#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 -3.78 1.55 0.02 0.00 1.13 0.14 -4.98 117.35 111.42 2iz4 s TYR 3 Ca 0.73 -1.56 0.02 0.00 -1.41 0.00 0.00 57.07 54.85 2iz4 s TYR 3 Cb -0.02 -0.50 -0.01 0.00 -1.10 0.00 0.00 41.96 40.33 2iz4 s TYR 3 CO 0.52 -0.98 -0.06 -0.06 -2.51 0.00 0.00 175.55 172.46 2iz4 s PHE 4 N -3.24 0.51 -0.08 -3.49 0.08 -1.26 -1.80 117.98 108.69 2iz4 s PHE 4 Ca 0.37 -0.26 0.02 0.00 0.12 0.00 0.00 56.93 57.18 2iz4 s PHE 4 Cb 0.01 -0.32 0.01 0.00 -0.57 0.00 0.00 43.02 42.16 2iz4 s PHE 4 CO 0.26 -0.05 -0.13 0.42 -0.10 0.00 0.00 175.22 175.62 2iz4 s ILE 5 N -0.67 1.26 -0.40 0.64 1.01 -0.63 -4.98 121.20 117.43 2iz4 s ILE 5 Ca -0.04 -0.53 -0.29 0.00 0.00 0.00 0.00 60.65 59.79 2iz4 s ILE 5 Cb -0.05 -1.15 0.01 0.00 0.01 0.00 0.00 42.46 41.27 2iz4 s ILE 5 CO 0.00 0.39 1.40 -2.16 0.00 0.00 0.00 174.94 174.57 2iz4 s PRO 6 N 0.77 3.61 0.24 2.79 0.04 -1.26 0.00 135.00 141.19 2iz4 s PRO 6 Ca -0.12 0.97 -0.31 0.00 0.04 0.00 0.00 61.00 61.58 2iz4 s PRO 6 Cb -0.16 -4.01 -0.13 0.00 0.04 0.00 0.00 34.50 30.24 2iz4 s PRO 6 CO 0.02 -1.52 1.39 -1.71 0.04 0.00 0.00 177.00 175.23 2iz4 n ASN 7 N 8.70 2.70 -2.27 6.66 5.15 -1.01 -4.89 115.26 130.29 2iz4 n ASN 7 Ca 0.16 1.14 -0.31 0.00 -0.60 0.00 0.00 54.58 54.97 2iz4 n ASN 7 Cb 0.48 -1.42 0.06 0.00 -0.53 0.00 0.00 39.78 38.36 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 1.99 3.02 -4.28 1.20 1.13 -1.22 -4.77 117.38 114.45 2iz4 n GLN 8 Ca 0.12 -3.63 -0.30 0.00 -1.94 0.00 0.00 57.00 51.25 2iz4 n GLN 8 Cb 0.31 -2.28 -0.10 0.00 0.11 0.00 0.00 30.24 28.27 2iz4 n GLN 8 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2iz4 s SER 9 N -2.42 4.25 -0.02 1.08 0.15 -1.26 -4.71 113.70 110.78 2iz4 s SER 9 Ca 0.59 -0.42 0.17 0.00 0.70 0.00 0.00 55.95 56.99 2iz4 s SER 9 Cb 0.47 -0.77 0.52 0.00 -1.71 0.00 0.00 66.02 64.54 2iz4 s SER 9 CO -0.03 0.19 1.43 0.18 1.20 0.00 0.00 173.24 176.21 2iz4 n LEU 10 N 0.81 3.26 -4.46 3.45 7.99 -1.26 -4.87 117.00 121.92 2iz4 n LEU 10 Ca -0.14 -1.63 -0.35 0.00 -0.01 0.00 0.00 56.01 53.88 2iz4 n LEU 10 Cb 0.52 -0.41 -0.12 0.00 -0.11 0.00 0.00 43.42 43.30 2iz4 n LEU 10 CO 0.32 0.75 -0.33 -0.54 -1.51 0.00 0.00 177.39 176.08 2iz4 s LYS 11 N -1.34 3.64 0.00 3.23 1.02 -1.26 -4.98 119.74 120.04 2iz4 s LYS 11 Ca 0.39 -0.51 0.26 0.00 0.02 0.00 0.00 55.97 56.13 2iz4 s LYS 11 Cb 0.21 -3.06 1.58 0.00 -0.52 0.00 0.00 37.83 36.04 2iz4 s LYS 11 CO 0.25 0.05 1.96 -0.35 -0.92 0.00 0.00 175.35 176.34 2iz4 n PRO 12 N 4.12 0.89 0.00 -1.68 -0.04 -1.26 -2.85 135.00 134.18 2iz4 n PRO 12 Ca -0.17 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.33 2iz4 n PRO 12 Cb 0.52 -1.47 0.03 0.00 -0.04 0.00 0.00 33.50 32.54 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 -0.97 1.57 -3.76 3.54 6.94 -1.26 -4.80 115.26 116.52 2iz4 n ASN 13 Ca 0.20 -1.28 -0.10 0.00 -0.02 0.00 0.00 54.58 53.38 2iz4 n ASN 13 Cb 0.09 0.06 -0.06 0.00 -2.36 0.00 0.00 39.78 37.51 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 -0.71 0.91 -0.04 -3.83 2.02 -1.13 -1.16 118.70 114.76 2iz4 s GLU 14 Ca 0.09 -0.80 0.06 0.00 0.02 0.00 0.00 54.97 54.35 2iz4 s GLU 14 Cb 0.06 0.39 -0.01 0.00 0.10 0.00 0.00 34.13 34.67 2iz4 s GLU 14 CO 0.11 -0.32 -0.24 0.00 0.02 0.00 0.00 175.26 174.84 2iz4 s GLN 16 N -0.29 4.25 0.79 0.00 2.00 -1.26 -2.80 119.66 122.35 2iz4 s GLN 16 Ca 0.01 0.11 -0.07 0.00 -2.00 0.00 0.00 55.36 53.41 2iz4 s GLN 16 Cb -0.12 -3.42 0.14 0.00 0.80 0.00 0.00 33.01 30.41 2iz4 s GLN 16 CO 0.02 0.25 1.10 0.34 -0.50 0.00 0.00 175.29 176.50 2iz4 s ASP 17 N 0.44 4.03 0.33 6.67 2.15 0.13 -3.46 116.67 126.97 2iz4 s ASP 17 Ca 0.17 -0.02 0.05 0.00 0.43 0.00 0.00 52.55 53.18 2iz4 s ASP 17 Cb -0.13 -0.30 0.60 0.00 -0.30 0.00 0.00 42.92 42.79 2iz4 s ASP 17 CO 0.04 -2.10 1.86 -0.07 -0.17 0.00 0.00 175.17 174.73 2iz4 h LEU 18 N -0.90 0.46 -0.02 -1.34 3.38 -1.98 -1.49 115.31 113.43 2iz4 h LEU 18 Ca -0.40 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2iz4 h LEU 18 Cb 1.26 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2iz4 h LEU 18 CO 0.43 0.56 0.00 1.17 0.09 0.00 0.00 178.44 180.69 2iz4 n LYS 19 N -4.26 0.94 -1.15 1.13 3.00 -1.26 -4.82 118.16 111.74 2iz4 n LYS 19 Ca 0.01 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.27 2iz4 n LYS 19 Cb 0.27 -1.01 -0.02 0.00 0.00 0.00 0.00 35.03 34.27 2iz4 n LYS 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2iz4 n GLY 20 N 0.43 0.76 3.83 3.14 0.00 -0.56 -5.01 105.19 107.79 2iz4 n GLY 20 Ca 0.00 -0.46 -0.37 0.00 0.00 0.00 0.00 46.02 45.18 2iz4 n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2iz4 s VAL 21 N -2.07 5.24 0.15 1.61 1.01 -1.26 -4.79 120.40 120.29 2iz4 s VAL 21 Ca 0.00 0.58 0.05 0.00 0.00 0.00 0.00 61.98 62.61 2iz4 s VAL 21 Cb 0.00 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 2iz4 s VAL 21 CO 0.00 0.55 0.10 -0.94 0.00 0.00 0.00 175.10 174.82 2iz4 s SER 22 N -0.75 5.41 0.02 3.32 1.04 -1.26 0.22 113.70 121.70 2iz4 s SER 22 Ca 0.20 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.49 2iz4 s SER 22 Cb -0.14 -1.39 -0.02 0.00 0.10 0.00 0.00 66.02 64.57 2iz4 s SER 22 CO 0.08 0.10 -0.03 -1.00 0.98 0.00 0.00 173.24 173.37 2iz4 s HIS 23 N -1.66 0.26 0.38 5.02 3.76 -1.12 -4.99 115.29 116.94 2iz4 s HIS 23 Ca 0.30 -0.42 -0.28 0.00 -0.15 0.00 0.00 55.06 54.52 2iz4 s HIS 23 Cb -0.10 -0.18 -0.11 0.00 1.11 0.00 0.00 32.58 33.30 2iz4 s HIS 23 CO 0.22 -0.14 1.47 -1.25 -0.85 0.00 0.00 174.74 174.19 2iz4 s PRO 24 N -1.17 4.06 0.20 8.40 0.04 -1.26 -3.16 135.00 142.12 2iz4 s PRO 24 Ca -0.12 2.53 -0.31 0.00 0.04 0.00 0.00 61.00 63.15 2iz4 s PRO 24 Cb -0.08 -2.93 -0.10 0.00 0.04 0.00 0.00 34.50 31.43 2iz4 s PRO 24 CO -0.01 -0.56 1.49 -1.17 0.04 0.00 0.00 177.00 176.80 2iz4 s LEU 25 N -2.17 4.38 0.00 -3.56 2.96 -0.31 -2.18 118.68 117.79 2iz4 s LEU 25 Ca 0.54 2.63 0.00 0.00 -0.22 0.00 0.00 54.13 57.07 2iz4 s LEU 25 Cb -0.46 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.62 2iz4 s LEU 25 CO 0.62 -0.75 0.00 -0.46 -1.32 0.00 0.00 176.35 174.43 2iz4 n ASN 26 N 3.12 0.00 -4.92 3.68 0.23 -0.86 -5.01 115.26 111.50 2iz4 n ASN 26 Ca 0.10 0.00 -0.26 0.00 -0.53 0.00 0.00 54.58 53.89 2iz4 n ASN 26 Cb 0.40 0.00 0.02 0.00 -2.08 0.00 0.00 39.78 38.12 2iz4 n ASN 26 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 2iz4 s SER 27 N -2.93 5.69 0.10 0.53 0.15 -0.93 -4.91 113.70 111.41 2iz4 s SER 27 Ca 0.00 0.63 0.07 0.00 0.70 0.00 0.00 55.95 57.34 2iz4 s SER 27 Cb 0.00 -1.70 -0.03 0.00 -1.71 0.00 0.00 66.02 62.58 2iz4 s SER 27 CO 0.00 -0.95 -0.17 0.54 1.20 0.00 0.00 173.24 173.86 2iz4 s VAL 28 N -2.87 1.46 0.29 4.45 0.11 -1.26 -3.14 120.40 119.43 2iz4 s VAL 28 Ca 0.52 -1.51 -0.16 0.00 -2.93 0.00 0.00 61.98 57.90 2iz4 s VAL 28 Cb -0.10 -1.40 0.02 0.00 -1.53 0.00 0.00 36.38 33.36 2iz4 s VAL 28 CO 0.43 -0.18 0.63 -1.66 -3.33 0.00 0.00 175.10 170.99 2iz4 s TRP 29 N -1.39 0.14 -0.04 1.54 -2.14 -0.82 -5.00 118.94 111.22 2iz4 s TRP 29 Ca 0.04 -0.59 0.06 0.00 2.66 0.00 0.00 56.10 58.27 2iz4 s TRP 29 Cb -0.09 0.50 -0.01 0.00 -3.10 0.00 0.00 33.47 30.77 2iz4 s TRP 29 CO 0.04 -1.20 -0.21 0.15 -2.66 0.00 0.00 176.95 173.06 2iz4 s LYS 30 N -3.63 2.08 0.57 3.25 1.02 -1.26 -1.25 119.74 120.52 2iz4 s LYS 30 Ca 0.17 -0.77 0.08 0.00 0.02 0.00 0.00 55.97 55.47 2iz4 s LYS 30 Cb -0.04 -1.83 0.08 0.00 -0.52 0.00 0.00 37.83 35.52 2iz4 s LYS 30 CO 0.09 0.36 0.79 0.95 -0.92 0.00 0.00 175.35 176.62 2iz4 s THR 31 N -0.18 2.28 -1.61 2.17 -4.23 -1.12 -4.97 115.64 107.98 2iz4 s THR 31 Ca -0.01 -0.93 0.00 0.00 -1.18 0.00 0.00 61.69 59.57 2iz4 s THR 31 Cb -0.12 -2.35 0.00 0.00 1.34 0.00 0.00 72.50 71.38 2iz4 s THR 31 CO 0.02 0.00 0.75 0.29 -0.54 0.00 0.00 174.62 175.14 2iz4 n LYS 32 N -2.28 0.93 -0.92 3.99 5.02 -1.26 -3.38 118.16 120.26 2iz4 n LYS 32 Ca 0.14 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.37 2iz4 n LYS 32 Cb 0.61 -1.18 0.18 0.00 -0.02 0.00 0.00 35.03 34.62 2iz4 n LYS 32 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2iz4 n ASP 33 N -0.29 2.76 -3.66 4.39 2.03 -1.26 -4.96 116.55 115.55 2iz4 n ASP 33 Ca 0.00 -3.82 -0.21 0.00 0.52 0.00 0.00 54.79 51.28 2iz4 n ASP 33 Cb 0.09 -0.60 0.00 0.00 -0.72 0.00 0.00 41.12 39.89 2iz4 n ASP 33 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2iz4 s GLU 35 N -4.51 1.13 -0.08 0.00 -1.05 -1.26 -3.84 118.70 109.09 2iz4 s GLU 35 Ca 0.02 -0.52 0.04 0.00 -0.15 0.00 0.00 54.97 54.36 2iz4 s GLU 35 Cb -0.00 0.45 -0.01 0.00 -0.44 0.00 0.00 34.13 34.13 2iz4 s GLU 35 CO 0.87 -0.51 -0.22 -1.83 0.95 0.00 0.00 175.26 174.53 2iz4 s GLU 36 N -3.38 2.85 0.01 -4.83 -1.05 0.00 -2.77 118.70 109.53 2iz4 s GLU 36 Ca 0.07 -0.84 0.04 0.00 -0.15 0.00 0.00 54.97 54.08 2iz4 s GLU 36 Cb -0.02 -2.30 -0.01 0.00 -0.44 0.00 0.00 34.13 31.36 2iz4 s GLU 36 CO -0.05 0.31 -0.12 0.00 0.95 0.00 0.00 175.26 176.35 2iz4 s THR 38 N -0.47 1.74 0.11 0.00 -4.23 -0.37 -1.94 115.64 110.48 2iz4 s THR 38 Ca 0.03 -0.86 -0.30 0.00 -1.18 0.00 0.00 61.69 59.38 2iz4 s THR 38 Cb -0.05 -1.50 -0.06 0.00 1.34 0.00 0.00 72.50 72.23 2iz4 s THR 38 CO 0.00 0.49 0.96 0.00 -0.54 0.00 0.00 174.62 175.53 2iz4 n GLY 40 N 2.25 4.52 0.04 0.00 0.00 -1.23 -2.03 105.19 108.75 2iz4 n GLY 40 Ca 0.02 -1.78 -0.02 0.00 0.00 0.00 0.00 46.02 44.24 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 0.00 1.61 4.20 -1.91 -3.41 115.11 115.59 2iz4 h GLN 41 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2iz4 h GLN 41 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2iz4 h GLN 41 CO 0.00 0.00 -0.16 -0.25 -0.67 0.00 0.00 178.83 177.75 2iz4 n ASP 42 N -3.88 1.56 -3.60 1.46 9.92 -1.26 -4.83 116.55 115.93 2iz4 n ASP 42 Ca -0.03 -2.68 -0.01 0.00 -0.53 0.00 0.00 54.79 51.54 2iz4 n ASP 42 Cb 0.12 -0.34 -0.04 0.00 -0.64 0.00 0.00 41.12 40.22 2iz4 n ASP 42 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2iz4 s ALA 43 N -1.87 -2.18 0.06 2.24 0.00 -1.26 -2.40 121.76 116.35 2iz4 s ALA 43 Ca 0.20 2.29 -0.23 0.00 0.00 0.00 0.00 51.96 54.23 2iz4 s ALA 43 Cb 0.18 -1.81 -0.06 0.00 0.00 0.00 0.00 23.12 21.42 2iz4 s ALA 43 CO 0.02 -0.89 0.69 0.42 0.00 0.00 0.00 175.76 176.00 2iz4 s ILE 44 N 2.71 4.71 -0.33 0.00 1.01 0.10 -3.51 121.20 125.89 2iz4 s ILE 44 Ca -0.06 1.48 -0.12 0.00 0.00 0.00 0.00 60.65 61.95 2iz4 s ILE 44 Cb -0.10 -4.04 -0.02 0.00 0.01 0.00 0.00 42.46 38.31 2iz4 s ILE 44 CO -0.19 0.43 0.23 -0.44 0.00 0.00 0.00 174.94 174.98 2iz4 s SER 45 N -0.44 6.01 0.07 3.58 0.01 -0.56 -1.61 113.70 120.76 2iz4 s SER 45 Ca 0.35 -0.38 0.08 0.00 1.31 0.00 0.00 55.95 57.31 2iz4 s SER 45 Cb -0.20 -2.12 -0.04 0.00 0.21 0.00 0.00 66.02 63.87 2iz4 s SER 45 CO 0.21 -0.21 -0.18 0.00 0.41 0.00 0.00 173.24 173.47 2iz4 s ASN 48 N -1.40 6.98 0.11 0.00 4.22 -1.26 -0.82 114.94 122.77 2iz4 s ASN 48 Ca -0.14 2.26 0.22 0.00 -2.14 0.00 0.00 52.86 53.06 2iz4 s ASN 48 Cb -0.06 -2.60 -0.12 0.00 1.28 0.00 0.00 41.25 39.75 2iz4 s ASN 48 CO 0.03 -0.49 0.83 0.35 -2.04 0.00 0.00 177.10 175.78 2iz4 n THR 49 N 3.07 0.53 -2.96 0.54 -2.24 -1.25 -4.88 114.28 107.09 2iz4 n THR 49 Ca 0.07 -0.56 -0.40 0.00 -2.27 0.00 0.00 64.05 60.89 2iz4 n THR 49 Cb 0.44 -0.29 -0.05 0.00 -2.10 0.00 0.00 70.33 68.33 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 -3.34 3.34 0.51 6.98 0.00 -1.26 -5.03 121.76 122.96 2iz4 s ALA 50 Ca -0.03 0.29 -0.23 0.00 0.00 0.00 0.00 51.96 51.99 2iz4 s ALA 50 Cb 0.11 -3.03 -0.06 0.00 0.00 0.00 0.00 23.12 20.13 2iz4 s ALA 50 CO 0.83 -0.00 1.32 0.00 0.00 0.00 0.00 175.76 177.91 2iz4 s ALA 51 N 0.22 2.92 -0.48 0.00 0.00 -1.26 -4.89 121.76 118.28 2iz4 s ALA 51 Ca 0.40 1.26 -0.15 0.00 0.00 0.00 0.00 51.96 53.47 2iz4 s ALA 51 Cb -0.20 -3.53 0.08 0.00 0.00 0.00 0.00 23.12 19.47 2iz4 s ALA 51 CO 0.23 -1.18 0.40 0.42 0.00 0.00 0.00 175.76 175.63 2iz4 s ILE 52 N -1.34 5.22 0.62 0.00 1.01 -0.36 -4.35 121.20 121.99 2iz4 s ILE 52 Ca 0.68 -1.10 -0.18 0.00 0.00 0.00 0.00 60.65 60.05 2iz4 s ILE 52 Cb -0.38 -4.13 -0.02 0.00 0.01 0.00 0.00 42.46 37.94 2iz4 s ILE 52 CO 0.46 -0.60 1.20 -2.16 0.00 0.00 0.00 174.94 173.84 2iz4 s PRO 53 N 1.64 2.84 0.16 2.79 0.04 -1.26 -2.08 135.00 139.12 2iz4 s PRO 53 Ca 0.04 1.77 -0.02 0.00 0.04 0.00 0.00 61.00 62.84 2iz4 s PRO 53 Cb -0.25 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 2iz4 s PRO 53 CO 0.06 -1.30 0.10 0.95 0.04 0.00 0.00 177.00 176.85 2iz4 s THR 54 N -1.72 0.07 0.00 1.26 -4.23 -1.23 -4.88 115.64 104.91 2iz4 s THR 54 Ca 0.76 -1.91 0.00 0.00 -1.18 0.00 0.00 61.69 59.36 2iz4 s THR 54 Cb -0.29 -2.18 0.00 0.00 1.34 0.00 0.00 72.50 71.37 2iz4 s THR 54 CO 0.35 -0.30 0.00 0.61 -0.54 0.00 0.00 174.62 174.74 2iz4 n GLY 55 N -0.16 0.78 3.89 3.99 0.00 -1.26 0.11 105.19 112.53 2iz4 n GLY 55 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 2iz4 n GLY 55 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2iz4 s TYR 56 N -2.91 1.95 -0.91 1.61 -0.85 -1.00 -4.63 117.35 110.62 2iz4 s TYR 56 Ca 0.00 0.49 -0.22 0.00 -0.52 0.00 0.00 57.07 56.82 2iz4 s TYR 56 Cb 0.00 -3.85 0.08 0.00 0.38 0.00 0.00 41.96 38.57 2iz4 s TYR 56 CO 0.00 -2.49 1.24 -0.51 -1.52 0.00 0.00 175.55 172.28 2iz4 s ASP 57 N -4.67 6.47 0.20 -0.18 1.01 -1.26 -4.82 116.67 113.42 2iz4 s ASP 57 Ca 0.70 -1.52 0.11 0.00 0.71 0.00 0.00 52.55 52.55 2iz4 s ASP 57 Cb -0.07 -2.48 0.60 0.00 1.01 0.00 0.00 42.92 41.97 2iz4 s ASP 57 CO 0.52 -1.36 1.28 0.35 0.21 0.00 0.00 175.17 176.17 2iz4 n THR 58 N 6.18 1.18 0.43 -1.27 -2.24 -1.26 0.22 114.28 117.52 2iz4 n THR 58 Ca 0.22 0.65 0.09 0.00 -2.27 0.00 0.00 64.05 62.73 2iz4 n THR 58 Cb 0.49 -1.65 -0.13 0.00 -2.10 0.00 0.00 70.33 66.95 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 -1.87 0.77 -0.85 3.42 5.03 -1.26 -4.53 115.26 115.96 2iz4 n ASN 59 Ca -0.01 -0.47 0.02 0.00 0.87 0.00 0.00 54.58 54.99 2iz4 n ASN 59 Cb 0.12 1.43 0.02 0.00 -1.02 0.00 0.00 39.78 40.33 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 -1.79 0.10 -3.63 3.52 5.02 0.16 -5.01 118.16 116.53 2iz4 n LYS 60 Ca 0.00 -1.50 -0.11 0.00 -2.02 0.00 0.00 58.31 54.69 2iz4 n LYS 60 Cb 0.39 -0.39 -0.05 0.00 -0.02 0.00 0.00 35.03 34.96 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 -3.63 0.44 -0.18 0.00 -2.07 -0.86 -4.56 119.66 108.79 2iz4 s GLN 62 Ca 0.02 -0.48 -0.26 0.00 -1.82 0.00 0.00 55.36 52.82 2iz4 s GLN 62 Cb 0.01 0.18 -0.01 0.00 -1.09 0.00 0.00 33.01 32.10 2iz4 s GLN 62 CO -0.11 -0.10 0.89 0.15 -1.32 0.00 0.00 175.29 174.80 2iz4 s LYS 63 N -1.46 4.29 -0.37 9.60 -0.14 -1.26 -3.27 119.74 127.13 2iz4 s LYS 63 Ca -0.15 1.11 0.02 0.00 -1.36 0.00 0.00 55.97 55.59 2iz4 s LYS 63 Cb -0.08 -3.59 0.11 0.00 -1.68 0.00 0.00 37.83 32.59 2iz4 s LYS 63 CO 0.01 -0.41 0.12 0.42 -0.76 0.00 0.00 175.35 174.72 2iz4 s ILE 64 N 2.43 1.80 0.19 2.17 1.01 -0.69 -5.04 121.20 123.07 2iz4 s ILE 64 Ca 0.40 -2.23 -0.30 0.00 0.00 0.00 0.00 60.65 58.52 2iz4 s ILE 64 Cb -0.16 -2.31 -0.08 0.00 0.01 0.00 0.00 42.46 39.91 2iz4 s ILE 64 CO 0.11 -0.69 1.22 -0.22 0.00 0.00 0.00 174.94 175.36 2iz4 s LEU 65 N 0.88 4.45 -0.22 2.97 2.96 -1.26 -3.19 118.68 125.26 2iz4 s LEU 65 Ca 0.12 2.27 -0.11 0.00 -0.22 0.00 0.00 54.13 56.19 2iz4 s LEU 65 Cb -0.20 -3.61 -0.05 0.00 0.50 0.00 0.00 46.19 42.83 2iz4 s LEU 65 CO -0.11 -0.40 0.18 0.20 -1.32 0.00 0.00 176.35 174.91 2iz4 s ASN 66 N 0.13 6.19 0.00 3.68 -0.87 -0.49 -4.95 114.94 118.63 2iz4 s ASN 66 Ca 0.53 0.21 0.25 0.00 -1.57 0.00 0.00 52.86 52.28 2iz4 s ASN 66 Cb -0.33 -2.12 0.47 0.00 -0.02 0.00 0.00 41.25 39.25 2iz4 s ASN 66 CO 0.37 0.09 1.39 0.29 -2.57 0.00 0.00 177.10 176.67 2iz4 n LYS 67 N 4.04 0.31 0.44 -0.60 4.76 -1.26 -2.01 118.16 123.84 2iz4 n LYS 67 Ca -0.14 -0.20 -0.17 0.00 -2.87 0.00 0.00 58.31 54.93 2iz4 n LYS 67 Cb 0.52 -1.50 -0.08 0.00 -1.84 0.00 0.00 35.03 32.13 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 0.48 -1.09 -0.21 1.97 1.57 -1.94 -3.34 116.57 114.02 2iz4 h LYS 68 Ca 0.00 0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2iz4 h LYS 68 Cb 0.51 0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.07 2iz4 h LYS 68 CO 0.00 -0.72 0.00 -2.37 -0.57 0.00 0.00 179.45 175.79 2iz4 n THR 69 N -5.36 1.20 -3.41 -0.16 5.66 -1.26 -5.02 114.28 105.93 2iz4 n THR 69 Ca -0.14 -1.18 -0.16 0.00 -3.05 0.00 0.00 64.05 59.52 2iz4 n THR 69 Cb 0.44 0.37 0.02 0.00 -1.55 0.00 0.00 70.33 69.62 2iz4 n THR 69 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2iz4 s THR 71 N -3.19 0.05 0.31 0.00 2.01 -1.04 -4.48 115.64 109.30 2iz4 s THR 71 Ca 0.20 -0.40 -0.09 0.00 0.31 0.00 0.00 61.69 61.71 2iz4 s THR 71 Cb -0.06 -0.36 -0.07 0.00 0.01 0.00 0.00 72.50 72.03 2iz4 s THR 71 CO 0.81 -0.22 0.64 -0.31 -0.69 0.00 0.00 174.62 174.85 2iz4 s TYR 72 N -0.78 3.45 0.00 4.92 2.02 -1.26 -1.39 117.35 124.31 2iz4 s TYR 72 Ca -0.09 0.90 -0.15 0.00 -0.37 0.00 0.00 57.07 57.36 2iz4 s TYR 72 Cb -0.05 -2.30 0.02 0.00 -0.40 0.00 0.00 41.96 39.23 2iz4 s TYR 72 CO 0.01 0.11 0.33 -0.08 -1.57 0.00 0.00 175.55 174.35 2iz4 s THR 73 N -2.08 0.06 -0.05 -0.71 -1.32 -1.19 -4.95 115.64 105.39 2iz4 s THR 73 Ca 0.48 -0.51 0.03 0.00 -1.21 0.00 0.00 61.69 60.48 2iz4 s THR 73 Cb -0.11 -0.75 0.00 0.00 -1.51 0.00 0.00 72.50 70.14 2iz4 s THR 73 CO 0.26 -0.28 -0.15 -0.69 -2.21 0.00 0.00 174.62 171.55 2iz4 s VAL 74 N -1.75 1.29 0.07 5.08 1.01 -1.26 -1.70 120.40 123.14 2iz4 s VAL 74 Ca -0.10 -0.61 -0.01 0.00 0.00 0.00 0.00 61.98 61.25 2iz4 s VAL 74 Cb -0.03 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 2iz4 s VAL 74 CO 0.02 0.38 -0.01 0.68 0.00 0.00 0.00 175.10 176.16 2iz4 s VAL 75 N 0.25 0.25 0.02 2.92 -7.23 -1.20 -2.92 120.40 112.49 2iz4 s VAL 75 Ca -0.07 -1.85 -0.30 0.00 -1.81 0.00 0.00 61.98 57.95 2iz4 s VAL 75 Cb -0.13 -1.66 -0.07 0.00 0.56 0.00 0.00 36.38 35.09 2iz4 s VAL 75 CO 0.03 -0.86 1.51 -1.61 -0.31 0.00 0.00 175.10 173.86 2iz4 s GLU 76 N -3.94 4.24 0.55 4.82 2.02 -1.18 -2.04 118.70 123.17 2iz4 s GLU 76 Ca 0.11 2.12 0.38 0.00 0.02 0.00 0.00 54.97 57.61 2iz4 s GLU 76 Cb 0.08 -3.61 1.56 0.00 0.10 0.00 0.00 34.13 32.25 2iz4 s GLU 76 CO -0.07 -0.66 1.75 0.87 0.02 0.00 0.00 175.26 177.18 2iz4 h LYS 77 N 8.15 0.00 0.00 1.61 1.57 -1.82 2.35 116.57 128.42 2iz4 h LYS 77 Ca -0.40 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.35 2iz4 h LYS 77 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 2iz4 h LYS 77 CO 0.92 0.00 -0.17 0.87 -0.57 0.00 0.00 179.45 180.49 2iz4 h LYS 78 N 0.00 0.00 -2.48 3.15 1.79 -1.89 -3.40 116.57 113.74 2iz4 h LYS 78 Ca 0.61 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.85 2iz4 h LYS 78 Cb 2.50 0.00 -0.33 0.00 -1.58 0.00 0.00 32.23 32.82 2iz4 h LYS 78 CO -0.01 0.17 -0.54 -0.51 -1.08 0.00 0.00 179.45 177.48 2iz4 s ASP 79 N -6.44 0.67 0.00 0.86 1.01 0.79 -5.02 116.67 108.54 2iz4 s ASP 79 Ca -0.03 0.23 0.00 0.00 0.71 0.00 0.00 52.55 53.46 2iz4 s ASP 79 Cb 0.14 0.72 0.00 0.00 1.01 0.00 0.00 42.92 44.79 2iz4 s ASP 79 CO 0.63 -0.29 0.50 -0.81 0.21 0.00 0.00 175.17 175.42 2iz4 n PRO 80 N 5.34 0.65 -0.04 8.23 -0.04 -1.23 -2.29 135.00 145.62 2iz4 n PRO 80 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 2iz4 n PRO 80 Cb 0.50 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.81 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 0.16 -2.23 0.00 0.55 0.00 -1.26 -4.94 105.19 97.46 2iz4 n GLY 81 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2iz4 n GLY 81 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2iz4 n LYS 82 N -0.04 3.94 -3.65 1.61 0.00 -0.97 -5.03 118.16 114.01 2iz4 n LYS 82 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 58.31 58.28 2iz4 n LYS 82 Cb 0.50 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.48 2iz4 n LYS 82 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2iz4 s THR 83 N 0.00 -0.79 0.00 3.15 -4.23 -1.26 -4.77 115.64 107.73 2iz4 s THR 83 Ca 0.00 0.02 0.00 0.00 -1.18 0.00 0.00 61.69 60.53 2iz4 s THR 83 Cb 0.00 -0.96 0.00 0.00 1.34 0.00 0.00 72.50 72.88 2iz4 s THR 83 CO 0.00 0.01 0.00 0.00 -0.54 0.00 0.00 174.62 174.09 2iz4 s ASP 85 N -1.00 -0.44 -0.03 0.00 1.01 -1.26 -5.05 116.67 109.90 2iz4 s ASP 85 Ca 0.00 0.83 0.04 0.00 0.71 0.00 0.00 52.55 54.13 2iz4 s ASP 85 Cb 0.00 0.82 -0.01 0.00 1.01 0.00 0.00 42.92 44.74 2iz4 s ASP 85 CO 0.00 -0.15 -0.16 0.68 0.21 0.00 0.00 175.17 175.75 2iz4 s VAL 86 N 0.42 1.34 -0.71 -1.27 -7.23 -1.26 -2.38 120.40 109.31 2iz4 s VAL 86 Ca -0.02 -0.68 0.24 0.00 -1.81 0.00 0.00 61.98 59.71 2iz4 s VAL 86 Cb -0.04 -1.14 0.03 0.00 0.56 0.00 0.00 36.38 35.79 2iz4 s VAL 86 CO -0.02 0.39 1.33 1.07 -0.31 0.00 0.00 175.10 177.55 2iz4 n THR 87 N 3.02 0.27 0.00 5.32 5.66 0.31 -4.95 114.28 123.91 2iz4 n THR 87 Ca -0.17 -0.22 0.00 0.00 -3.05 0.00 0.00 64.05 60.61 2iz4 n THR 87 Cb 0.53 -0.04 0.00 0.00 -1.55 0.00 0.00 70.33 69.27 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 1.37 3.36 3.92 1.09 0.00 -1.24 -5.01 105.19 108.68 2iz4 n GLY 88 Ca 0.04 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 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 0.00 1.80 -0.06 1.61 0.51 -1.26 -3.47 118.94 118.07 2iz4 s TRP 89 Ca 0.00 0.39 -0.07 0.00 -2.12 0.00 0.00 56.10 54.30 2iz4 s TRP 89 Cb 0.00 -4.01 0.02 0.00 -0.81 0.00 0.00 33.47 28.67 2iz4 s TRP 89 CO 0.00 -2.53 0.18 0.08 -0.51 0.00 0.00 176.95 174.17 2iz4 s VAL 90 N -3.83 0.01 0.00 4.03 1.01 -0.88 -4.90 120.40 115.85 2iz4 s VAL 90 Ca 0.72 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.60 2iz4 s VAL 90 Cb -0.05 -0.30 0.00 0.00 0.00 0.00 0.00 36.38 36.03 2iz4 s VAL 90 CO 0.52 -0.06 0.35 -0.11 0.00 0.00 0.00 175.10 175.81