#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 -3.26 -0.21 0.05 0.00 1.13 0.13 -4.99 117.35 110.20 2iz4 s TYR 3 Ca 0.32 0.55 -0.07 0.00 -1.41 0.00 0.00 57.07 56.46 2iz4 s TYR 3 Cb 0.07 -0.01 -0.05 0.00 -1.10 0.00 0.00 41.96 40.87 2iz4 s TYR 3 CO 0.15 -0.16 0.32 -0.06 -2.51 0.00 0.00 175.55 173.28 2iz4 s PHE 4 N 0.87 3.56 -0.09 -3.49 0.40 -1.26 -1.19 117.98 116.77 2iz4 s PHE 4 Ca -0.06 0.60 0.01 0.00 -0.60 0.00 0.00 56.93 56.88 2iz4 s PHE 4 Cb -0.08 -2.02 -0.02 0.00 0.51 0.00 0.00 43.02 41.41 2iz4 s PHE 4 CO -0.05 0.56 -0.13 0.42 0.70 0.00 0.00 175.22 176.71 2iz4 s ILE 5 N -1.40 3.07 -0.55 0.64 1.01 0.03 -4.96 121.20 119.03 2iz4 s ILE 5 Ca 0.32 -0.68 -0.28 0.00 0.00 0.00 0.00 60.65 60.01 2iz4 s ILE 5 Cb -0.13 -2.25 0.01 0.00 0.01 0.00 0.00 42.46 40.10 2iz4 s ILE 5 CO 0.19 0.55 1.48 -2.16 0.00 0.00 0.00 174.94 175.00 2iz4 s PRO 6 N -0.13 3.24 -0.35 2.79 0.04 -1.26 -1.13 135.00 138.20 2iz4 s PRO 6 Ca -0.01 0.53 -0.42 0.00 0.04 0.00 0.00 61.00 61.13 2iz4 s PRO 6 Cb -0.14 -4.15 -0.17 0.00 0.04 0.00 0.00 34.50 30.08 2iz4 s PRO 6 CO 0.03 -2.01 1.70 -1.71 0.04 0.00 0.00 177.00 175.06 2iz4 n ASN 7 N 9.92 2.02 -0.02 6.66 5.15 -1.03 -4.79 115.26 133.18 2iz4 n ASN 7 Ca 0.14 1.11 0.14 0.00 -0.60 0.00 0.00 54.58 55.37 2iz4 n ASN 7 Cb 0.49 -1.06 0.68 0.00 -0.53 0.00 0.00 39.78 39.37 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 4.98 0.34 -2.31 1.20 1.13 -0.99 -4.84 117.38 116.89 2iz4 n GLN 8 Ca 0.28 -0.03 -0.26 0.00 -1.94 0.00 0.00 57.00 55.05 2iz4 n GLN 8 Cb 0.07 -1.50 0.05 0.00 0.11 0.00 0.00 30.24 28.97 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 -2.68 5.26 0.00 1.08 0.15 -1.26 -4.91 113.70 111.33 2iz4 s SER 9 Ca 0.24 0.60 0.05 0.00 0.70 0.00 0.00 55.95 57.54 2iz4 s SER 9 Cb 0.20 -1.44 0.10 0.00 -1.71 0.00 0.00 66.02 63.17 2iz4 s SER 9 CO 0.49 -1.30 0.94 0.18 1.20 0.00 0.00 173.24 174.76 2iz4 n LEU 10 N -2.73 2.03 -4.67 3.45 4.77 -1.26 -4.88 117.00 113.71 2iz4 n LEU 10 Ca 0.06 -1.63 -0.39 0.00 -0.03 0.00 0.00 56.01 54.03 2iz4 n LEU 10 Cb 0.59 -0.06 -0.07 0.00 -2.33 0.00 0.00 43.42 41.55 2iz4 n LEU 10 CO 0.52 0.49 0.18 -0.54 -1.33 0.00 0.00 177.39 176.72 2iz4 s LYS 11 N -0.78 4.20 0.00 3.23 1.02 -1.26 -4.96 119.74 121.19 2iz4 s LYS 11 Ca 0.08 0.35 0.23 0.00 0.02 0.00 0.00 55.97 56.65 2iz4 s LYS 11 Cb 0.05 -3.54 1.01 0.00 -0.52 0.00 0.00 37.83 34.83 2iz4 s LYS 11 CO 0.07 -0.07 1.74 -0.35 -0.92 0.00 0.00 175.35 175.81 2iz4 n PRO 12 N 4.54 0.04 0.00 -1.68 -0.04 -1.26 -2.89 135.00 133.71 2iz4 n PRO 12 Ca -0.06 0.10 0.11 0.00 -0.04 0.00 0.00 63.50 63.61 2iz4 n PRO 12 Cb 0.51 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.57 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 -1.47 1.15 -3.99 3.54 0.23 -1.26 -4.60 115.26 108.85 2iz4 n ASN 13 Ca 0.06 -0.93 -0.09 0.00 -0.53 0.00 0.00 54.58 53.09 2iz4 n ASN 13 Cb 0.26 0.52 -0.05 0.00 -2.08 0.00 0.00 39.78 38.42 2iz4 n ASN 13 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2iz4 s GLU 14 N -2.77 1.54 -0.02 -3.83 2.02 -1.14 -1.52 118.70 112.97 2iz4 s GLU 14 Ca 0.15 -1.23 0.04 0.00 0.02 0.00 0.00 54.97 53.94 2iz4 s GLU 14 Cb 0.18 0.47 -0.01 0.00 0.10 0.00 0.00 34.13 34.87 2iz4 s GLU 14 CO 0.68 -0.64 -0.13 0.00 0.02 0.00 0.00 175.26 175.19 2iz4 s GLN 16 N -0.13 3.96 0.57 0.00 0.74 -1.26 -3.12 119.66 120.43 2iz4 s GLN 16 Ca 0.01 -0.34 0.00 0.00 0.05 0.00 0.00 55.36 55.08 2iz4 s GLN 16 Cb -0.07 -3.27 0.11 0.00 1.10 0.00 0.00 33.01 30.88 2iz4 s GLN 16 CO 0.00 0.20 0.78 -3.47 -0.55 0.00 0.00 175.29 172.26 2iz4 n ASP 17 N 3.76 1.08 0.15 6.67 -0.08 -0.35 -2.35 116.55 125.43 2iz4 n ASP 17 Ca -0.16 -1.90 0.03 0.00 -1.51 0.00 0.00 54.79 51.24 2iz4 n ASP 17 Cb 0.52 -0.50 0.41 0.00 2.34 0.00 0.00 41.12 43.88 2iz4 n ASP 17 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2iz4 h LEU 18 N 0.00 0.15 -0.49 -2.67 4.07 -1.96 -1.66 115.31 112.75 2iz4 h LEU 18 Ca -0.26 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.67 2iz4 h LEU 18 Cb 0.96 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.66 2iz4 h LEU 18 CO 0.28 0.35 0.00 1.17 -1.08 0.00 0.00 178.44 179.15 2iz4 n LYS 19 N -4.26 0.92 -1.79 1.13 4.81 -1.26 -4.81 118.16 112.90 2iz4 n LYS 19 Ca -0.01 0.00 -0.20 0.00 -0.87 0.00 0.00 58.31 57.23 2iz4 n LYS 19 Cb 0.29 -1.23 -0.07 0.00 0.02 0.00 0.00 35.03 34.04 2iz4 n LYS 19 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2iz4 n GLY 20 N 0.23 1.26 3.90 3.14 0.00 -0.62 -4.96 105.19 108.14 2iz4 n GLY 20 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2iz4 n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2iz4 s VAL 21 N -2.76 5.30 0.22 1.61 0.11 -1.26 -4.85 120.40 118.77 2iz4 s VAL 21 Ca 0.00 -0.35 0.11 0.00 -2.93 0.00 0.00 61.98 58.81 2iz4 s VAL 21 Cb 0.00 -3.54 -0.05 0.00 -1.53 0.00 0.00 36.38 31.26 2iz4 s VAL 21 CO 0.00 0.21 -0.20 -0.94 -3.33 0.00 0.00 175.10 170.83 2iz4 s SER 22 N -2.29 3.62 0.00 3.54 1.04 -1.26 -1.22 113.70 117.13 2iz4 s SER 22 Ca 0.32 -0.88 -0.04 0.00 0.48 0.00 0.00 55.95 55.83 2iz4 s SER 22 Cb -0.13 -0.34 -0.00 0.00 0.10 0.00 0.00 66.02 65.65 2iz4 s SER 22 CO 0.24 0.09 0.07 -1.00 0.98 0.00 0.00 173.24 173.62 2iz4 s HIS 23 N -1.96 0.08 0.39 5.02 3.76 -1.18 -4.99 115.29 116.41 2iz4 s HIS 23 Ca 0.24 -0.19 -0.28 0.00 -0.15 0.00 0.00 55.06 54.69 2iz4 s HIS 23 Cb -0.07 -0.08 -0.11 0.00 1.11 0.00 0.00 32.58 33.43 2iz4 s HIS 23 CO 0.12 -0.21 1.45 -0.35 -0.85 0.00 0.00 174.74 174.91 2iz4 n PRO 24 N 1.81 2.53 -1.85 8.40 -0.04 -1.26 -3.30 135.00 141.29 2iz4 n PRO 24 Ca -0.21 0.89 -0.42 0.00 -0.04 0.00 0.00 63.50 63.72 2iz4 n PRO 24 Cb 0.56 -2.62 -0.02 0.00 -0.04 0.00 0.00 33.50 31.39 2iz4 n PRO 24 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2iz4 s LEU 25 N -2.01 4.36 0.00 1.53 2.96 -0.58 -2.11 118.68 122.84 2iz4 s LEU 25 Ca 0.55 2.84 0.00 0.00 -0.22 0.00 0.00 54.13 57.30 2iz4 s LEU 25 Cb -0.48 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 42.58 2iz4 s LEU 25 CO 0.63 -0.85 0.00 -3.20 -1.32 0.00 0.00 176.35 171.60 2iz4 n ASN 26 N 2.49 0.00 -4.85 3.68 2.85 0.32 -4.98 115.26 114.78 2iz4 n ASN 26 Ca 0.09 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 54.24 2iz4 n ASN 26 Cb 0.38 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 41.35 2iz4 n ASN 26 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 2iz4 s SER 27 N -3.07 6.74 0.13 1.20 0.01 -0.90 -4.86 113.70 112.95 2iz4 s SER 27 Ca 0.00 1.34 0.11 0.00 1.31 0.00 0.00 55.95 58.71 2iz4 s SER 27 Cb 0.00 -2.40 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 2iz4 s SER 27 CO 0.00 -0.30 -0.26 0.54 0.41 0.00 0.00 173.24 173.62 2iz4 s VAL 28 N -2.15 2.20 0.20 3.43 0.11 -1.26 -2.72 120.40 120.22 2iz4 s VAL 28 Ca 0.55 -1.75 -0.11 0.00 -2.93 0.00 0.00 61.98 57.74 2iz4 s VAL 28 Cb -0.10 -1.96 -0.00 0.00 -1.53 0.00 0.00 36.38 32.79 2iz4 s VAL 28 CO 0.21 0.07 0.39 -1.66 -3.33 0.00 0.00 175.10 170.78 2iz4 s TRP 29 N -1.09 0.34 -0.04 1.54 -2.14 -0.30 -4.99 118.94 112.26 2iz4 s TRP 29 Ca 0.13 -0.69 0.05 0.00 2.66 0.00 0.00 56.10 58.26 2iz4 s TRP 29 Cb -0.10 0.09 -0.01 0.00 -3.10 0.00 0.00 33.47 30.35 2iz4 s TRP 29 CO 0.06 -0.86 -0.21 0.15 -2.66 0.00 0.00 176.95 173.44 2iz4 s LYS 30 N -3.98 1.97 0.00 3.25 1.02 -1.26 -0.85 119.74 119.89 2iz4 s LYS 30 Ca 0.19 -0.74 0.00 0.00 0.02 0.00 0.00 55.97 55.45 2iz4 s LYS 30 Cb 0.01 -1.75 0.00 0.00 -0.52 0.00 0.00 37.83 35.57 2iz4 s LYS 30 CO 0.04 0.35 0.00 0.25 -0.92 0.00 0.00 175.35 175.06 2iz4 n THR 31 N 2.91 0.00 1.32 2.17 -2.24 -1.17 -4.96 114.28 112.32 2iz4 n THR 31 Ca -0.17 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.71 2iz4 n THR 31 Cb 0.53 -1.09 0.59 0.00 -2.10 0.00 0.00 70.33 68.26 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 -0.90 0.66 -0.95 -0.78 5.02 -1.26 -2.72 118.16 117.23 2iz4 n LYS 32 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 2iz4 n LYS 32 Cb 0.00 -1.47 0.22 0.00 -0.02 0.00 0.00 35.03 33.76 2iz4 n LYS 32 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2iz4 n ASP 33 N -0.97 3.44 -0.29 4.39 8.00 -1.26 -4.91 116.55 124.96 2iz4 n ASP 33 Ca 0.15 -3.55 -0.01 0.00 0.71 0.00 0.00 54.79 52.09 2iz4 n ASP 33 Cb 0.07 -0.71 -0.01 0.00 -0.02 0.00 0.00 41.12 40.45 2iz4 n ASP 33 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2iz4 s GLU 35 N -0.97 2.39 -0.06 0.00 -1.05 -1.26 -3.86 118.70 113.90 2iz4 s GLU 35 Ca 0.00 -0.29 0.04 0.00 -0.15 0.00 0.00 54.97 54.57 2iz4 s GLU 35 Cb 0.00 -2.24 0.00 0.00 -0.44 0.00 0.00 34.13 31.45 2iz4 s GLU 35 CO 0.00 -1.05 -0.17 -1.83 0.95 0.00 0.00 175.26 173.16 2iz4 s GLU 36 N -5.12 1.95 -0.01 -4.83 -1.05 -0.10 -3.02 118.70 106.53 2iz4 s GLU 36 Ca 0.58 -0.62 0.03 0.00 -0.15 0.00 0.00 54.97 54.81 2iz4 s GLU 36 Cb -0.11 -1.64 -0.01 0.00 -0.44 0.00 0.00 34.13 31.94 2iz4 s GLU 36 CO 0.44 0.20 -0.09 0.00 0.95 0.00 0.00 175.26 176.76 2iz4 s THR 38 N -0.21 1.32 -0.00 0.00 2.01 -0.79 -1.15 115.64 116.82 2iz4 s THR 38 Ca 0.03 -0.63 -0.30 0.00 0.31 0.00 0.00 61.69 61.10 2iz4 s THR 38 Cb -0.03 -1.16 -0.03 0.00 0.01 0.00 0.00 72.50 71.29 2iz4 s THR 38 CO -0.00 0.39 1.04 0.00 -0.69 0.00 0.00 174.62 175.35 2iz4 n GLY 40 N 3.01 2.98 0.02 0.00 0.00 -1.21 -0.52 105.19 109.47 2iz4 n GLY 40 Ca 0.07 -1.91 -0.00 0.00 0.00 0.00 0.00 46.02 44.18 2iz4 n GLY 40 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2iz4 h GLN 41 N 0.00 -0.01 0.00 1.61 5.75 -1.89 -3.41 115.11 117.16 2iz4 h GLN 41 Ca 0.00 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2iz4 h GLN 41 Cb 0.00 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 2iz4 h GLN 41 CO 0.00 -0.01 -0.18 -3.47 -2.65 0.00 0.00 178.83 172.52 2iz4 n ASP 42 N -3.04 1.71 -3.61 -0.69 -0.08 -1.26 -4.50 116.55 105.08 2iz4 n ASP 42 Ca -0.00 -2.86 -0.01 0.00 -1.51 0.00 0.00 54.79 50.41 2iz4 n ASP 42 Cb 0.00 -0.38 -0.04 0.00 2.34 0.00 0.00 41.12 43.04 2iz4 n ASP 42 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2iz4 s ALA 43 N -2.15 -2.15 0.21 -1.67 0.00 -1.26 -2.47 121.76 112.28 2iz4 s ALA 43 Ca 0.25 2.30 -0.22 0.00 0.00 0.00 0.00 51.96 54.29 2iz4 s ALA 43 Cb 0.22 -1.78 -0.08 0.00 0.00 0.00 0.00 23.12 21.48 2iz4 s ALA 43 CO 0.01 -0.85 0.77 0.42 0.00 0.00 0.00 175.76 176.10 2iz4 s ILE 44 N 2.63 4.46 -0.32 0.00 1.01 -0.28 -3.30 121.20 125.40 2iz4 s ILE 44 Ca -0.06 1.48 -0.06 0.00 0.00 0.00 0.00 60.65 62.02 2iz4 s ILE 44 Cb -0.10 -3.97 0.03 0.00 0.01 0.00 0.00 42.46 38.44 2iz4 s ILE 44 CO -0.19 0.31 0.08 -0.44 0.00 0.00 0.00 174.94 174.69 2iz4 s SER 45 N -1.48 5.15 0.02 3.58 0.01 -0.75 -0.79 113.70 119.44 2iz4 s SER 45 Ca 0.41 -1.04 0.04 0.00 1.31 0.00 0.00 55.95 56.67 2iz4 s SER 45 Cb -0.19 -1.84 -0.03 0.00 0.21 0.00 0.00 66.02 64.17 2iz4 s SER 45 CO 0.23 -0.27 -0.08 0.00 0.41 0.00 0.00 173.24 173.53 2iz4 s ASN 48 N -1.11 7.14 0.00 0.00 2.47 -1.25 -0.93 114.94 121.27 2iz4 s ASN 48 Ca -0.12 1.38 0.23 0.00 0.42 0.00 0.00 52.86 54.77 2iz4 s ASN 48 Cb -0.07 -2.47 0.47 0.00 -1.45 0.00 0.00 41.25 37.73 2iz4 s ASN 48 CO 0.01 -0.16 1.42 0.35 -3.72 0.00 0.00 177.10 175.00 2iz4 n THR 49 N 3.75 0.49 -2.85 -5.21 -2.24 -1.25 -4.91 114.28 102.06 2iz4 n THR 49 Ca 0.01 -0.71 -0.42 0.00 -2.27 0.00 0.00 64.05 60.67 2iz4 n THR 49 Cb 0.51 0.89 -0.04 0.00 -2.10 0.00 0.00 70.33 69.59 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 -1.51 3.48 0.31 6.98 0.00 -1.26 -5.01 121.76 124.75 2iz4 s ALA 50 Ca 0.38 0.12 -0.29 0.00 0.00 0.00 0.00 51.96 52.17 2iz4 s ALA 50 Cb 0.22 -3.27 -0.12 0.00 0.00 0.00 0.00 23.12 19.96 2iz4 s ALA 50 CO 0.31 -0.61 1.54 0.00 0.00 0.00 0.00 175.76 176.99 2iz4 n ALA 51 N 5.12 2.32 -3.07 0.00 0.00 -1.26 -4.91 120.51 118.71 2iz4 n ALA 51 Ca 0.05 0.37 -0.43 0.00 0.00 0.00 0.00 53.44 53.43 2iz4 n ALA 51 Cb 0.49 -2.43 -0.08 0.00 0.00 0.00 0.00 19.45 17.43 2iz4 n ALA 51 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2iz4 s ILE 52 N -0.35 4.90 0.70 0.00 -1.09 -0.33 -4.39 121.20 120.64 2iz4 s ILE 52 Ca 0.61 -1.25 -0.16 0.00 -2.23 0.00 0.00 60.65 57.63 2iz4 s ILE 52 Cb -0.51 -3.99 0.02 0.00 -1.58 0.00 0.00 42.46 36.41 2iz4 s ILE 52 CO 0.53 -0.61 1.21 -2.16 -1.23 0.00 0.00 174.94 172.69 2iz4 s PRO 53 N 1.56 2.35 0.23 2.79 0.04 -1.26 -1.62 135.00 139.08 2iz4 s PRO 53 Ca 0.04 1.78 -0.07 0.00 0.04 0.00 0.00 61.00 62.79 2iz4 s PRO 53 Cb -0.25 -1.86 -0.02 0.00 0.04 0.00 0.00 34.50 32.42 2iz4 s PRO 53 CO 0.05 -1.68 0.32 0.95 0.04 0.00 0.00 177.00 176.67 2iz4 s THR 54 N -1.88 0.00 0.00 1.26 -4.23 -1.23 -4.89 115.64 104.66 2iz4 s THR 54 Ca 0.75 -1.70 0.00 0.00 -1.18 0.00 0.00 61.69 59.57 2iz4 s THR 54 Cb -0.30 -2.36 0.00 0.00 1.34 0.00 0.00 72.50 71.18 2iz4 s THR 54 CO 0.43 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.12 2iz4 n GLY 55 N -0.34 0.84 3.87 3.99 0.00 -1.26 0.07 105.19 112.36 2iz4 n GLY 55 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.32 3.15 -0.68 1.61 -0.85 -1.10 -4.64 117.35 111.52 2iz4 s TYR 56 Ca 0.00 1.00 -0.26 0.00 -0.52 0.00 0.00 57.07 57.29 2iz4 s TYR 56 Cb 0.00 -3.17 -0.08 0.00 0.38 0.00 0.00 41.96 39.09 2iz4 s TYR 56 CO 0.00 -1.43 2.24 -0.51 -1.52 0.00 0.00 175.55 174.33 2iz4 s ASP 57 N -4.31 4.51 0.54 -0.18 1.01 -1.26 -4.74 116.67 112.24 2iz4 s ASP 57 Ca 0.59 0.33 0.34 0.00 0.71 0.00 0.00 52.55 54.53 2iz4 s ASP 57 Cb -0.12 -2.53 1.42 0.00 1.01 0.00 0.00 42.92 42.70 2iz4 s ASP 57 CO 0.52 -3.10 1.99 0.71 0.21 0.00 0.00 175.17 175.50 2iz4 h THR 58 N 7.48 0.00 -0.01 -1.27 1.35 -1.90 2.76 112.91 121.32 2iz4 h THR 58 Ca -0.11 -0.45 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 2iz4 h THR 58 Cb 1.12 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.97 2iz4 h THR 58 CO 1.13 0.00 -0.62 0.59 -0.25 0.00 0.00 175.52 176.37 2iz4 n ASN 59 N -3.02 1.23 0.00 5.36 4.13 -1.26 -4.57 115.26 117.12 2iz4 n ASN 59 Ca 0.00 -1.00 0.00 0.00 1.68 0.00 0.00 54.58 55.26 2iz4 n ASN 59 Cb 0.28 0.55 0.00 0.00 -1.54 0.00 0.00 39.78 39.08 2iz4 n ASN 59 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 2iz4 n LYS 60 N -0.91 0.00 -3.67 3.52 4.81 -0.83 -5.04 118.16 116.05 2iz4 n LYS 60 Ca 0.07 0.00 -0.23 0.00 -0.87 0.00 0.00 58.31 57.28 2iz4 n LYS 60 Cb 0.38 -0.70 -0.01 0.00 0.02 0.00 0.00 35.03 34.72 2iz4 n LYS 60 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2iz4 s GLN 62 N -4.25 1.24 -0.21 0.00 -2.07 -0.74 -4.28 119.66 109.35 2iz4 s GLN 62 Ca 0.43 -1.11 -0.08 0.00 -1.82 0.00 0.00 55.36 52.78 2iz4 s GLN 62 Cb -0.03 0.42 -0.04 0.00 -1.09 0.00 0.00 33.01 32.27 2iz4 s GLN 62 CO 0.26 -0.48 0.10 -1.59 -1.32 0.00 0.00 175.29 172.26 2iz4 s LYS 63 N -3.95 3.95 -0.06 9.60 0.00 -1.26 -2.64 119.74 125.38 2iz4 s LYS 63 Ca 0.16 -0.34 0.02 0.00 0.00 0.00 0.00 55.97 55.80 2iz4 s LYS 63 Cb 0.02 -3.34 0.02 0.00 0.00 0.00 0.00 37.83 34.53 2iz4 s LYS 63 CO -0.00 0.12 -0.10 0.42 0.00 0.00 0.00 175.35 175.79 2iz4 s ILE 64 N 0.82 0.97 -0.30 3.79 1.01 -0.36 -5.01 121.20 122.10 2iz4 s ILE 64 Ca 0.05 -0.37 -0.22 0.00 0.00 0.00 0.00 60.65 60.11 2iz4 s ILE 64 Cb -0.13 -0.91 -0.00 0.00 0.01 0.00 0.00 42.46 41.42 2iz4 s ILE 64 CO 0.02 0.32 0.70 -0.22 0.00 0.00 0.00 174.94 175.77 2iz4 s LEU 65 N 0.81 4.12 0.00 2.97 2.96 -1.26 -1.80 118.68 126.48 2iz4 s LEU 65 Ca -0.12 0.55 -0.30 0.00 -0.22 0.00 0.00 54.13 54.03 2iz4 s LEU 65 Cb -0.15 -2.94 -0.04 0.00 0.50 0.00 0.00 46.19 43.56 2iz4 s LEU 65 CO 0.02 -0.54 1.11 0.21 -1.32 0.00 0.00 176.35 175.83 2iz4 s ASN 66 N 1.62 7.19 0.14 3.68 3.04 0.15 -4.91 114.94 125.85 2iz4 s ASN 66 Ca 0.29 1.81 0.23 0.00 0.04 0.00 0.00 52.86 55.23 2iz4 s ASN 66 Cb -0.15 -2.57 -0.01 0.00 -1.54 0.00 0.00 41.25 36.98 2iz4 s ASN 66 CO 0.12 -0.42 0.99 0.29 -3.04 0.00 0.00 177.10 175.04 2iz4 n LYS 67 N 4.24 0.55 0.35 0.43 4.01 -1.26 -1.68 118.16 124.79 2iz4 n LYS 67 Ca 0.08 0.06 -0.18 0.00 -0.51 0.00 0.00 58.31 57.76 2iz4 n LYS 67 Cb 0.48 -1.74 -0.09 0.00 -0.51 0.00 0.00 35.03 33.17 2iz4 n LYS 67 CO 0.00 0.00 0.00 0.87 -1.11 0.00 0.00 177.40 177.16 2iz4 h LYS 68 N 0.00 -0.90 -0.01 1.97 1.57 -1.96 -3.27 116.57 113.97 2iz4 h LYS 68 Ca 0.00 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2iz4 h LYS 68 Cb 0.94 0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2iz4 h LYS 68 CO 0.00 -0.60 -0.26 0.25 -0.57 0.00 0.00 179.45 178.27 2iz4 n THR 69 N -5.51 0.00 -2.86 -0.16 -2.24 -1.26 -5.01 114.28 97.23 2iz4 n THR 69 Ca -0.13 -0.37 -0.12 0.00 -2.27 0.00 0.00 64.05 61.16 2iz4 n THR 69 Cb 0.40 1.21 0.05 0.00 -2.10 0.00 0.00 70.33 69.90 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 -3.30 0.06 0.33 0.00 2.01 -0.90 -4.87 115.64 108.98 2iz4 s THR 71 Ca 0.33 -0.50 -0.20 0.00 0.31 0.00 0.00 61.69 61.63 2iz4 s THR 71 Cb -0.04 -0.41 -0.10 0.00 0.01 0.00 0.00 72.50 71.96 2iz4 s THR 71 CO 0.57 -0.28 0.84 -0.31 -0.69 0.00 0.00 174.62 174.75 2iz4 s TYR 72 N -1.02 3.48 0.04 4.92 2.02 -1.26 -0.68 117.35 124.85 2iz4 s TYR 72 Ca -0.11 1.49 -0.08 0.00 -0.37 0.00 0.00 57.07 58.00 2iz4 s TYR 72 Cb -0.06 -2.73 -0.00 0.00 -0.40 0.00 0.00 41.96 38.77 2iz4 s TYR 72 CO 0.02 0.11 0.15 -0.08 -1.57 0.00 0.00 175.55 174.18 2iz4 s THR 73 N -1.87 0.12 -0.07 -0.71 -1.32 -0.74 -4.92 115.64 106.13 2iz4 s THR 73 Ca 0.53 -0.99 0.02 0.00 -1.21 0.00 0.00 61.69 60.04 2iz4 s THR 73 Cb -0.13 -0.92 0.02 0.00 -1.51 0.00 0.00 72.50 69.96 2iz4 s THR 73 CO 0.18 -0.54 -0.10 -0.69 -2.21 0.00 0.00 174.62 171.25 2iz4 s VAL 74 N -2.63 1.04 0.13 5.08 1.01 -1.26 -1.23 120.40 122.54 2iz4 s VAL 74 Ca -0.05 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.55 2iz4 s VAL 74 Cb -0.01 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 2iz4 s VAL 74 CO -0.04 0.34 -0.02 0.68 0.00 0.00 0.00 175.10 176.05 2iz4 s VAL 75 N 0.86 0.61 0.30 2.92 -7.23 -1.08 -2.46 120.40 114.31 2iz4 s VAL 75 Ca -0.11 -1.95 -0.29 0.00 -1.81 0.00 0.00 61.98 57.82 2iz4 s VAL 75 Cb -0.15 -1.91 -0.10 0.00 0.56 0.00 0.00 36.38 34.78 2iz4 s VAL 75 CO 0.01 -0.66 1.26 -1.61 -0.31 0.00 0.00 175.10 173.79 2iz4 s GLU 76 N -3.90 4.43 0.21 4.82 2.02 -0.70 -1.79 118.70 123.78 2iz4 s GLU 76 Ca 0.18 2.10 -0.10 0.00 0.02 0.00 0.00 54.97 57.18 2iz4 s GLU 76 Cb 0.06 -3.12 0.22 0.00 0.10 0.00 0.00 34.13 31.40 2iz4 s GLU 76 CO -0.00 -0.11 1.81 0.87 0.02 0.00 0.00 175.26 177.85 2iz4 h LYS 77 N 3.77 0.67 0.00 1.61 1.57 -0.12 -1.32 116.57 122.75 2iz4 h LYS 77 Ca -0.48 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.16 2iz4 h LYS 77 Cb 1.22 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.37 2iz4 h LYS 77 CO 0.68 0.44 -0.48 0.87 -0.57 0.00 0.00 179.45 180.39 2iz4 h LYS 78 N 0.69 0.00 -3.77 3.15 1.79 -1.92 -3.39 116.57 113.12 2iz4 h LYS 78 Ca 0.29 0.00 -0.63 0.00 -2.18 0.00 0.00 60.65 58.12 2iz4 h LYS 78 Cb 0.16 0.00 -0.40 0.00 -1.58 0.00 0.00 32.23 30.40 2iz4 h LYS 78 CO -0.17 0.48 -0.70 0.34 -1.08 0.00 0.00 179.45 178.33 2iz4 s ASP 79 N -6.46 4.31 0.00 0.86 -1.08 -0.52 -4.94 116.67 108.84 2iz4 s ASP 79 Ca 0.02 -2.48 0.27 0.00 -0.52 0.00 0.00 52.55 49.84 2iz4 s ASP 79 Cb 0.09 -1.42 1.55 0.00 -1.46 0.00 0.00 42.92 41.68 2iz4 s ASP 79 CO 0.72 -0.31 2.00 -0.81 0.52 0.00 0.00 175.17 177.30 2iz4 n PRO 80 N 3.80 1.04 -0.10 4.34 -0.04 -1.09 -1.72 135.00 141.21 2iz4 n PRO 80 Ca 0.04 -0.05 0.06 0.00 -0.04 0.00 0.00 63.50 63.51 2iz4 n PRO 80 Cb 0.37 -1.42 0.12 0.00 -0.04 0.00 0.00 33.50 32.53 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 0.93 1.29 3.17 0.55 0.00 -1.26 -4.92 105.19 104.94 2iz4 n GLY 81 Ca 0.20 -0.41 -0.19 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.04 0.86 0.61 1.61 -0.14 -1.17 -5.08 119.74 115.38 2iz4 s LYS 82 Ca 0.21 -0.91 -0.07 0.00 -1.36 0.00 0.00 55.97 53.84 2iz4 s LYS 82 Cb 0.12 -0.87 0.00 0.00 -1.68 0.00 0.00 37.83 35.41 2iz4 s LYS 82 CO 0.17 0.20 0.94 0.95 -0.76 0.00 0.00 175.35 176.86 2iz4 s THR 83 N -1.16 3.79 0.00 2.17 -4.23 -1.26 -2.26 115.64 112.69 2iz4 s THR 83 Ca -0.01 0.18 0.00 0.00 -1.18 0.00 0.00 61.69 60.68 2iz4 s THR 83 Cb -0.09 -3.52 0.00 0.00 1.34 0.00 0.00 72.50 70.23 2iz4 s THR 83 CO 0.02 -0.58 0.00 0.00 -0.54 0.00 0.00 174.62 173.53 2iz4 s ASP 85 N -0.26 -0.43 -0.01 0.00 2.15 -1.26 -5.07 116.67 111.79 2iz4 s ASP 85 Ca 0.00 0.82 0.05 0.00 0.43 0.00 0.00 52.55 53.84 2iz4 s ASP 85 Cb 0.00 0.82 -0.01 0.00 -0.30 0.00 0.00 42.92 43.43 2iz4 s ASP 85 CO 0.00 -0.14 -0.15 0.68 -0.17 0.00 0.00 175.17 175.39 2iz4 s VAL 86 N 0.28 1.19 -1.03 1.11 -7.23 -1.26 -2.71 120.40 110.75 2iz4 s VAL 86 Ca -0.01 -0.64 0.22 0.00 -1.81 0.00 0.00 61.98 59.75 2iz4 s VAL 86 Cb -0.03 -1.00 -0.14 0.00 0.56 0.00 0.00 36.38 35.77 2iz4 s VAL 86 CO -0.00 0.34 1.08 1.07 -0.31 0.00 0.00 175.10 177.28 2iz4 n THR 87 N 2.77 0.00 0.00 5.32 5.66 0.11 -4.96 114.28 123.17 2iz4 n THR 87 Ca -0.15 -0.01 0.00 0.00 -3.05 0.00 0.00 64.05 60.85 2iz4 n THR 87 Cb 0.55 0.75 0.00 0.00 -1.55 0.00 0.00 70.33 70.08 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 1.50 3.17 3.87 1.09 0.00 -1.25 -5.02 105.19 108.55 2iz4 n GLY 88 Ca 0.05 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 2iz4 n GLY 88 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2iz4 s TRP 89 N 0.00 1.68 -0.02 1.61 1.48 -1.26 -3.55 118.94 118.88 2iz4 s TRP 89 Ca 0.00 0.44 -0.05 0.00 -1.06 0.00 0.00 56.10 55.44 2iz4 s TRP 89 Cb 0.00 -3.88 0.01 0.00 -1.16 0.00 0.00 33.47 28.43 2iz4 s TRP 89 CO 0.00 -2.70 0.11 0.08 -4.06 0.00 0.00 176.95 170.38 2iz4 s VAL 90 N -3.67 0.04 0.00 -0.66 1.01 -0.64 -4.89 120.40 111.58 2iz4 s VAL 90 Ca 0.71 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.40 2iz4 s VAL 90 Cb -0.06 -0.26 0.00 0.00 0.00 0.00 0.00 36.38 36.06 2iz4 s VAL 90 CO 0.53 -0.16 0.00 -0.11 0.00 0.00 0.00 175.10 175.36