#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iz4 s TYR 3 N -3.19 -0.16 0.06 0.00 1.13 0.12 -5.00 117.35 110.31 2iz4 s TYR 3 Ca 0.65 0.44 0.02 0.00 -1.41 0.00 0.00 57.07 56.77 2iz4 s TYR 3 Cb -0.06 -0.02 -0.04 0.00 -1.10 0.00 0.00 41.96 40.74 2iz4 s TYR 3 CO 0.45 -0.13 0.11 -0.06 -2.51 0.00 0.00 175.55 173.41 2iz4 s PHE 4 N 0.70 3.29 -0.07 -3.49 0.40 -1.26 -1.11 117.98 116.44 2iz4 s PHE 4 Ca -0.05 0.14 0.05 0.00 -0.60 0.00 0.00 56.93 56.47 2iz4 s PHE 4 Cb -0.07 -1.68 -0.01 0.00 0.51 0.00 0.00 43.02 41.77 2iz4 s PHE 4 CO -0.03 0.55 -0.24 0.42 0.70 0.00 0.00 175.22 176.62 2iz4 s ILE 5 N -1.39 2.17 -0.35 0.64 1.09 -0.45 -4.97 121.20 117.94 2iz4 s ILE 5 Ca 0.30 -1.02 -0.29 0.00 -1.10 0.00 0.00 60.65 58.54 2iz4 s ILE 5 Cb -0.12 -1.80 0.00 0.00 -1.06 0.00 0.00 42.46 39.47 2iz4 s ILE 5 CO 0.22 0.57 1.46 -2.16 -0.10 0.00 0.00 174.94 174.92 2iz4 s PRO 6 N -0.08 3.65 -0.31 2.79 0.04 -1.26 -0.95 135.00 138.88 2iz4 s PRO 6 Ca -0.06 1.15 -0.40 0.00 0.04 0.00 0.00 61.00 61.74 2iz4 s PRO 6 Cb -0.14 -4.01 -0.15 0.00 0.04 0.00 0.00 34.50 30.23 2iz4 s PRO 6 CO 0.04 -1.46 1.84 -1.71 0.04 0.00 0.00 177.00 175.75 2iz4 n ASN 7 N 8.66 2.25 -0.05 6.66 5.15 -0.73 -4.79 115.26 132.41 2iz4 n ASN 7 Ca 0.17 0.95 0.14 0.00 -0.60 0.00 0.00 54.58 55.24 2iz4 n ASN 7 Cb 0.47 -1.14 0.66 0.00 -0.53 0.00 0.00 39.78 39.24 2iz4 n ASN 7 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2iz4 n GLN 8 N 5.97 0.49 -2.34 1.20 3.00 -1.12 -4.84 117.38 119.74 2iz4 n GLN 8 Ca 0.31 -0.10 -0.25 0.00 -0.01 0.00 0.00 57.00 56.94 2iz4 n GLN 8 Cb 0.13 -1.50 0.05 0.00 0.00 0.00 0.00 30.24 28.93 2iz4 n GLN 8 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2iz4 s SER 9 N -2.58 5.08 -0.09 1.08 1.04 -1.26 -4.92 113.70 112.06 2iz4 s SER 9 Ca 0.27 0.42 0.13 0.00 0.48 0.00 0.00 55.95 57.25 2iz4 s SER 9 Cb 0.20 -1.20 0.23 0.00 0.10 0.00 0.00 66.02 65.36 2iz4 s SER 9 CO 0.48 -1.38 1.14 0.18 0.98 0.00 0.00 173.24 174.64 2iz4 n LEU 10 N -2.73 2.44 -4.70 2.42 4.77 -1.26 -4.91 117.00 113.04 2iz4 n LEU 10 Ca 0.07 -2.72 -0.36 0.00 -0.03 0.00 0.00 56.01 52.97 2iz4 n LEU 10 Cb 0.60 -0.31 -0.08 0.00 -2.33 0.00 0.00 43.42 41.29 2iz4 n LEU 10 CO 0.51 0.65 -0.12 -0.54 -1.33 0.00 0.00 177.39 176.56 2iz4 s LYS 11 N -2.25 4.16 0.00 3.23 1.02 -1.26 -4.98 119.74 119.65 2iz4 s LYS 11 Ca 0.24 -0.14 0.24 0.00 0.02 0.00 0.00 55.97 56.33 2iz4 s LYS 11 Cb 0.20 -3.48 1.07 0.00 -0.52 0.00 0.00 37.83 35.10 2iz4 s LYS 11 CO 0.03 0.17 1.78 -0.35 -0.92 0.00 0.00 175.35 176.06 2iz4 n PRO 12 N 3.91 0.07 -0.04 -1.68 -0.04 -1.26 -3.01 135.00 132.95 2iz4 n PRO 12 Ca -0.14 0.08 0.05 0.00 -0.04 0.00 0.00 63.50 63.45 2iz4 n PRO 12 Cb 0.52 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.55 2iz4 n PRO 12 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2iz4 n ASN 13 N -1.46 2.11 -3.80 3.54 6.94 -1.26 -4.65 115.26 116.68 2iz4 n ASN 13 Ca 0.07 -1.58 -0.09 0.00 -0.02 0.00 0.00 54.58 52.96 2iz4 n ASN 13 Cb 0.26 -0.06 -0.07 0.00 -2.36 0.00 0.00 39.78 37.56 2iz4 n ASN 13 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2iz4 s GLU 14 N -0.87 0.90 -0.01 -3.83 2.02 -1.16 -0.56 118.70 115.18 2iz4 s GLU 14 Ca 0.14 -0.89 0.04 0.00 0.02 0.00 0.00 54.97 54.28 2iz4 s GLU 14 Cb 0.09 0.38 -0.01 0.00 0.10 0.00 0.00 34.13 34.69 2iz4 s GLU 14 CO 0.13 -0.31 -0.14 0.00 0.02 0.00 0.00 175.26 174.96 2iz4 s GLN 16 N -0.25 3.66 0.79 0.00 2.00 -1.26 -2.11 119.66 122.48 2iz4 s GLN 16 Ca 0.04 -0.51 -0.07 0.00 -2.00 0.00 0.00 55.36 52.81 2iz4 s GLN 16 Cb -0.06 -3.01 0.13 0.00 0.80 0.00 0.00 33.01 30.87 2iz4 s GLN 16 CO -0.00 0.13 1.10 0.34 -0.50 0.00 0.00 175.29 176.36 2iz4 s ASP 17 N 0.67 4.08 0.00 6.67 2.15 -0.95 -2.79 116.67 126.51 2iz4 s ASP 17 Ca -0.01 0.07 0.20 0.00 0.43 0.00 0.00 52.55 53.24 2iz4 s ASP 17 Cb -0.14 -0.42 0.91 0.00 -0.30 0.00 0.00 42.92 42.96 2iz4 s ASP 17 CO 0.02 -2.06 1.65 0.18 -0.17 0.00 0.00 175.17 174.78 2iz4 n LEU 18 N -3.16 0.00 0.00 -1.34 7.99 -1.26 -2.96 117.00 116.28 2iz4 n LEU 18 Ca 0.13 0.44 -0.18 0.00 -0.01 0.00 0.00 56.01 56.40 2iz4 n LEU 18 Cb 0.60 -0.44 -0.13 0.00 -0.11 0.00 0.00 43.42 43.34 2iz4 n LEU 18 CO 0.46 -0.14 0.21 0.50 -1.51 0.00 0.00 177.39 176.91 2iz4 h LYS 19 N 0.00 0.22 0.00 3.23 3.11 -2.04 -3.48 116.57 117.61 2iz4 h LYS 19 Ca 0.00 -0.33 0.00 0.00 -2.81 0.00 0.00 60.65 57.51 2iz4 h LYS 19 Cb 0.31 0.12 0.00 0.00 -1.00 0.00 0.00 32.23 31.65 2iz4 h LYS 19 CO 0.00 1.12 0.00 0.41 -2.81 0.00 0.00 179.45 178.17 2iz4 n GLY 20 N 1.49 1.04 3.67 5.01 0.00 -1.15 -5.15 105.19 110.09 2iz4 n GLY 20 Ca -0.12 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.66 2iz4 n GLY 20 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2iz4 s VAL 21 N -1.23 3.66 0.20 1.61 -7.23 -1.26 -4.94 120.40 111.20 2iz4 s VAL 21 Ca 0.00 -1.65 0.08 0.00 -1.81 0.00 0.00 61.98 58.61 2iz4 s VAL 21 Cb 0.00 -2.91 -0.04 0.00 0.56 0.00 0.00 36.38 33.99 2iz4 s VAL 21 CO 0.00 -0.25 -0.04 -0.94 -0.31 0.00 0.00 175.10 173.56 2iz4 s SER 22 N -3.36 4.51 -0.04 4.85 1.04 -1.26 -2.23 113.70 117.20 2iz4 s SER 22 Ca 0.30 -0.52 -0.04 0.00 0.48 0.00 0.00 55.95 56.17 2iz4 s SER 22 Cb -0.08 -0.86 0.02 0.00 0.10 0.00 0.00 66.02 65.20 2iz4 s SER 22 CO 0.20 0.08 0.11 -1.00 0.98 0.00 0.00 173.24 173.61 2iz4 s HIS 23 N -1.85 -0.12 0.48 5.02 3.76 -0.90 -4.96 115.29 116.72 2iz4 s HIS 23 Ca 0.27 0.32 -0.23 0.00 -0.15 0.00 0.00 55.06 55.27 2iz4 s HIS 23 Cb -0.08 0.02 -0.07 0.00 1.11 0.00 0.00 32.58 33.56 2iz4 s HIS 23 CO 0.17 -0.07 1.26 -1.25 -0.85 0.00 0.00 174.74 174.00 2iz4 s PRO 24 N 0.24 3.56 0.56 8.40 0.04 -1.26 -1.83 135.00 144.70 2iz4 s PRO 24 Ca -0.02 2.00 -0.21 0.00 0.04 0.00 0.00 61.00 62.82 2iz4 s PRO 24 Cb -0.03 -2.40 -0.04 0.00 0.04 0.00 0.00 34.50 32.07 2iz4 s PRO 24 CO -0.01 -0.78 1.29 -1.17 0.04 0.00 0.00 177.00 176.37 2iz4 s LEU 25 N -3.12 3.80 0.00 -3.56 2.96 0.28 -2.43 118.68 116.60 2iz4 s LEU 25 Ca 0.66 2.59 0.00 0.00 -0.22 0.00 0.00 54.13 57.16 2iz4 s LEU 25 Cb -0.34 -4.39 0.00 0.00 0.50 0.00 0.00 46.19 41.96 2iz4 s LEU 25 CO 0.42 -1.54 0.00 0.59 -1.32 0.00 0.00 176.35 174.50 2iz4 n ASN 26 N -1.19 0.00 -4.84 3.68 3.02 -0.91 -4.96 115.26 110.06 2iz4 n ASN 26 Ca 0.11 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.34 2iz4 n ASN 26 Cb 0.47 -0.27 -0.05 0.00 -0.61 0.00 0.00 39.78 39.32 2iz4 n ASN 26 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2iz4 s SER 27 N -2.19 6.73 -0.00 6.41 0.01 -1.02 -4.91 113.70 118.73 2iz4 s SER 27 Ca 0.00 1.59 0.06 0.00 1.31 0.00 0.00 55.95 58.92 2iz4 s SER 27 Cb 0.00 -2.51 -0.02 0.00 0.21 0.00 0.00 66.02 63.70 2iz4 s SER 27 CO 0.00 -0.50 -0.20 0.54 0.41 0.00 0.00 173.24 173.49 2iz4 s VAL 28 N -2.46 1.60 0.12 3.43 0.11 -1.26 -3.15 120.40 118.79 2iz4 s VAL 28 Ca 0.60 -0.93 -0.08 0.00 -2.93 0.00 0.00 61.98 58.63 2iz4 s VAL 28 Cb -0.10 -1.34 -0.01 0.00 -1.53 0.00 0.00 36.38 33.40 2iz4 s VAL 28 CO 0.25 0.39 0.22 -1.66 -3.33 0.00 0.00 175.10 170.97 2iz4 s TRP 29 N -0.54 0.29 -0.00 1.54 -2.14 -0.51 -5.00 118.94 112.57 2iz4 s TRP 29 Ca 0.08 -0.69 0.05 0.00 2.66 0.00 0.00 56.10 58.20 2iz4 s TRP 29 Cb -0.08 -0.08 -0.01 0.00 -3.10 0.00 0.00 33.47 30.20 2iz4 s TRP 29 CO -0.00 -0.61 -0.17 0.15 -2.66 0.00 0.00 176.95 173.66 2iz4 s LYS 30 N -3.91 1.31 0.00 3.25 1.02 -1.26 -0.14 119.74 120.00 2iz4 s LYS 30 Ca 0.11 -0.64 0.00 0.00 0.02 0.00 0.00 55.97 55.46 2iz4 s LYS 30 Cb 0.04 -1.29 0.00 0.00 -0.52 0.00 0.00 37.83 36.07 2iz4 s LYS 30 CO -0.06 0.35 0.00 0.25 -0.92 0.00 0.00 175.35 174.97 2iz4 n THR 31 N 2.53 0.00 0.82 2.17 -2.24 -1.19 -4.98 114.28 111.39 2iz4 n THR 31 Ca -0.15 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.72 2iz4 n THR 31 Cb 0.54 -0.92 0.46 0.00 -2.10 0.00 0.00 70.33 68.31 2iz4 n THR 31 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2iz4 n LYS 32 N -0.74 0.18 -0.74 -0.78 4.76 -1.26 -3.03 118.16 116.55 2iz4 n LYS 32 Ca 0.00 0.13 -0.10 0.00 -2.87 0.00 0.00 58.31 55.47 2iz4 n LYS 32 Cb 0.00 -1.50 0.16 0.00 -1.84 0.00 0.00 35.03 31.85 2iz4 n LYS 32 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2iz4 n ASP 33 N -1.36 3.66 -0.46 4.39 5.68 -1.26 -4.86 116.55 122.35 2iz4 n ASP 33 Ca 0.08 -2.92 -0.03 0.00 -0.50 0.00 0.00 54.79 51.41 2iz4 n ASP 33 Cb 0.18 -0.69 -0.01 0.00 -1.14 0.00 0.00 41.12 39.45 2iz4 n ASP 33 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2iz4 s GLU 35 N -1.56 2.27 -0.04 0.00 -1.05 -1.26 -2.97 118.70 114.09 2iz4 s GLU 35 Ca 0.00 -1.02 0.02 0.00 -0.15 0.00 0.00 54.97 53.82 2iz4 s GLU 35 Cb 0.00 -2.48 0.01 0.00 -0.44 0.00 0.00 34.13 31.22 2iz4 s GLU 35 CO 0.00 -0.93 -0.09 -1.83 0.95 0.00 0.00 175.26 173.37 2iz4 s GLU 36 N -4.84 1.04 0.02 -4.83 -1.05 0.37 -3.19 118.70 106.23 2iz4 s GLU 36 Ca 0.60 -0.28 0.05 0.00 -0.15 0.00 0.00 54.97 55.20 2iz4 s GLU 36 Cb -0.08 -0.96 -0.02 0.00 -0.44 0.00 0.00 34.13 32.63 2iz4 s GLU 36 CO 0.40 0.06 -0.15 0.00 0.95 0.00 0.00 175.26 176.52 2iz4 s THR 38 N -0.67 1.14 0.03 0.00 -4.23 -0.84 -1.42 115.64 109.66 2iz4 s THR 38 Ca 0.04 -0.53 -0.30 0.00 -1.18 0.00 0.00 61.69 59.72 2iz4 s THR 38 Cb -0.07 -1.01 -0.04 0.00 1.34 0.00 0.00 72.50 72.72 2iz4 s THR 38 CO 0.01 0.34 1.00 0.00 -0.54 0.00 0.00 174.62 175.43 2iz4 n GLY 40 N 2.76 3.28 0.04 0.00 0.00 -0.22 -2.14 105.19 108.90 2iz4 n GLY 40 Ca 0.05 -1.98 -0.00 0.00 0.00 0.00 0.00 46.02 44.09 2iz4 n GLY 40 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2iz4 h GLN 41 N 0.00 0.00 -0.03 1.61 1.08 -1.91 -3.41 115.11 112.45 2iz4 h GLN 41 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2iz4 h GLN 41 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2iz4 h GLN 41 CO 0.00 0.00 0.00 -0.25 -0.95 0.00 0.00 178.83 177.63 2iz4 n ASP 42 N -3.93 2.31 -3.53 1.46 8.00 -1.26 -4.57 116.55 115.02 2iz4 n ASP 42 Ca -0.00 -2.61 -0.17 0.00 0.71 0.00 0.00 54.79 52.72 2iz4 n ASP 42 Cb 0.01 -0.26 -0.06 0.00 -0.02 0.00 0.00 41.12 40.79 2iz4 n ASP 42 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2iz4 s ALA 43 N -2.06 -1.79 0.01 2.24 0.00 -1.26 -1.77 121.76 117.12 2iz4 s ALA 43 Ca 0.19 1.40 0.01 0.00 0.00 0.00 0.00 51.96 53.57 2iz4 s ALA 43 Cb 0.17 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 2iz4 s ALA 43 CO 0.03 -0.36 0.02 0.42 0.00 0.00 0.00 175.76 175.87 2iz4 s ILE 44 N -1.07 4.29 -0.29 0.00 1.01 -0.13 -1.05 121.20 123.96 2iz4 s ILE 44 Ca -0.09 -0.59 -0.01 0.00 0.00 0.00 0.00 60.65 59.96 2iz4 s ILE 44 Cb -0.00 -2.94 0.05 0.00 0.01 0.00 0.00 42.46 39.58 2iz4 s ILE 44 CO 0.08 0.34 -0.02 -0.44 0.00 0.00 0.00 174.94 174.90 2iz4 s SER 45 N -1.68 4.80 -0.08 3.58 0.01 -0.72 -1.34 113.70 118.27 2iz4 s SER 45 Ca 0.21 -1.28 0.01 0.00 1.31 0.00 0.00 55.95 56.20 2iz4 s SER 45 Cb -0.12 -1.68 -0.02 0.00 0.21 0.00 0.00 66.02 64.41 2iz4 s SER 45 CO 0.12 -0.24 -0.10 0.00 0.41 0.00 0.00 173.24 173.42 2iz4 s ASN 48 N -1.33 7.18 0.00 0.00 2.20 -1.26 -0.48 114.94 121.25 2iz4 s ASN 48 Ca -0.15 1.41 0.12 0.00 -0.94 0.00 0.00 52.86 53.30 2iz4 s ASN 48 Cb -0.09 -2.46 0.45 0.00 -2.00 0.00 0.00 41.25 37.15 2iz4 s ASN 48 CO -0.01 -0.02 1.33 0.35 -2.94 0.00 0.00 177.10 175.81 2iz4 n THR 49 N 3.03 0.23 -3.12 0.54 -2.24 -1.16 -4.82 114.28 106.75 2iz4 n THR 49 Ca -0.02 -0.26 -0.40 0.00 -2.27 0.00 0.00 64.05 61.10 2iz4 n THR 49 Cb 0.50 0.13 -0.06 0.00 -2.10 0.00 0.00 70.33 68.81 2iz4 n THR 49 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2iz4 s ALA 50 N -1.77 3.56 0.55 6.98 0.00 -1.26 -5.05 121.76 124.77 2iz4 s ALA 50 Ca 0.20 -0.31 -0.20 0.00 0.00 0.00 0.00 51.96 51.65 2iz4 s ALA 50 Cb 0.11 -2.98 -0.05 0.00 0.00 0.00 0.00 23.12 20.20 2iz4 s ALA 50 CO 0.15 -0.61 1.24 0.00 0.00 0.00 0.00 175.76 176.54 2iz4 s ALA 51 N 2.03 2.71 -0.44 0.00 0.00 -1.26 -4.93 121.76 119.87 2iz4 s ALA 51 Ca 0.28 1.08 -0.10 0.00 0.00 0.00 0.00 51.96 53.22 2iz4 s ALA 51 Cb -0.16 -3.47 0.08 0.00 0.00 0.00 0.00 23.12 19.58 2iz4 s ALA 51 CO 0.10 -1.11 0.30 0.42 0.00 0.00 0.00 175.76 175.47 2iz4 s ILE 52 N -1.50 4.41 0.95 0.00 -1.09 -0.43 -4.42 121.20 119.12 2iz4 s ILE 52 Ca 0.73 -1.40 -0.11 0.00 -2.23 0.00 0.00 60.65 57.64 2iz4 s ILE 52 Cb -0.33 -3.72 0.16 0.00 -1.58 0.00 0.00 42.46 37.00 2iz4 s ILE 52 CO 0.37 -0.56 1.10 -2.16 -1.23 0.00 0.00 174.94 172.46 2iz4 s PRO 53 N 1.46 0.77 0.33 2.79 0.04 -1.26 -0.78 135.00 138.34 2iz4 s PRO 53 Ca 0.04 1.15 -0.11 0.00 0.04 0.00 0.00 61.00 62.12 2iz4 s PRO 53 Cb -0.24 -1.73 0.04 0.00 0.04 0.00 0.00 34.50 32.62 2iz4 s PRO 53 CO 0.02 -2.67 0.62 -2.37 0.04 0.00 0.00 177.00 172.65 2iz4 n THR 54 N -4.22 0.00 0.00 1.26 5.66 -0.29 -4.84 114.28 111.85 2iz4 n THR 54 Ca 0.08 -0.96 0.00 0.00 -3.05 0.00 0.00 64.05 60.13 2iz4 n THR 54 Cb 0.53 0.85 0.00 0.00 -1.55 0.00 0.00 70.33 70.17 2iz4 n THR 54 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2iz4 n GLY 55 N -0.46 2.87 1.28 1.09 0.00 -1.26 -2.25 105.19 106.46 2iz4 n GLY 55 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 2iz4 n GLY 55 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2iz4 n TYR 56 N -2.00 -3.70 -2.57 1.61 4.11 -1.19 -4.78 117.16 108.63 2iz4 n TYR 56 Ca 0.00 -0.38 -0.41 0.00 -0.00 0.00 0.00 57.90 57.11 2iz4 n TYR 56 Cb 0.00 -0.37 -0.03 0.00 -0.00 0.00 0.00 39.34 38.94 2iz4 n TYR 56 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 2iz4 s ASP 57 N -2.61 6.35 0.00 9.48 1.11 -1.26 -4.79 116.67 124.94 2iz4 s ASP 57 Ca 0.25 -1.02 0.23 0.00 0.18 0.00 0.00 52.55 52.19 2iz4 s ASP 57 Cb -0.01 -2.56 1.33 0.00 1.07 0.00 0.00 42.92 42.74 2iz4 s ASP 57 CO 0.18 -1.64 1.74 0.35 1.18 0.00 0.00 175.17 176.98 2iz4 n THR 58 N 6.61 0.06 0.46 -1.27 -2.24 -1.26 0.32 114.28 116.96 2iz4 n THR 58 Ca 0.19 0.01 0.05 0.00 -2.27 0.00 0.00 64.05 62.04 2iz4 n THR 58 Cb 0.50 -0.65 0.01 0.00 -2.10 0.00 0.00 70.33 68.09 2iz4 n THR 58 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2iz4 n ASN 59 N -1.05 1.46 0.00 3.42 5.03 -1.26 -4.73 115.26 118.13 2iz4 n ASN 59 Ca 0.16 -1.23 0.00 0.00 0.87 0.00 0.00 54.58 54.38 2iz4 n ASN 59 Cb 0.10 0.31 0.00 0.00 -1.02 0.00 0.00 39.78 39.17 2iz4 n ASN 59 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2iz4 n LYS 60 N 0.04 0.00 -3.02 3.52 5.02 -0.83 -5.06 118.16 117.83 2iz4 n LYS 60 Ca 0.05 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.15 2iz4 n LYS 60 Cb 0.24 -0.65 0.05 0.00 -0.02 0.00 0.00 35.03 34.65 2iz4 n LYS 60 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2iz4 s GLN 62 N -4.31 0.72 -0.22 0.00 -2.07 -0.72 -4.64 119.66 108.42 2iz4 s GLN 62 Ca 0.48 -0.40 -0.21 0.00 -1.82 0.00 0.00 55.36 53.41 2iz4 s GLN 62 Cb -0.04 0.31 -0.02 0.00 -1.09 0.00 0.00 33.01 32.17 2iz4 s GLN 62 CO 0.31 -0.21 0.67 -1.59 -1.32 0.00 0.00 175.29 173.14 2iz4 s LYS 63 N -2.04 4.18 -0.09 9.60 0.00 -1.26 -2.65 119.74 127.49 2iz4 s LYS 63 Ca -0.09 0.66 0.01 0.00 0.00 0.00 0.00 55.97 56.55 2iz4 s LYS 63 Cb -0.03 -3.61 0.02 0.00 0.00 0.00 0.00 37.83 34.21 2iz4 s LYS 63 CO -0.00 -0.33 -0.10 0.42 0.00 0.00 0.00 175.35 175.34 2iz4 s ILE 64 N 2.21 1.08 0.25 3.79 -1.09 -0.35 -5.01 121.20 122.08 2iz4 s ILE 64 Ca 0.29 -0.38 -0.30 0.00 -2.23 0.00 0.00 60.65 58.03 2iz4 s ILE 64 Cb -0.16 -1.04 -0.09 0.00 -1.58 0.00 0.00 42.46 39.59 2iz4 s ILE 64 CO 0.10 0.36 1.06 -0.22 -1.23 0.00 0.00 174.94 175.00 2iz4 s LEU 65 N 1.19 4.57 -0.21 2.97 2.96 -1.26 -2.08 118.68 126.82 2iz4 s LEU 65 Ca -0.05 2.16 -0.07 0.00 -0.22 0.00 0.00 54.13 55.95 2iz4 s LEU 65 Cb -0.14 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 2iz4 s LEU 65 CO -0.03 -0.08 0.06 0.20 -1.32 0.00 0.00 176.35 175.19 2iz4 s ASN 66 N -0.84 5.37 0.00 3.68 0.01 0.39 -4.96 114.94 118.59 2iz4 s ASN 66 Ca 0.44 -0.07 0.27 0.00 -0.71 0.00 0.00 52.86 52.79 2iz4 s ASN 66 Cb -0.30 -1.94 0.79 0.00 0.41 0.00 0.00 41.25 40.21 2iz4 s ASN 66 CO 0.38 0.07 1.61 0.29 -1.51 0.00 0.00 177.10 177.94 2iz4 n LYS 67 N 4.22 0.02 0.07 -0.60 4.76 -1.26 -2.05 118.16 123.33 2iz4 n LYS 67 Ca -0.16 -0.01 -0.04 0.00 -2.87 0.00 0.00 58.31 55.23 2iz4 n LYS 67 Cb 0.52 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 32.19 2iz4 n LYS 67 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2iz4 h LYS 68 N 0.02 -0.21 -0.18 1.97 1.57 -1.93 -3.32 116.57 114.48 2iz4 h LYS 68 Ca 0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2iz4 h LYS 68 Cb 0.50 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.86 2iz4 h LYS 68 CO 0.00 -0.14 0.00 0.25 -0.57 0.00 0.00 179.45 178.99 2iz4 n THR 69 N -2.83 2.06 -3.33 -0.16 -2.24 -1.26 -5.01 114.28 101.52 2iz4 n THR 69 Ca -0.03 -1.92 -0.09 0.00 -2.27 0.00 0.00 64.05 59.74 2iz4 n THR 69 Cb 0.10 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.14 2iz4 n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2iz4 s THR 71 N -3.01 0.05 0.25 0.00 2.01 -0.93 -4.91 115.64 109.10 2iz4 s THR 71 Ca 0.01 -0.39 -0.11 0.00 0.31 0.00 0.00 61.69 61.51 2iz4 s THR 71 Cb -0.00 -0.85 -0.08 0.00 0.01 0.00 0.00 72.50 71.58 2iz4 s THR 71 CO 0.80 -0.21 0.60 -0.31 -0.69 0.00 0.00 174.62 174.81 2iz4 s TYR 72 N -1.90 3.43 0.06 4.92 2.02 -1.26 -0.46 117.35 124.16 2iz4 s TYR 72 Ca -0.09 0.98 -0.06 0.00 -0.37 0.00 0.00 57.07 57.54 2iz4 s TYR 72 Cb -0.02 -2.34 -0.01 0.00 -0.40 0.00 0.00 41.96 39.18 2iz4 s TYR 72 CO 0.02 0.24 0.10 -0.08 -1.57 0.00 0.00 175.55 174.26 2iz4 s THR 73 N -1.82 0.15 -0.05 -0.71 -1.32 -0.88 -4.92 115.64 106.08 2iz4 s THR 73 Ca 0.48 -1.27 0.03 0.00 -1.21 0.00 0.00 61.69 59.73 2iz4 s THR 73 Cb -0.11 -1.17 0.00 0.00 -1.51 0.00 0.00 72.50 69.71 2iz4 s THR 73 CO 0.20 -0.70 -0.15 -0.69 -2.21 0.00 0.00 174.62 171.07 2iz4 s VAL 74 N -3.27 1.31 0.05 5.08 1.01 -1.26 -1.21 120.40 122.10 2iz4 s VAL 74 Ca 0.01 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.37 2iz4 s VAL 74 Cb 0.03 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 2iz4 s VAL 74 CO -0.08 0.39 -0.05 0.68 0.00 0.00 0.00 175.10 176.04 2iz4 s VAL 75 N 0.28 0.39 0.31 2.92 -7.23 -1.08 -2.82 120.40 113.16 2iz4 s VAL 75 Ca -0.08 -1.32 -0.30 0.00 -1.81 0.00 0.00 61.98 58.48 2iz4 s VAL 75 Cb -0.13 -0.87 -0.11 0.00 0.56 0.00 0.00 36.38 35.83 2iz4 s VAL 75 CO 0.03 -0.61 1.56 -1.61 -0.31 0.00 0.00 175.10 174.16 2iz4 s GLU 76 N -2.36 4.13 0.24 4.82 2.02 -0.87 -1.75 118.70 124.93 2iz4 s GLU 76 Ca -0.05 2.56 -0.07 0.00 0.02 0.00 0.00 54.97 57.43 2iz4 s GLU 76 Cb -0.04 -3.02 0.23 0.00 0.10 0.00 0.00 34.13 31.40 2iz4 s GLU 76 CO -0.03 -0.60 1.91 0.87 0.02 0.00 0.00 175.26 177.44 2iz4 h LYS 77 N 4.52 1.23 -0.02 1.61 1.57 -0.85 -0.79 116.57 123.83 2iz4 h LYS 77 Ca -0.48 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.12 2iz4 h LYS 77 Cb 1.22 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 2iz4 h LYS 77 CO 0.76 0.81 -0.49 0.87 -0.57 0.00 0.00 179.45 180.83 2iz4 h LYS 78 N 1.26 0.04 -3.44 3.15 1.57 -1.90 -3.38 116.57 113.87 2iz4 h LYS 78 Ca 0.34 -0.02 -0.61 0.00 -1.87 0.00 0.00 60.65 58.49 2iz4 h LYS 78 Cb -0.14 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 31.77 2iz4 h LYS 78 CO -0.08 0.53 -0.73 -0.51 -0.57 0.00 0.00 179.45 178.09 2iz4 s ASP 79 N -6.89 3.99 0.00 0.86 1.01 -0.34 -4.96 116.67 110.34 2iz4 s ASP 79 Ca -0.02 -2.30 0.13 0.00 0.71 0.00 0.00 52.55 51.07 2iz4 s ASP 79 Cb 0.13 -1.13 0.75 0.00 1.01 0.00 0.00 42.92 43.69 2iz4 s ASP 79 CO 0.75 -0.33 1.40 -0.81 0.21 0.00 0.00 175.17 176.39 2iz4 n PRO 80 N 4.00 0.89 -0.08 8.23 -0.04 -0.96 -2.36 135.00 144.69 2iz4 n PRO 80 Ca 0.04 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.56 2iz4 n PRO 80 Cb 0.38 -1.22 0.09 0.00 -0.04 0.00 0.00 33.50 32.71 2iz4 n PRO 80 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2iz4 n GLY 81 N 0.56 0.98 3.13 0.55 0.00 -1.26 -4.94 105.19 104.21 2iz4 n GLY 81 Ca 0.09 -0.35 -0.18 0.00 0.00 0.00 0.00 46.02 45.59 2iz4 n GLY 81 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2iz4 s LYS 82 N -0.96 0.78 0.54 1.61 -0.14 -1.10 -5.08 119.74 115.38 2iz4 s LYS 82 Ca 0.17 -0.83 -0.04 0.00 -1.36 0.00 0.00 55.97 53.91 2iz4 s LYS 82 Cb 0.11 -0.74 0.00 0.00 -1.68 0.00 0.00 37.83 35.52 2iz4 s LYS 82 CO 0.15 0.17 0.83 0.95 -0.76 0.00 0.00 175.35 176.68 2iz4 s THR 83 N -1.13 3.77 0.00 2.17 -4.23 -1.26 -2.05 115.64 112.91 2iz4 s THR 83 Ca -0.02 -0.16 0.00 0.00 -1.18 0.00 0.00 61.69 60.33 2iz4 s THR 83 Cb -0.09 -3.46 0.00 0.00 1.34 0.00 0.00 72.50 70.29 2iz4 s THR 83 CO 0.02 -0.43 0.00 0.00 -0.54 0.00 0.00 174.62 173.67 2iz4 s ASP 85 N -0.10 -0.77 0.08 0.00 2.15 -1.26 -5.10 116.67 111.67 2iz4 s ASP 85 Ca 0.00 1.32 0.06 0.00 0.43 0.00 0.00 52.55 54.36 2iz4 s ASP 85 Cb 0.00 1.33 -0.03 0.00 -0.30 0.00 0.00 42.92 43.92 2iz4 s ASP 85 CO 0.00 -0.22 -0.16 0.68 -0.17 0.00 0.00 175.17 175.30 2iz4 s VAL 86 N 1.03 1.27 -0.68 1.11 -7.23 -1.26 -3.18 120.40 111.45 2iz4 s VAL 86 Ca -0.05 -1.35 0.08 0.00 -1.81 0.00 0.00 61.98 58.85 2iz4 s VAL 86 Cb -0.05 -1.19 -0.00 0.00 0.56 0.00 0.00 36.38 35.70 2iz4 s VAL 86 CO -0.11 -0.16 0.54 1.07 -0.31 0.00 0.00 175.10 176.12 2iz4 n THR 87 N 1.27 0.00 -0.98 5.32 5.66 -0.95 -4.98 114.28 119.62 2iz4 n THR 87 Ca -0.21 -0.42 0.00 0.00 -3.05 0.00 0.00 64.05 60.37 2iz4 n THR 87 Cb 0.54 1.09 0.00 0.00 -1.55 0.00 0.00 70.33 70.41 2iz4 n THR 87 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2iz4 n GLY 88 N 0.79 -1.71 3.31 1.09 0.00 -1.25 -5.04 105.19 102.39 2iz4 n GLY 88 Ca 0.03 -1.10 -0.10 0.00 0.00 0.00 0.00 46.02 44.86 2iz4 n GLY 88 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2iz4 s TRP 89 N -2.29 0.46 0.00 1.61 0.51 -1.26 -1.13 118.94 116.84 2iz4 s TRP 89 Ca 0.00 -0.82 0.00 0.00 -2.12 0.00 0.00 56.10 53.16 2iz4 s TRP 89 Cb 0.00 -0.11 -0.00 0.00 -0.81 0.00 0.00 33.47 32.54 2iz4 s TRP 89 CO 0.00 -0.69 -0.02 0.08 -0.51 0.00 0.00 176.95 175.81 2iz4 s VAL 90 N -3.98 0.13 0.00 4.03 1.01 0.04 -4.89 120.40 116.75 2iz4 s VAL 90 Ca 0.18 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.97 2iz4 s VAL 90 Cb 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 36.38 36.28 2iz4 s VAL 90 CO 0.00 -0.04 0.00 -0.11 0.00 0.00 0.00 175.10 174.95