE 7 CO 0.01 0.52 -0.16 -0.06 0.70 0.00 0.00 175.22 176.22 1zvn s PHE 8 N -1.73 1.92 -0.25 0.36 0.40 -1.26 0.18 117.98 117.61 1zvn s PHE 8 Ca 0.23 -0.83 -0.00 0.00 -0.60 0.00 0.00 56.93 55.74 1zvn s PHE 8 Cb -0.08 -1.36 0.04 0.00 0.51 0.00 0.00 43.02 42.12 1zvn s PHE 8 CO 0.13 -0.40 -0.09 0.08 0.70 0.00 0.00 175.22 175.64 1zvn s VAL 9 N 0.78 2.59 -0.24 -0.44 1.01 0.76 -4.94 120.40 119.92 1zvn s VAL 9 Ca -0.11 -1.20 -0.29 0.00 0.00 0.00 0.00 61.98 60.38 1zvn s VAL 9 Cb -0.16 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.86 1zvn s VAL 9 CO 0.02 0.16 1.31 -0.76 0.00 0.00 0.00 175.10 175.83 1zvn s LEU 10 N 1.26 4.01 0.27 3.92 1.43 -1.26 -1.00 118.68 127.30 1zvn s LEU 10 Ca -0.02 1.45 -0.05 0.00 -1.03 0.00 0.00 54.13 54.48 1zvn s LEU 10 Cb -0.17 -3.54 0.53 0.00 0.03 0.00 0.00 46.19 43.04 1zvn s LEU 10 CO -0.06 -0.96 1.60 -0.08 0.23 0.00 0.00 176.35 177.09 1zvn h GLU 11 N 8.93 0.05 -1.01 1.70 4.81 -1.84 -0.55 114.58 126.68 1zvn h GLU 11 Ca -0.27 -0.00 0.25 0.00 -0.13 0.00 0.00 59.36 59.21 1zvn h GLU 11 Cb 1.10 -0.01 -0.13 0.00 0.63 0.00 0.00 28.75 30.35 1zvn h GLU 11 CO 1.00 0.04 0.60 1.49 -0.73 0.00 0.00 179.01 181.40 1zvn h GLU 12 N 0.05 0.55 -0.01 1.92 4.81 -1.88 -2.29 114.58 117.74 1zvn h GLU 12 Ca 0.48 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.68 1zvn h GLU 12 Cb 0.88 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.13 1zvn h GLU 12 CO -0.80 0.36 -0.33 0.66 -0.73 0.00 0.00 179.01 178.17 1zvn n TYR 13 N -4.89 0.00 -1.17 0.92 4.01 -0.21 -4.93 117.16 110.88 1zvn n TYR 13 Ca 0.27 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.70 1zvn n TYR 13 Cb 0.76 -0.14 0.10 0.00 -0.31 0.00 0.00 39.34 39.75 1zvn n TYR 13 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1zvn s THR 14 N -2.62 3.03 -3.23 -0.72 -4.23 -0.86 -4.86 115.64 102.15 1zvn s THR 14 Ca 0.21 0.35 0.00 0.00 -1.18 0.00 0.00 61.69 61.07 1zvn s THR 14 Cb 0.19 -2.74 0.00 0.00 1.34 0.00 0.00 72.50 71.29 1zvn s THR 14 CO 0.57 -0.43 0.00 0.61 -0.54 0.00 0.00 174.62 174.83 1zvn n GLY 15 N -0.83 -1.13 0.11 3.99 0.00 -1.20 -4.69 105.19 101.44 1zvn n GLY 15 Ca 0.10 -1.04 -0.01 0.00 0.00 0.00 0.00 46.02 45.07 1zvn n GLY 15 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1zvn h THR 16 N 0.00 1.09 -2.63 2.61 1.35 -1.86 -2.77 112.91 110.71 1zvn h THR 16 Ca 0.00 -2.59 -0.52 0.00 -0.55 0.00 0.00 66.41 62.75 1zvn h THR 16 Cb 0.00 2.52 0.05 0.00 -1.73 0.00 0.00 68.15 68.98 1zvn h THR 16 CO 0.00 0.62 1.04 -1.81 -0.25 0.00 0.00 175.52 175.12 1zvn s ASP 17 N -6.46 6.44 0.02 5.36 1.11 -1.26 -4.81 116.67 117.07 1zvn s ASP 17 Ca 0.02 2.76 -0.34 0.00 0.18 0.00 0.00 52.55 55.18 1zvn s ASP 17 Cb 0.08 -2.58 -0.12 0.00 1.07 0.00 0.00 42.92 41.37 1zvn s ASP 17 CO 0.78 -0.96 1.77 -2.65 1.18 0.00 0.00 175.17 175.29 1zvn n PRO 18 N 4.85 2.24 -3.60 8.23 -0.02 -1.26 -4.75 135.00 140.68 1zvn n PRO 18 Ca 0.16 0.81 -0.38 0.00 -2.02 0.00 0.00 63.50 62.08 1zvn n PRO 18 Cb 0.37 -2.64 -0.11 0.00 -0.02 0.00 0.00 33.50 31.10 1zvn n PRO 18 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1zvn s LEU 19 N 2.88 4.04 0.10 2.45 2.96 0.30 -4.91 118.68 126.49 1zvn s LEU 19 Ca 0.87 -0.14 -0.31 0.00 -0.22 0.00 0.00 54.13 54.32 1zvn s LEU 19 Cb -0.66 -2.09 -0.11 0.00 0.50 0.00 0.00 46.19 43.83 1zvn s LEU 19 CO 0.45 -0.09 1.86 0.00 -1.32 0.00 0.00 176.35 177.26 1zvn n TYR 20 N 5.05 2.58 -0.11 5.38 9.36 -1.26 -1.08 117.16 137.07 1zvn n TYR 20 Ca -0.14 -0.18 -0.20 0.00 3.32 0.00 0.00 57.90 60.70 1zvn n TYR 20 Cb 0.51 -2.74 -0.09 0.00 -0.63 0.00 0.00 39.34 36.39 1zvn n TYR 20 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1zvn n VAL 21 N 4.87 1.27 -1.22 2.97 0.31 0.41 -4.91 118.33 122.02 1zvn n VAL 21 Ca 0.19 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 1zvn n VAL 21 Cb 0.37 -1.52 0.00 0.00 -0.91 0.00 0.00 33.84 31.79 1zvn n VAL 21 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1zvn n GLY 22 N 2.04 -0.60 3.47 2.92 0.00 -1.20 -4.61 105.19 107.21 1zvn n GLY 22 Ca -0.42 -0.65 -0.11 0.00 0.00 0.00 0.00 46.02 44.84 1zvn n GLY 22 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1zvn s LYS 23 N -1.08 0.61 0.09 1.61 2.20 -1.26 -0.54 119.74 121.37 1zvn s LYS 23 Ca 0.00 0.91 -0.25 0.00 -0.36 0.00 0.00 55.97 56.27 1zvn s LYS 23 Cb 0.00 0.19 -0.06 0.00 -1.51 0.00 0.00 37.83 36.44 1zvn s LYS 23 CO 0.00 -0.12 0.77 -0.51 -0.36 0.00 0.00 175.35 175.13 1zvn s LEU 24 N 0.95 4.51 -0.20 5.43 1.43 0.31 -4.96 118.68 126.14 1zvn s LEU 24 Ca -0.05 1.52 -0.12 0.00 -1.03 0.00 0.00 54.13 54.45 1zvn s LEU 24 Cb -0.05 -3.25 0.06 0.00 0.03 0.00 0.00 46.19 42.98 1zvn s LEU 24 CO -0.08 0.09 0.49 -2.28 0.23 0.00 0.00 176.35 174.80 1zvn s HIS 25 N -0.48 -0.69 -0.10 0.29 2.46 -1.26 -4.42 115.29 111.09 1zvn s HIS 25 Ca 0.37 1.47 -0.03 0.00 0.47 0.00 0.00 55.06 57.35 1zvn s HIS 25 Cb -0.21 0.33 -0.03 0.00 -0.13 0.00 0.00 32.58 32.53 1zvn s HIS 25 CO 0.24 -0.37 0.02 0.45 -2.47 0.00 0.00 174.74 172.61 1zvn s SER 26 N 1.23 5.37 0.00 9.88 0.15 -1.26 -4.99 113.70 124.08 1zvn s SER 26 Ca -0.08 0.17 0.14 0.00 0.70 0.00 0.00 55.95 56.88 1zvn s SER 26 Cb -0.07 -1.58 0.67 0.00 -1.71 0.00 0.00 66.02 63.33 1zvn s SER 26 CO -0.12 0.37 1.37 -0.90 1.20 0.00 0.00 173.24 175.16 1zvn n ASP 27 N 2.23 0.00 -0.04 5.45 5.68 -1.26 -1.65 116.55 126.96 1zvn n ASP 27 Ca -0.19 0.17 0.14 0.00 -0.50 0.00 0.00 54.79 54.41 1zvn n ASP 27 Cb 0.54 -0.33 0.52 0.00 -1.14 0.00 0.00 41.12 40.71 1zvn n ASP 27 CO 0.00 0.00 0.00 0.23 -1.33 0.00 0.00 177.20 176.10 1zvn n MET 28 N -1.33 0.25 -2.27 0.11 2.81 -1.26 -4.84 117.12 110.59 1zvn n MET 28 Ca 0.06 -0.08 -0.43 0.00 -1.81 0.00 0.00 57.70 55.44 1zvn n MET 28 Cb 0.12 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.11 1zvn n MET 28 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1zvn s ASP 29 N -2.81 6.63 0.25 7.83 -1.08 -0.66 -4.91 116.67 121.93 1zvn s ASP 29 Ca 0.19 1.56 0.26 0.00 -0.52 0.00 0.00 52.55 54.04 1zvn s ASP 29 Cb 0.19 -2.54 0.73 0.00 -1.46 0.00 0.00 42.92 39.84 1zvn s ASP 29 CO 0.55 -1.06 1.75 0.08 0.52 0.00 0.00 175.17 177.02 1zvn h ARG 30 N 9.57 0.00 0.00 4.34 -0.00 -1.89 -3.48 114.38 122.93 1zvn h ARG 30 Ca -0.30 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.68 1zvn h ARG 30 Cb 1.13 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.10 1zvn h ARG 30 CO 1.00 0.00 0.00 0.41 -0.00 0.00 0.00 179.97 181.38 1zvn n GLY 31 N 1.25 0.62 0.97 0.08 0.00 -1.26 -4.98 105.19 101.87 1zvn n GLY 31 Ca 0.05 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.17 1zvn n GLY 31 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1zvn n ASP 32 N 0.00 3.14 -0.14 1.61 5.75 -1.26 -4.95 116.55 120.71 1zvn n ASP 32 Ca 0.00 -1.91 -0.02 0.00 -0.01 0.00 0.00 54.79 52.85 1zvn n ASP 32 Cb 0.00 -0.19 -0.01 0.00 -1.03 0.00 0.00 41.12 39.89 1zvn n ASP 32 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1zvn n GLY 33 N 1.23 0.53 0.06 6.12 0.00 -1.26 -4.91 105.19 106.97 1zvn n GLY 33 Ca 0.16 -0.70 0.15 0.00 0.00 0.00 0.00 46.02 45.63 1zvn n GLY 33 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1zvn n SER 34 N 1.12 0.23 -4.77 1.61 3.41 -1.26 -4.75 113.62 109.20 1zvn n SER 34 Ca -0.02 -0.60 -0.35 0.00 -0.26 0.00 0.00 58.87 57.64 1zvn n SER 34 Cb 0.08 -0.12 -0.08 0.00 -0.26 0.00 0.00 64.21 63.83 1zvn n SER 34 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1zvn s ILE 35 N -2.34 4.79 -0.23 -1.33 -1.09 -1.26 0.30 121.20 120.03 1zvn s ILE 35 Ca 0.35 -0.13 0.01 0.00 -2.23 0.00 0.00 60.65 58.65 1zvn s ILE 35 Cb 0.21 -3.07 0.04 0.00 -1.58 0.00 0.00 42.46 38.05 1zvn s ILE 35 CO 0.43 0.56 -0.13 -0.75 -1.23 0.00 0.00 174.94 173.82 1zvn s LYS 36 N -1.10 2.61 -0.11 2.79 2.20 0.42 -4.63 119.74 121.92 1zvn s LYS 36 Ca 0.16 -1.10 -0.21 0.00 -0.36 0.00 0.00 55.97 54.46 1zvn s LYS 36 Cb -0.12 -2.80 -0.04 0.00 -1.51 0.00 0.00 37.83 33.36 1zvn s LYS 36 CO 0.05 -0.42 0.59 0.71 -0.36 0.00 0.00 175.35 175.92 1zvn s TYR 37 N 1.21 3.52 -0.03 4.03 1.51 0.17 -0.56 117.35 127.20 1zvn s TYR 37 Ca -0.02 1.04 0.07 0.00 -1.01 0.00 0.00 57.07 57.15 1zvn s TYR 37 Cb -0.17 -2.68 -0.02 0.00 -0.11 0.00 0.00 41.96 38.98 1zvn s TYR 37 CO -0.08 0.10 -0.23 0.42 -1.11 0.00 0.00 175.55 174.65 1zvn s ILE 38 N 0.83 1.83 -0.07 2.71 1.01 -0.30 -4.36 121.20 122.85 1zvn s ILE 38 Ca 0.31 -0.98 0.05 0.00 0.00 0.00 0.00 60.65 60.04 1zvn s ILE 38 Cb -0.16 -1.53 -0.01 0.00 0.01 0.00 0.00 42.46 40.77 1zvn s ILE 38 CO 0.14 0.52 -0.25 -0.22 0.00 0.00 0.00 174.94 175.13 1zvn s LEU 39 N -0.44 2.07 0.18 2.97 2.96 -1.26 -0.82 118.68 124.33 1zvn s LEU 39 Ca 0.06 -0.52 -0.03 0.00 -0.22 0.00 0.00 54.13 53.42 1zvn s LEU 39 Cb -0.10 -1.37 -0.03 0.00 0.50 0.00 0.00 46.19 45.19 1zvn s LEU 39 CO 0.00 0.22 0.15 -0.94 -1.32 0.00 0.00 176.35 174.46 1zvn s SER 40 N -0.02 0.18 0.00 3.68 1.04 -0.53 -4.91 113.70 113.14 1zvn s SER 40 Ca -0.08 -1.24 0.00 0.00 0.48 0.00 0.00 55.95 55.12 1zvn s SER 40 Cb -0.15 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.34 1zvn s SER 40 CO 0.05 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 174.05 1zvn n GLY 41 N -0.21 -0.34 3.64 7.32 0.00 -1.26 0.25 105.19 114.58 1zvn n GLY 41 Ca -0.02 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 1zvn n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1zvn s GLU 42 N 0.00 3.72 0.00 1.61 2.02 -0.74 -1.30 118.70 124.02 1zvn s GLU 42 Ca 0.00 2.38 0.00 0.00 0.02 0.00 0.00 54.97 57.37 1zvn s GLU 42 Cb 0.00 -4.25 0.00 0.00 0.10 0.00 0.00 34.13 29.98 1zvn s GLU 42 CO 0.00 -1.43 0.00 0.41 0.02 0.00 0.00 175.26 174.26 1zvn n GLY 43 N 5.05 0.67 3.75 -1.39 0.00 -1.26 -4.61 105.19 107.39 1zvn n GLY 43 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 1zvn n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zvn s ALA 44 N -2.83 3.72 0.00 4.61 0.00 -0.42 0.11 121.76 126.95 1zvn s ALA 44 Ca 0.00 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.44 1zvn s ALA 44 Cb 0.00 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1zvn s ALA 44 CO 0.00 -0.89 0.00 0.41 0.00 0.00 0.00 175.76 175.28 1zvn n GLY 45 N 2.30 2.45 0.13 0.00 0.00 0.12 -4.61 105.19 105.59 1zvn n GLY 45 Ca 0.08 -0.05 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 1zvn n GLY 45 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1zvn n ILE 46 N 0.00 1.18 -0.09 -0.61 5.41 -1.09 -4.79 119.36 119.37 1zvn n ILE 46 Ca 0.00 -0.43 -0.14 0.00 1.00 0.00 0.00 62.75 63.18 1zvn n ILE 46 Cb 0.00 -1.30 -0.08 0.00 -0.71 0.00 0.00 39.64 37.55 1zvn n ILE 46 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1zvn n VAL 47 N -3.21 1.02 -5.25 1.39 0.31 0.12 -4.64 118.33 108.07 1zvn n VAL 47 Ca -0.37 -0.36 -0.31 0.00 -0.01 0.00 0.00 64.34 63.29 1zvn n VAL 47 Cb 0.87 -1.29 -0.16 0.00 -0.91 0.00 0.00 33.84 32.35 1zvn n VAL 47 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1zvn s PHE 48 N -2.35 2.41 0.33 3.52 0.40 -0.40 -0.22 117.98 121.66 1zvn s PHE 48 Ca -0.25 -0.72 0.08 0.00 -0.60 0.00 0.00 56.93 55.44 1zvn s PHE 48 Cb 0.07 -1.58 -0.06 0.00 0.51 0.00 0.00 43.02 41.96 1zvn s PHE 48 CO 0.39 -0.22 -0.06 0.95 0.70 0.00 0.00 175.22 176.98 1zvn s THR 49 N -0.15 1.94 0.02 0.64 -4.23 0.15 0.15 115.64 114.16 1zvn s THR 49 Ca -0.04 -2.14 0.04 0.00 -1.18 0.00 0.00 61.69 58.37 1zvn s THR 49 Cb -0.14 -2.64 -0.02 0.00 1.34 0.00 0.00 72.50 71.04 1zvn s THR 49 CO 0.04 -0.19 -0.11 -0.51 -0.54 0.00 0.00 174.62 173.31 1zvn s ILE 50 N -2.80 0.84 -0.18 2.99 2.07 -1.26 -1.57 121.20 121.29 1zvn s ILE 50 Ca 0.32 -0.74 -0.21 0.00 -1.41 0.00 0.00 60.65 58.60 1zvn s ILE 50 Cb 0.04 -0.76 -0.03 0.00 0.13 0.00 0.00 42.46 41.85 1zvn s ILE 50 CO 0.15 0.02 0.65 -0.62 -1.91 0.00 0.00 174.94 173.24 1zvn s ASP 51 N -0.81 6.75 0.08 4.50 -1.08 -0.52 -4.97 116.67 120.62 1zvn s ASP 51 Ca 0.01 0.91 0.27 0.00 -0.52 0.00 0.00 52.55 53.21 1zvn s ASP 51 Cb -0.06 -2.36 1.04 0.00 -1.46 0.00 0.00 42.92 40.07 1zvn s ASP 51 CO 0.00 -0.26 1.84 -0.90 0.52 0.00 0.00 175.17 176.37 1zvn n ASP 52 N 4.90 0.32 -0.10 -0.34 3.85 -1.26 0.34 116.55 124.26 1zvn n ASP 52 Ca -0.01 0.53 -0.19 0.00 -0.71 0.00 0.00 54.79 54.42 1zvn n ASP 52 Cb 0.50 -0.62 -0.08 0.00 -1.35 0.00 0.00 41.12 39.57 1zvn n ASP 52 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.20 176.60 1zvn n THR 53 N -1.80 1.50 0.10 2.12 -1.04 -1.26 -0.66 114.28 113.24 1zvn n THR 53 Ca 0.06 -0.03 -0.02 0.00 -2.04 0.00 0.00 64.05 62.02 1zvn n THR 53 Cb 0.36 -2.11 -0.05 0.00 -1.82 0.00 0.00 70.33 66.71 1zvn n THR 53 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 1zvn h THR 54 N -1.00 1.22 0.00 12.58 1.35 -1.92 -3.46 112.91 121.69 1zvn h THR 54 Ca -0.32 -2.75 0.00 0.00 -0.55 0.00 0.00 66.41 62.79 1zvn h THR 54 Cb 1.17 2.60 0.00 0.00 -1.73 0.00 0.00 68.15 70.18 1zvn h THR 54 CO -0.19 0.70 0.00 0.61 -0.25 0.00 0.00 175.52 176.38 1zvn n GLY 55 N 1.29 1.19 3.74 5.82 0.00 0.15 -4.76 105.19 112.63 1zvn n GLY 55 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1zvn n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1zvn s ASP 56 N -3.11 6.41 -0.10 1.61 1.01 -1.24 -0.53 116.67 120.71 1zvn s ASP 56 Ca 0.00 2.88 0.01 0.00 0.71 0.00 0.00 52.55 56.15 1zvn s ASP 56 Cb 0.00 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.29 1zvn s ASP 56 CO 0.00 -0.92 -0.12 -0.63 0.21 0.00 0.00 175.17 173.71 1zvn s ILE 57 N 0.49 3.19 0.05 0.77 1.01 0.30 -1.44 121.20 125.58 1zvn s ILE 57 Ca 0.68 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.75 1zvn s ILE 57 Cb -0.48 -2.31 -0.03 0.00 0.01 0.00 0.00 42.46 39.66 1zvn s ILE 57 CO 0.41 0.55 -0.17 -1.00 0.00 0.00 0.00 174.94 174.73 1zvn s HIS 58 N -0.17 1.51 -0.13 3.97 3.76 -0.61 -0.45 115.29 123.17 1zvn s HIS 58 Ca 0.00 -0.38 -0.10 0.00 -0.15 0.00 0.00 55.06 54.43 1zvn s HIS 58 Cb -0.13 -0.88 -0.05 0.00 1.11 0.00 0.00 32.58 32.63 1zvn s HIS 58 CO 0.03 0.08 0.20 0.00 -0.85 0.00 0.00 174.74 174.20 1zvn s ALA 59 N -0.92 3.76 -0.01 -1.40 0.00 -0.24 -0.67 121.76 122.27 1zvn s ALA 59 Ca 0.04 -0.57 0.02 0.00 0.00 0.00 0.00 51.96 51.45 1zvn s ALA 59 Cb -0.09 -2.15 0.03 0.00 0.00 0.00 0.00 23.12 20.91 1zvn s ALA 59 CO 0.02 0.39 0.88 0.44 0.00 0.00 0.00 175.76 177.49 1zvn n ILE 60 N 2.64 0.78 -4.29 0.00 -5.35 0.69 -0.54 119.36 113.29 1zvn n ILE 60 Ca -0.17 -0.81 -0.18 0.00 -0.27 0.00 0.00 62.75 61.32 1zvn n ILE 60 Cb 0.53 0.56 -0.11 0.00 -1.74 0.00 0.00 39.64 38.89 1zvn n ILE 60 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1zvn s GLN 61 N -0.87 1.15 -0.07 6.28 -0.21 -1.05 -4.30 119.66 120.60 1zvn s GLN 61 Ca 0.03 -1.39 -0.30 0.00 0.02 0.00 0.00 55.36 53.72 1zvn s GLN 61 Cb 0.03 -1.00 -0.03 0.00 1.00 0.00 0.00 33.01 33.01 1zvn s GLN 61 CO 0.00 0.18 1.14 0.50 -2.12 0.00 0.00 175.29 174.99 1zvn s ARG 62 N -3.09 4.38 0.20 2.91 3.52 -1.23 -3.21 118.95 122.42 1zvn s ARG 62 Ca 0.15 1.58 0.10 0.00 -0.13 0.00 0.00 55.73 57.43 1zvn s ARG 62 Cb -0.03 -3.55 -0.04 0.00 -1.56 0.00 0.00 34.95 29.77 1zvn s ARG 62 CO 0.04 -0.40 -0.12 -0.51 -0.81 0.00 0.00 175.30 173.50 1zvn s LEU 63 N 2.13 2.86 -0.07 -0.88 1.43 -1.26 -4.88 118.68 118.00 1zvn s LEU 63 Ca 0.53 -0.68 -0.00 0.00 -1.03 0.00 0.00 54.13 52.96 1zvn s LEU 63 Cb -0.23 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.49 1zvn s LEU 63 CO 0.21 0.09 -0.04 -0.62 0.23 0.00 0.00 176.35 176.22 1zvn s ASP 64 N -2.93 1.57 0.20 2.29 2.15 -1.26 -4.82 116.67 113.87 1zvn s ASP 64 Ca 0.25 -0.18 -0.11 0.00 0.43 0.00 0.00 52.55 52.94 1zvn s ASP 64 Cb -0.08 -0.59 0.17 0.00 -0.30 0.00 0.00 42.92 42.13 1zvn s ASP 64 CO 0.15 -0.11 1.82 -0.09 -0.17 0.00 0.00 175.17 176.77 1zvn h ARG 65 N 7.80 0.70 -0.00 4.34 2.43 -1.88 -2.36 114.38 125.42 1zvn h ARG 65 Ca -0.29 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 58.81 1zvn h ARG 65 Cb 1.14 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1zvn h ARG 65 CO 0.38 0.46 -0.15 0.93 -1.51 0.00 0.00 179.97 180.09 1zvn h GLU 66 N 0.72 0.00 -0.37 0.20 5.08 -1.96 -0.17 114.58 118.08 1zvn h GLU 66 Ca 0.26 -0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.47 1zvn h GLU 66 Cb 0.07 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1zvn h GLU 66 CO -0.13 0.15 -0.35 1.05 -1.00 0.00 0.00 179.01 178.74 1zvn h GLU 67 N 0.00 0.90 -1.38 2.33 4.11 -1.88 -3.46 114.58 115.20 1zvn h GLU 67 Ca -0.00 -0.47 0.14 0.00 0.07 0.00 0.00 59.36 59.10 1zvn h GLU 67 Cb 0.27 0.01 -0.22 0.00 0.50 0.00 0.00 28.75 29.31 1zvn h GLU 67 CO 0.02 1.12 0.08 0.50 0.07 0.00 0.00 179.01 180.80 1zvn s ARG 68 N -4.41 0.40 0.17 1.06 3.52 -0.11 -5.04 118.95 114.54 1zvn s ARG 68 Ca -0.11 1.01 0.24 0.00 -0.13 0.00 0.00 55.73 56.74 1zvn s ARG 68 Cb 0.11 0.61 0.26 0.00 -1.56 0.00 0.00 34.95 34.36 1zvn s ARG 68 CO 0.87 -0.15 1.27 0.66 -0.81 0.00 0.00 175.30 177.15 1zvn h SER 69 N 7.70 0.00 -4.70 -2.12 4.64 -1.74 -3.39 113.55 113.94 1zvn h SER 69 Ca -0.17 -0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 60.99 1zvn h SER 69 Cb 1.11 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.00 1zvn h SER 69 CO 0.09 0.07 0.25 0.00 -0.87 0.00 0.00 176.83 176.36 1zvn s GLN 70 N -3.22 0.95 -0.08 4.77 -2.07 -1.26 -0.11 119.66 118.62 1zvn s GLN 70 Ca 0.04 0.34 0.04 0.00 -1.82 0.00 0.00 55.36 53.96 1zvn s GLN 70 Cb 0.12 0.45 -0.00 0.00 -1.09 0.00 0.00 33.01 32.48 1zvn s GLN 70 CO 0.73 -0.27 -0.23 0.71 -1.32 0.00 0.00 175.29 174.91 1zvn s TYR 71 N -0.96 2.39 -0.32 9.60 1.51 -0.01 -4.98 117.35 124.57 1zvn s TYR 71 Ca -0.08 -0.90 -0.14 0.00 -1.01 0.00 0.00 57.07 54.94 1zvn s TYR 71 Cb -0.01 -1.60 -0.02 0.00 -0.11 0.00 0.00 41.96 40.22 1zvn s TYR 71 CO 0.07 -0.35 0.31 0.99 -1.11 0.00 0.00 175.55 175.46 1zvn s THR 72 N 0.25 5.22 0.45 -0.71 2.01 -1.26 -0.91 115.64 120.69 1zvn s THR 72 Ca -0.15 0.07 0.05 0.00 0.31 0.00 0.00 61.69 61.97 1zvn s THR 72 Cb -0.17 -3.74 -0.05 0.00 0.01 0.00 0.00 72.50 68.56 1zvn s THR 72 CO 0.07 0.01 0.03 -0.76 -0.69 0.00 0.00 174.62 173.28 1zvn s LEU 73 N 1.92 2.66 -0.02 4.42 1.02 0.24 -1.79 118.68 127.12 1zvn s LEU 73 Ca 0.10 -1.46 0.03 0.00 0.02 0.00 0.00 54.13 52.82 1zvn s LEU 73 Cb -0.17 -0.88 -0.00 0.00 0.02 0.00 0.00 46.19 45.17 1zvn s LEU 73 CO 0.11 -0.63 -0.12 -0.13 0.02 0.00 0.00 176.35 175.60 1zvn s ARG 74 N -3.80 1.13 -0.10 1.70 0.52 0.14 -1.68 118.95 116.86 1zvn s ARG 74 Ca 0.24 -0.43 -0.02 0.00 -0.52 0.00 0.00 55.73 55.00 1zvn s ARG 74 Cb 0.06 -1.05 -0.03 0.00 0.52 0.00 0.00 34.95 34.44 1zvn s ARG 74 CO 0.12 0.21 -0.02 0.00 0.02 0.00 0.00 175.30 175.63 1zvn s ALA 75 N -0.06 3.15 0.04 2.13 0.00 0.11 -1.46 121.76 125.67 1zvn s ALA 75 Ca 0.01 -0.83 0.05 0.00 0.00 0.00 0.00 51.96 51.19 1zvn s ALA 75 Cb -0.07 -1.45 -0.02 0.00 0.00 0.00 0.00 23.12 21.57 1zvn s ALA 75 CO 0.00 0.48 -0.15 -0.65 0.00 0.00 0.00 175.76 175.45 1zvn s GLN 76 N -0.53 0.99 -0.26 0.00 -0.21 -0.00 -1.71 119.66 117.93 1zvn s GLN 76 Ca 0.09 -0.79 0.00 0.00 0.02 0.00 0.00 55.36 54.69 1zvn s GLN 76 Cb -0.12 -1.01 0.07 0.00 1.00 0.00 0.00 33.01 32.95 1zvn s GLN 76 CO 0.02 0.25 0.00 0.00 -2.12 0.00 0.00 175.29 173.44 1zvn s ALA 77 N -0.85 1.90 0.03 6.09 0.00 -1.26 -1.15 121.76 126.51 1zvn s ALA 77 Ca 0.02 -1.52 -0.00 0.00 0.00 0.00 0.00 51.96 50.46 1zvn s ALA 77 Cb -0.08 -1.52 -0.04 0.00 0.00 0.00 0.00 23.12 21.48 1zvn s ALA 77 CO 0.01 -1.36 0.16 -0.51 0.00 0.00 0.00 175.76 174.06 1zvn s LEU 78 N 1.42 4.18 -0.04 0.00 1.43 0.27 -0.83 118.68 125.13 1zvn s LEU 78 Ca 0.00 0.22 -0.30 0.00 -1.03 0.00 0.00 54.13 53.03 1zvn s LEU 78 Cb -0.18 -2.65 -0.06 0.00 0.03 0.00 0.00 46.19 43.32 1zvn s LEU 78 CO -0.11 0.22 1.74 -0.62 0.23 0.00 0.00 176.35 177.81 1zvn s ASP 79 N -2.18 6.59 0.42 2.29 2.15 0.59 -0.44 116.67 126.09 1zvn s ASP 79 Ca 0.30 2.33 0.16 0.00 0.43 0.00 0.00 52.55 55.77 1zvn s ASP 79 Cb -0.13 -2.53 1.06 0.00 -0.30 0.00 0.00 42.92 41.02 1zvn s ASP 79 CO 0.22 -0.98 1.89 -0.09 -0.17 0.00 0.00 175.17 176.04 1zvn h ARG 80 N 9.89 0.41 0.22 4.34 9.65 -0.46 0.29 114.38 138.72 1zvn h ARG 80 Ca -0.42 -0.02 -0.30 0.00 -1.10 0.00 0.00 59.98 58.14 1zvn h ARG 80 Cb 1.19 -0.09 0.03 0.00 -1.39 0.00 0.00 29.97 29.71 1zvn h ARG 80 CO 0.95 0.27 -1.32 0.00 2.80 0.00 0.00 179.97 182.67 1zvn h ARG 81 N 0.42 0.46 0.00 0.20 2.47 -1.90 -3.38 114.38 112.64 1zvn h ARG 81 Ca 0.42 -0.78 -0.01 0.00 -1.26 0.00 0.00 59.98 58.35 1zvn h ARG 81 Cb 1.00 0.29 -0.00 0.00 -1.65 0.00 0.00 29.97 29.61 1zvn h ARG 81 CO -0.15 1.37 -1.85 0.25 0.56 0.00 0.00 179.97 180.15 1zvn n THR 82 N -3.83 0.03 -0.97 2.04 -2.24 -1.18 -4.98 114.28 103.16 1zvn n THR 82 Ca -0.17 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 1zvn n THR 82 Cb 1.02 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.31 1zvn n THR 82 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1zvn n GLY 83 N 1.47 0.62 3.76 3.38 0.00 0.10 -5.01 105.19 109.51 1zvn n GLY 83 Ca -0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1zvn n GLY 83 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1zvn s ARG 84 N -0.21 4.77 0.45 1.61 0.52 -1.25 -4.67 118.95 120.17 1zvn s ARG 84 Ca 0.00 1.48 -0.24 0.00 -0.52 0.00 0.00 55.73 56.44 1zvn s ARG 84 Cb 0.00 -3.15 -0.07 0.00 0.52 0.00 0.00 34.95 32.24 1zvn s ARG 84 CO 0.00 0.43 1.28 -2.14 0.02 0.00 0.00 175.30 174.90 1zvn s PRO 85 N -1.42 3.71 -0.01 3.54 0.02 -1.26 -0.30 135.00 139.28 1zvn s PRO 85 Ca 0.44 2.08 0.10 0.00 0.02 0.00 0.00 61.00 63.64 1zvn s PRO 85 Cb -0.25 -2.54 -0.13 0.00 0.02 0.00 0.00 34.50 31.60 1zvn s PRO 85 CO 0.31 -0.68 0.34 -1.33 -0.33 0.00 0.00 177.00 175.31 1zvn n MET 86 N -0.31 2.32 -4.03 5.54 2.81 -0.01 -4.77 117.12 118.67 1zvn n MET 86 Ca 0.06 -0.04 -0.10 0.00 -1.81 0.00 0.00 57.70 55.81 1zvn n MET 86 Cb 0.45 -1.08 -0.11 0.00 -0.71 0.00 0.00 33.22 31.77 1zvn n MET 86 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1zvn s GLU 87 N -2.26 0.44 0.53 0.03 0.41 -1.24 -5.05 118.70 111.58 1zvn s GLU 87 Ca 0.01 -0.77 -0.21 0.00 -0.41 0.00 0.00 54.97 53.59 1zvn s GLU 87 Cb 0.07 -0.03 -0.05 0.00 -1.78 0.00 0.00 34.13 32.34 1zvn s GLU 87 CO 0.42 -0.02 1.29 -1.25 -0.49 0.00 0.00 175.26 175.20 1zvn s PRO 88 N -1.90 3.25 0.21 0.39 0.04 -1.26 -4.62 135.00 131.11 1zvn s PRO 88 Ca -0.10 2.06 -0.30 0.00 0.04 0.00 0.00 61.00 62.70 1zvn s PRO 88 Cb -0.07 -2.24 -0.10 0.00 0.04 0.00 0.00 34.50 32.14 1zvn s PRO 88 CO -0.02 -1.05 1.44 -2.00 0.04 0.00 0.00 177.00 175.41 1zvn s GLU 89 N -2.93 4.28 -0.02 4.56 2.12 -1.26 -4.85 118.70 120.60 1zvn s GLU 89 Ca 0.71 2.26 0.03 0.00 0.36 0.00 0.00 54.97 58.33 1zvn s GLU 89 Cb -0.36 -3.14 -0.00 0.00 0.26 0.00 0.00 34.13 30.88 1zvn s GLU 89 CO 0.42 -0.44 -0.11 -1.12 -0.54 0.00 0.00 175.26 173.48 1zvn s SER 90 N 0.59 1.31 0.36 -1.70 0.01 -0.69 -4.93 113.70 108.65 1zvn s SER 90 Ca 0.62 -0.20 -0.25 0.00 1.31 0.00 0.00 55.95 57.42 1zvn s SER 90 Cb -0.41 -0.24 -0.09 0.00 0.21 0.00 0.00 66.02 65.49 1zvn s SER 90 CO 0.39 0.11 1.01 -0.70 0.41 0.00 0.00 173.24 174.46 1zvn s GLU 91 N -0.06 4.38 0.11 12.44 2.12 -1.26 0.05 118.70 136.47 1zvn s GLU 91 Ca 0.01 1.46 -0.08 0.00 0.36 0.00 0.00 54.97 56.72 1zvn s GLU 91 Cb -0.06 -2.70 -0.01 0.00 0.26 0.00 0.00 34.13 31.62 1zvn s GLU 91 CO 0.00 0.06 0.20 -0.59 -0.54 0.00 0.00 175.26 174.39 1zvn s PHE 92 N -1.60 0.28 0.07 5.30 -0.12 -0.67 -4.92 117.98 116.31 1zvn s PHE 92 Ca 0.54 -0.70 0.08 0.00 -0.05 0.00 0.00 56.93 56.80 1zvn s PHE 92 Cb -0.21 -0.10 -0.03 0.00 -0.63 0.00 0.00 43.02 42.05 1zvn s PHE 92 CO 0.27 -0.59 -0.21 0.42 -0.05 0.00 0.00 175.22 175.06 1zvn s ILE 93 N -3.91 2.58 -0.22 -4.49 -1.09 -0.27 -0.59 121.20 113.22 1zvn s ILE 93 Ca 0.10 -1.36 0.00 0.00 -2.23 0.00 0.00 60.65 57.16 1zvn s ILE 93 Cb 0.05 -2.09 0.03 0.00 -1.58 0.00 0.00 42.46 38.86 1zvn s ILE 93 CO -0.07 0.27 -0.14 -0.63 -1.23 0.00 0.00 174.94 173.15 1zvn s ILE 94 N -0.95 2.36 -0.14 2.92 1.01 -0.09 -0.34 121.20 125.98 1zvn s ILE 94 Ca 0.14 -1.08 -0.06 0.00 0.00 0.00 0.00 60.65 59.65 1zvn s ILE 94 Cb -0.10 -2.14 -0.04 0.00 0.01 0.00 0.00 42.46 40.19 1zvn s ILE 94 CO 0.05 0.33 0.08 -0.54 0.00 0.00 0.00 174.94 174.86 1zvn s LYS 95 N 1.27 3.56 -0.12 2.79 1.02 0.13 -0.83 119.74 127.55 1zvn s LYS 95 Ca 0.01 -0.27 -0.17 0.00 0.02 0.00 0.00 55.97 55.56 1zvn s LYS 95 Cb -0.15 -3.12 -0.04 0.00 -0.52 0.00 0.00 37.83 34.00 1zvn s LYS 95 CO -0.09 0.56 0.43 0.42 -0.92 0.00 0.00 175.35 175.76 1zvn s ILE 96 N -0.44 5.21 0.43 2.17 -1.09 0.84 -0.17 121.20 128.15 1zvn s ILE 96 Ca 0.10 0.85 0.07 0.00 -2.23 0.00 0.00 60.65 59.44 1zvn s ILE 96 Cb -0.12 -3.77 -0.04 0.00 -1.58 0.00 0.00 42.46 36.95 1zvn s ILE 96 CO 0.02 0.36 0.17 -1.58 -1.23 0.00 0.00 174.94 172.68 1zvn s GLN 97 N 0.48 2.21 0.00 2.79 2.00 -0.17 -4.85 119.66 122.11 1zvn s GLN 97 Ca 0.24 -1.92 0.00 0.00 -2.00 0.00 0.00 55.36 51.67 1zvn s GLN 97 Cb -0.15 -1.93 0.00 0.00 0.80 0.00 0.00 33.01 31.73 1zvn s GLN 97 CO 0.09 -0.18 0.00 -3.47 -0.50 0.00 0.00 175.29 171.23