#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iz3 s TYR 3 N -1.00 -0.07 0.19 0.00 -0.85 -1.09 -5.01 117.35 109.52 2iz3 s TYR 3 Ca 0.16 0.11 -0.24 0.00 -0.52 0.00 0.00 57.07 56.57 2iz3 s TYR 3 Cb -0.11 0.02 -0.08 0.00 0.38 0.00 0.00 41.96 42.17 2iz3 s TYR 3 CO 0.07 -0.28 0.78 -0.06 -1.52 0.00 0.00 175.55 174.54 2iz3 s PHE 4 N -1.09 3.85 -0.02 -3.49 0.08 -1.26 -2.90 117.98 113.14 2iz3 s PHE 4 Ca -0.12 1.60 0.06 0.00 0.12 0.00 0.00 56.93 58.60 2iz3 s PHE 4 Cb -0.06 -2.75 -0.01 0.00 -0.57 0.00 0.00 43.02 39.62 2iz3 s PHE 4 CO 0.02 0.46 -0.21 0.42 -0.10 0.00 0.00 175.22 175.81 2iz3 s ILE 5 N -1.25 1.67 0.86 0.64 -1.09 0.12 -5.00 121.20 117.16 2iz3 s ILE 5 Ca 0.38 -0.89 -0.11 0.00 -2.23 0.00 0.00 60.65 57.80 2iz3 s ILE 5 Cb -0.22 -1.40 0.11 0.00 -1.58 0.00 0.00 42.46 39.37 2iz3 s ILE 5 CO 0.25 0.47 1.11 -2.16 -1.23 0.00 0.00 174.94 173.38 2iz3 s PRO 6 N -0.39 1.50 0.24 2.79 0.04 -1.26 0.05 135.00 137.98 2iz3 s PRO 6 Ca 0.05 1.23 0.21 0.00 0.04 0.00 0.00 61.00 62.53 2iz3 s PRO 6 Cb -0.09 -1.81 0.94 0.00 0.04 0.00 0.00 34.50 33.58 2iz3 s PRO 6 CO 0.00 -2.19 1.63 -1.71 0.04 0.00 0.00 177.00 174.77 2iz3 n ASN 7 N -3.90 0.53 0.08 6.66 2.85 -1.24 -2.75 115.26 117.49 2iz3 n ASN 7 Ca 0.09 0.67 -0.12 0.00 -0.11 0.00 0.00 54.58 55.11 2iz3 n ASN 7 Cb 0.53 -0.77 -0.05 0.00 1.24 0.00 0.00 39.78 40.73 2iz3 n ASN 7 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 2iz3 h GLU 8 N 0.00 -0.28 0.00 1.20 4.81 -1.89 -3.15 114.58 115.26 2iz3 h GLU 8 Ca 0.00 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2iz3 h GLU 8 Cb 0.23 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2iz3 h GLU 8 CO 0.00 -0.19 0.00 0.41 -0.73 0.00 0.00 179.01 178.50 2iz3 n GLY 9 N -1.29 -1.29 3.62 1.92 0.00 -1.11 -1.04 105.19 106.00 2iz3 n GLY 9 Ca -0.06 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.67 2iz3 n GLY 9 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2iz3 s VAL 10 N -3.00 3.57 -0.42 1.61 -7.23 -1.26 -4.27 120.40 109.40 2iz3 s VAL 10 Ca 0.00 -1.29 -0.45 0.00 -1.81 0.00 0.00 61.98 58.43 2iz3 s VAL 10 Cb 0.00 -2.72 -0.19 0.00 0.56 0.00 0.00 36.38 34.03 2iz3 s VAL 10 CO 0.00 0.04 1.61 -2.65 -0.31 0.00 0.00 175.10 173.79 2iz3 n PRO 11 N 0.40 0.28 -2.21 4.82 -0.02 -1.26 -0.11 135.00 136.90 2iz3 n PRO 11 Ca -0.12 0.10 -0.04 0.00 -2.02 0.00 0.00 63.50 61.42 2iz3 n PRO 11 Cb 0.53 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 2iz3 n PRO 11 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2iz3 n GLY 12 N 3.93 0.29 3.93 -1.23 0.00 -1.26 -5.05 105.19 105.80 2iz3 n GLY 12 Ca 0.29 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 45.37 2iz3 n GLY 12 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2iz3 s ASP 13 N -2.86 4.03 0.00 1.61 -4.77 0.84 -5.02 116.67 110.49 2iz3 s ASP 13 Ca 0.02 0.37 0.00 0.00 -3.30 0.00 0.00 52.55 49.64 2iz3 s ASP 13 Cb -0.01 -0.71 0.00 0.00 -1.09 0.00 0.00 42.92 41.11 2iz3 s ASP 13 CO 0.03 -2.14 0.00 -1.54 0.70 0.00 0.00 175.17 172.22 2iz3 n SER 14 N -3.34 0.00 -0.01 2.11 3.41 -1.26 -4.88 113.62 109.66 2iz3 n SER 14 Ca 0.12 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.83 2iz3 n SER 14 Cb 0.60 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.40 2iz3 n SER 14 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2iz3 n THR 15 N -0.03 0.00 -2.77 6.66 -2.24 -1.26 -5.08 114.28 109.56 2iz3 n THR 15 Ca 0.00 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 2iz3 n THR 15 Cb 0.00 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 2iz3 n THR 15 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2iz3 n ARG 16 N -2.06 0.00 -0.45 -0.78 1.74 -1.26 -4.95 116.66 108.90 2iz3 n ARG 16 Ca -0.02 0.00 0.06 0.00 -0.77 0.00 0.00 57.85 57.12 2iz3 n ARG 16 Cb 0.50 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.93 2iz3 n ARG 16 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2iz3 n LYS 17 N -0.66 -0.91 -1.90 5.56 5.02 -0.20 -4.12 118.16 120.95 2iz3 n LYS 17 Ca 0.00 0.60 -0.38 0.00 -2.02 0.00 0.00 58.31 56.51 2iz3 n LYS 17 Cb 0.00 -1.11 0.04 0.00 -0.02 0.00 0.00 35.03 33.94 2iz3 n LYS 17 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2iz3 s MET 19 N -3.98 3.17 0.89 0.00 0.00 -1.26 -4.11 119.30 114.01 2iz3 s MET 19 Ca 0.53 -0.61 -0.12 0.00 0.00 0.00 0.00 55.69 55.49 2iz3 s MET 19 Cb 0.44 -2.66 0.13 0.00 0.00 0.00 0.00 34.83 32.74 2iz3 s MET 19 CO -0.33 0.39 1.12 0.34 0.00 0.00 0.00 175.02 176.54 2iz3 s ASP 20 N -0.09 3.66 0.45 1.11 2.15 -1.25 -4.94 116.67 117.77 2iz3 s ASP 20 Ca -0.00 1.10 0.16 0.00 0.43 0.00 0.00 52.55 54.24 2iz3 s ASP 20 Cb -0.13 -1.74 1.04 0.00 -0.30 0.00 0.00 42.92 41.79 2iz3 s ASP 20 CO 0.03 -2.47 1.99 -0.07 -0.17 0.00 0.00 175.17 174.48 2iz3 h LEU 21 N -1.44 0.00 -0.78 -1.34 4.07 -1.97 -2.39 115.31 111.46 2iz3 h LEU 21 Ca -0.50 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.38 2iz3 h LEU 21 Cb 1.31 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.03 2iz3 h LEU 21 CO 0.60 0.19 0.06 0.11 -1.08 0.00 0.00 178.44 178.32 2iz3 h LYS 22 N 0.00 0.98 0.00 1.13 1.79 -1.96 -3.46 116.57 115.05 2iz3 h LYS 22 Ca -0.00 -0.27 0.00 0.00 -2.18 0.00 0.00 60.65 58.20 2iz3 h LYS 22 Cb 0.36 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 30.90 2iz3 h LYS 22 CO 0.03 0.93 0.00 0.41 -1.08 0.00 0.00 179.45 179.74 2iz3 n GLY 23 N -0.59 1.50 3.36 3.86 0.00 -0.90 -5.09 105.19 107.33 2iz3 n GLY 23 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2iz3 n GLY 23 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2iz3 s ASN 24 N -2.00 5.78 0.29 1.61 3.04 -1.26 -4.92 114.94 117.48 2iz3 s ASN 24 Ca 0.00 -1.11 -0.29 0.00 0.04 0.00 0.00 52.86 51.50 2iz3 s ASN 24 Cb 0.00 -2.04 -0.10 0.00 -1.54 0.00 0.00 41.25 37.57 2iz3 s ASN 24 CO 0.00 -0.44 1.30 -0.75 -3.04 0.00 0.00 177.10 174.17 2iz3 s LYS 25 N 1.55 4.38 -0.39 0.43 2.20 -1.26 -3.77 119.74 122.88 2iz3 s LYS 25 Ca 0.02 2.15 0.00 0.00 -0.36 0.00 0.00 55.97 57.79 2iz3 s LYS 25 Cb -0.20 -3.11 0.11 0.00 -1.51 0.00 0.00 37.83 33.11 2iz3 s LYS 25 CO 0.06 -0.19 0.15 -3.38 -0.36 0.00 0.00 175.35 171.63 2iz3 s HIS 26 N -0.74 3.64 0.65 4.03 0.00 -1.26 -5.03 115.29 116.59 2iz3 s HIS 26 Ca 0.51 -2.71 -0.07 0.00 -3.00 0.00 0.00 55.06 49.79 2iz3 s HIS 26 Cb -0.39 -3.08 0.11 0.00 -4.00 0.00 0.00 32.58 25.22 2iz3 s HIS 26 CO 0.47 -0.95 0.26 -2.30 -1.00 0.00 0.00 174.74 171.22 2iz3 n PRO 27 N 4.34 -0.49 -2.21 -0.38 -0.02 -1.26 -4.59 135.00 130.40 2iz3 n PRO 27 Ca 0.01 -0.43 -0.40 0.00 -2.02 0.00 0.00 63.50 60.66 2iz3 n PRO 27 Cb 0.41 -0.99 -0.02 0.00 -0.02 0.00 0.00 33.50 32.88 2iz3 n PRO 27 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2iz3 s ILE 28 N -1.58 2.91 0.00 4.25 -1.09 -1.26 -2.24 121.20 122.19 2iz3 s ILE 28 Ca 0.20 0.91 0.00 0.00 -2.23 0.00 0.00 60.65 59.52 2iz3 s ILE 28 Cb -0.03 -3.57 0.00 0.00 -1.58 0.00 0.00 42.46 37.27 2iz3 s ILE 28 CO 0.17 0.20 0.00 0.59 -1.23 0.00 0.00 174.94 174.67 2iz3 n ASN 29 N 0.80 -0.88 -4.76 3.58 3.02 -1.05 -5.00 115.26 110.96 2iz3 n ASN 29 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.18 2iz3 n ASN 29 Cb 0.43 -0.55 -0.06 0.00 -0.61 0.00 0.00 39.78 38.98 2iz3 n ASN 29 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2iz3 s SER 30 N -2.63 6.63 0.01 6.41 0.15 -0.95 -4.98 113.70 118.34 2iz3 s SER 30 Ca 0.00 0.75 0.05 0.00 0.70 0.00 0.00 55.95 57.45 2iz3 s SER 30 Cb 0.00 -2.23 -0.03 0.00 -1.71 0.00 0.00 66.02 62.05 2iz3 s SER 30 CO 0.00 0.15 -0.15 -1.61 1.20 0.00 0.00 173.24 172.83 2iz3 s GLU 31 N -0.01 2.29 0.01 5.44 2.02 -1.26 -3.25 118.70 123.94 2iz3 s GLU 31 Ca 0.22 -0.85 -0.04 0.00 0.02 0.00 0.00 54.97 54.32 2iz3 s GLU 31 Cb -0.15 -2.30 -0.01 0.00 0.10 0.00 0.00 34.13 31.77 2iz3 s GLU 31 CO 0.09 0.57 0.05 1.67 0.02 0.00 0.00 175.26 177.66 2iz3 s TRP 32 N -0.89 0.17 -0.07 1.61 -2.14 -0.95 -5.00 118.94 111.67 2iz3 s TRP 32 Ca 0.14 -0.37 -0.11 0.00 2.66 0.00 0.00 56.10 58.42 2iz3 s TRP 32 Cb -0.11 -0.13 -0.05 0.00 -3.10 0.00 0.00 33.47 30.08 2iz3 s TRP 32 CO 0.05 -0.25 0.28 -1.14 -2.66 0.00 0.00 176.95 173.23 2iz3 s GLN 33 N -1.57 3.76 0.18 3.25 0.74 -1.26 -1.71 119.66 123.06 2iz3 s GLN 33 Ca -0.14 0.14 0.01 0.00 0.05 0.00 0.00 55.36 55.42 2iz3 s GLN 33 Cb -0.08 -3.23 -0.05 0.00 1.10 0.00 0.00 33.01 30.75 2iz3 s GLN 33 CO -0.00 0.67 0.05 -0.08 -0.55 0.00 0.00 175.29 175.38 2iz3 s THR 34 N -0.86 0.43 0.00 -0.34 -1.32 -0.28 -4.98 115.64 108.29 2iz3 s THR 34 Ca 0.19 -1.97 0.00 0.00 -1.21 0.00 0.00 61.69 58.70 2iz3 s THR 34 Cb -0.14 -2.26 0.00 0.00 -1.51 0.00 0.00 72.50 68.58 2iz3 s THR 34 CO 0.08 -0.31 0.00 0.47 -2.21 0.00 0.00 174.62 172.65 2iz3 n ASP 35 N -0.26 0.00 0.00 8.08 8.00 -1.26 -3.76 116.55 127.35 2iz3 n ASP 35 Ca -0.04 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.46 2iz3 n ASP 35 Cb 0.64 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.74 2iz3 n ASP 35 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2iz3 n ASN 36 N 1.12 0.00 -2.95 -2.24 0.23 -1.26 -4.99 115.26 105.16 2iz3 n ASN 36 Ca 0.00 0.00 -0.17 0.00 -0.53 0.00 0.00 54.58 53.88 2iz3 n ASN 36 Cb 0.00 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 37.77 2iz3 n ASN 36 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2iz3 s GLU 38 N -5.63 0.36 -0.04 0.00 2.02 -1.25 -3.90 118.70 110.26 2iz3 s GLU 38 Ca 0.27 0.59 0.02 0.00 0.02 0.00 0.00 54.97 55.86 2iz3 s GLU 38 Cb -0.12 0.06 0.01 0.00 0.10 0.00 0.00 34.13 34.19 2iz3 s GLU 38 CO 0.58 -0.11 -0.07 0.99 0.02 0.00 0.00 175.26 176.68 2iz3 s THR 39 N 0.78 0.66 0.23 3.63 2.01 -0.27 -1.13 115.64 121.56 2iz3 s THR 39 Ca -0.05 -0.24 0.10 0.00 0.31 0.00 0.00 61.69 61.81 2iz3 s THR 39 Cb -0.06 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 2iz3 s THR 39 CO -0.06 0.23 -0.10 0.00 -0.69 0.00 0.00 174.62 174.01 2iz3 s THR 41 N -2.11 1.10 -0.21 0.00 2.01 -0.52 -2.25 115.64 113.66 2iz3 s THR 41 Ca 0.28 -0.47 -0.21 0.00 0.31 0.00 0.00 61.69 61.60 2iz3 s THR 41 Cb -0.07 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.42 2iz3 s THR 41 CO 0.16 0.34 0.63 0.00 -0.69 0.00 0.00 174.62 175.07 2iz3 s TYR 43 N 2.04 1.51 0.18 0.00 2.02 0.83 -2.52 117.35 121.41 2iz3 s TYR 43 Ca 0.28 -0.89 -0.22 0.00 -0.37 0.00 0.00 57.07 55.87 2iz3 s TYR 43 Cb -0.16 -1.87 0.09 0.00 -0.40 0.00 0.00 41.96 39.63 2iz3 s TYR 43 CO 0.10 -0.48 1.59 0.93 -1.57 0.00 0.00 175.55 176.12 2iz3 h GLU 44 N 0.74 -0.20 -0.04 -0.62 5.08 -2.00 -3.30 114.58 114.24 2iz3 h GLU 44 Ca -0.37 0.01 -0.19 0.00 -1.00 0.00 0.00 59.36 57.82 2iz3 h GLU 44 Cb 1.31 0.04 -0.39 0.00 0.50 0.00 0.00 28.75 30.22 2iz3 h GLU 44 CO 0.58 -0.13 -1.03 -2.37 -1.00 0.00 0.00 179.01 175.05 2iz3 n THR 45 N -5.42 0.13 -3.61 1.13 5.66 -1.26 -5.06 114.28 105.84 2iz3 n THR 45 Ca 0.03 -1.18 -0.13 0.00 -3.05 0.00 0.00 64.05 59.71 2iz3 n THR 45 Cb 0.34 1.02 -0.06 0.00 -1.55 0.00 0.00 70.33 70.09 2iz3 n THR 45 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 2iz3 s GLU 46 N -0.40 0.99 -0.09 1.09 2.02 -1.25 -3.71 118.70 117.35 2iz3 s GLU 46 Ca 0.33 -0.29 0.02 0.00 0.02 0.00 0.00 54.97 55.04 2iz3 s GLU 46 Cb 0.38 0.45 0.01 0.00 0.10 0.00 0.00 34.13 35.07 2iz3 s GLU 46 CO -0.15 -0.35 -0.14 0.42 0.02 0.00 0.00 175.26 175.06 2iz3 s ILE 47 N -2.46 1.36 0.25 -1.63 1.01 0.11 -0.12 121.20 119.72 2iz3 s ILE 47 Ca -0.05 -0.58 -0.02 0.00 0.00 0.00 0.00 60.65 60.00 2iz3 s ILE 47 Cb -0.01 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.17 2iz3 s ILE 47 CO -0.02 0.41 0.46 -0.55 0.00 0.00 0.00 174.94 175.24 2iz3 s SER 48 N 0.89 6.39 -0.26 3.58 0.15 -0.56 0.13 113.70 124.01 2iz3 s SER 48 Ca -0.09 0.51 -0.02 0.00 0.70 0.00 0.00 55.95 57.04 2iz3 s SER 48 Cb -0.15 -2.05 0.15 0.00 -1.71 0.00 0.00 66.02 62.26 2iz3 s SER 48 CO 0.01 -0.12 0.46 0.00 1.20 0.00 0.00 173.24 174.78 2iz3 n THR 51 N 3.52 0.00 0.00 0.00 5.66 -1.22 -1.12 114.28 121.12 2iz3 n THR 51 Ca -0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 2iz3 n THR 51 Cb 0.53 -0.46 0.00 0.00 -1.55 0.00 0.00 70.33 68.85 2iz3 n THR 51 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2iz3 n LEU 52 N -0.87 0.00 -4.76 1.09 4.77 -1.25 -4.26 117.00 111.71 2iz3 n LEU 52 Ca 0.15 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.78 2iz3 n LEU 52 Cb 0.07 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.19 2iz3 n LEU 52 CO 0.11 0.00 0.80 -0.69 -1.33 0.00 0.00 177.39 176.28 2iz3 s VAL 53 N 0.00 2.88 0.24 4.08 1.01 -1.26 -4.99 120.40 122.36 2iz3 s VAL 53 Ca 0.00 0.51 0.05 0.00 0.00 0.00 0.00 61.98 62.55 2iz3 s VAL 53 Cb 0.00 -3.15 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 2iz3 s VAL 53 CO 0.00 -0.15 0.33 -0.44 0.00 0.00 0.00 175.10 174.84 2iz3 s SER 54 N -1.84 6.20 -0.18 3.32 0.01 -1.26 -4.90 113.70 115.05 2iz3 s SER 54 Ca 0.74 0.02 -0.06 0.00 1.31 0.00 0.00 55.95 57.96 2iz3 s SER 54 Cb -0.27 -1.79 -0.04 0.00 0.21 0.00 0.00 66.02 64.14 2iz3 s SER 54 CO 0.33 -0.06 0.03 -0.89 0.41 0.00 0.00 173.24 173.06 2iz3 s THR 55 N -2.00 4.44 -0.06 1.44 2.01 -0.93 -4.26 115.64 116.28 2iz3 s THR 55 Ca 0.34 -0.16 -0.30 0.00 0.31 0.00 0.00 61.69 61.88 2iz3 s THR 55 Cb -0.09 -2.99 -0.02 0.00 0.01 0.00 0.00 72.50 69.41 2iz3 s THR 55 CO 0.28 0.47 1.03 -2.16 -0.69 0.00 0.00 174.62 173.55 2iz3 s PRO 56 N 0.44 4.45 -0.00 4.92 0.04 -1.26 -2.39 135.00 141.20 2iz3 s PRO 56 Ca 0.01 1.45 -0.07 0.00 0.04 0.00 0.00 61.00 62.42 2iz3 s PRO 56 Cb -0.13 -3.51 0.00 0.00 0.04 0.00 0.00 34.50 30.90 2iz3 s PRO 56 CO 0.01 -0.25 0.14 0.54 0.04 0.00 0.00 177.00 177.48 2iz3 s VAL 57 N 1.71 0.08 0.00 -0.36 0.11 -1.13 -4.90 120.40 115.91 2iz3 s VAL 57 Ca 0.51 -0.66 0.00 0.00 -2.93 0.00 0.00 61.98 58.90 2iz3 s VAL 57 Cb -0.20 -0.42 0.00 0.00 -1.53 0.00 0.00 36.38 34.23 2iz3 s VAL 57 CO 0.22 -0.36 0.00 0.61 -3.33 0.00 0.00 175.10 172.24 2iz3 n GLY 58 N 1.53 0.92 3.13 6.54 0.00 -1.26 -2.78 105.19 113.27 2iz3 n GLY 58 Ca -0.22 -0.56 -0.09 0.00 0.00 0.00 0.00 46.02 45.15 2iz3 n GLY 58 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2iz3 s TYR 59 N -2.61 0.71 -0.74 1.61 1.13 -1.26 -1.88 117.35 114.31 2iz3 s TYR 59 Ca 0.00 -1.03 -0.26 0.00 -1.41 0.00 0.00 57.07 54.37 2iz3 s TYR 59 Cb 0.00 -0.46 -0.02 0.00 -1.10 0.00 0.00 41.96 40.38 2iz3 s TYR 59 CO 0.00 -0.31 1.82 -0.51 -2.51 0.00 0.00 175.55 174.05 2iz3 s ASP 60 N -2.99 5.35 0.20 -0.18 1.01 -1.26 -4.82 116.67 113.99 2iz3 s ASP 60 Ca 0.11 -0.14 -0.10 0.00 0.71 0.00 0.00 52.55 53.13 2iz3 s ASP 60 Cb 0.07 -2.54 0.14 0.00 1.01 0.00 0.00 42.92 41.60 2iz3 s ASP 60 CO -0.06 -2.42 1.83 0.11 0.21 0.00 0.00 175.17 174.84 2iz3 h LYS 61 N 13.13 1.01 -0.31 8.23 1.57 -1.99 0.48 116.57 138.70 2iz3 h LYS 61 Ca -0.12 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.48 2iz3 h LYS 61 Cb 1.09 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 2iz3 h LYS 61 CO 1.23 0.74 -0.08 -0.44 -0.57 0.00 0.00 179.45 180.32 2iz3 h ASP 62 N 1.01 0.60 0.98 0.86 3.32 -2.02 -3.21 116.42 117.97 2iz3 h ASP 62 Ca 0.26 -0.37 -0.17 0.00 0.02 0.00 0.00 57.03 56.77 2iz3 h ASP 62 Cb -0.00 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 2iz3 h ASP 62 CO -0.05 0.84 -0.82 0.78 -1.72 0.00 0.00 179.24 178.27 2iz3 h ASN 63 N 0.36 0.00 -4.37 6.45 -0.26 -1.93 -3.45 115.58 112.39 2iz3 h ASN 63 Ca 0.08 0.00 -0.60 0.00 -0.56 0.00 0.00 56.30 55.21 2iz3 h ASN 63 Cb 0.58 0.00 -0.30 0.00 -1.06 0.00 0.00 38.32 37.54 2iz3 h ASN 63 CO 0.03 0.82 -0.85 0.00 -1.06 0.00 0.00 177.43 176.37 2iz3 s GLN 65 N -0.43 3.04 0.12 0.00 -2.07 -0.87 -4.13 119.66 115.32 2iz3 s GLN 65 Ca 0.06 -0.64 -0.28 0.00 -1.82 0.00 0.00 55.36 52.68 2iz3 s GLN 65 Cb -0.08 -2.58 -0.06 0.00 -1.09 0.00 0.00 33.01 29.19 2iz3 s GLN 65 CO -0.00 0.42 0.88 -0.98 -1.32 0.00 0.00 175.29 174.29 2iz3 s ARG 66 N -0.18 4.65 -0.06 9.60 1.70 -1.26 -3.13 118.95 130.26 2iz3 s ARG 66 Ca 0.01 1.32 0.05 0.00 -0.47 0.00 0.00 55.73 56.64 2iz3 s ARG 66 Cb -0.13 -3.35 -0.01 0.00 -0.57 0.00 0.00 34.95 30.90 2iz3 s ARG 66 CO 0.03 0.32 -0.23 0.42 -1.08 0.00 0.00 175.30 174.76 2iz3 s ILE 67 N -0.32 1.90 -0.18 4.99 1.01 0.61 -4.97 121.20 124.24 2iz3 s ILE 67 Ca 0.42 -0.97 -0.22 0.00 0.00 0.00 0.00 60.65 59.89 2iz3 s ILE 67 Cb -0.23 -1.62 -0.02 0.00 0.01 0.00 0.00 42.46 40.60 2iz3 s ILE 67 CO 0.28 0.53 0.67 0.12 0.00 0.00 0.00 174.94 176.54 2iz3 s PHE 68 N -0.01 3.40 -0.37 3.97 5.36 -1.26 -2.39 117.98 126.69 2iz3 s PHE 68 Ca -0.07 1.02 0.03 0.00 -0.96 0.00 0.00 56.93 56.96 2iz3 s PHE 68 Cb -0.14 -2.84 0.11 0.00 -0.34 0.00 0.00 43.02 39.80 2iz3 s PHE 68 CO 0.04 -0.16 0.09 0.15 -1.46 0.00 0.00 175.22 173.89 2iz3 s LYS 69 N 1.85 1.44 0.20 10.12 3.01 -1.06 -4.98 119.74 130.32 2iz3 s LYS 69 Ca 0.31 -1.88 -0.08 0.00 -1.01 0.00 0.00 55.97 53.32 2iz3 s LYS 69 Cb -0.16 -3.02 0.12 0.00 -1.01 0.00 0.00 37.83 33.76 2iz3 s LYS 69 CO 0.11 -0.98 1.68 1.57 0.51 0.00 0.00 175.35 178.24 2iz3 h LYS 70 N 7.48 1.05 -0.96 1.68 2.10 -1.96 -0.64 116.57 125.32 2iz3 h LYS 70 Ca -0.06 -0.31 0.27 0.00 -2.00 0.00 0.00 60.65 58.55 2iz3 h LYS 70 Cb 1.00 -0.11 -0.05 0.00 -0.90 0.00 0.00 32.23 32.17 2iz3 h LYS 70 CO 0.54 1.00 0.68 1.49 -2.00 0.00 0.00 179.45 181.16 2iz3 h GLU 71 N 0.97 0.08 -0.08 0.07 4.81 -1.96 0.16 114.58 118.63 2iz3 h GLU 71 Ca 0.18 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 2iz3 h GLU 71 Cb 0.51 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.87 2iz3 h GLU 71 CO 0.02 0.05 0.00 -0.25 -0.73 0.00 0.00 179.01 178.10 2iz3 n ASP 72 N -4.31 2.19 -3.94 1.04 8.00 -1.11 -5.02 116.55 113.39 2iz3 n ASP 72 Ca 0.20 -1.97 -0.37 0.00 0.71 0.00 0.00 54.79 53.37 2iz3 n ASP 72 Cb 0.98 -0.05 0.01 0.00 -0.02 0.00 0.00 41.12 42.04 2iz3 n ASP 72 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2iz3 s LYS 74 N -6.35 1.05 -0.12 0.00 -2.85 -0.97 -4.42 119.74 106.08 2iz3 s LYS 74 Ca 0.28 -0.25 -0.04 0.00 -1.00 0.00 0.00 55.97 54.97 2iz3 s LYS 74 Cb -0.16 0.49 -0.03 0.00 -2.06 0.00 0.00 37.83 36.06 2iz3 s LYS 74 CO 0.90 -0.43 0.02 0.71 0.10 0.00 0.00 175.35 176.64 2iz3 s TYR 75 N -2.91 3.19 0.03 1.78 2.02 -1.26 -2.55 117.35 117.65 2iz3 s TYR 75 Ca -0.00 0.13 0.06 0.00 -0.37 0.00 0.00 57.07 56.88 2iz3 s TYR 75 Cb -0.01 -1.88 -0.02 0.00 -0.40 0.00 0.00 41.96 39.65 2iz3 s TYR 75 CO -0.07 0.36 -0.17 0.96 -1.57 0.00 0.00 175.55 175.07 2iz3 s ILE 76 N -0.49 1.32 -0.11 2.71 -4.36 -1.01 -4.87 121.20 114.39 2iz3 s ILE 76 Ca 0.09 -1.01 0.03 0.00 -0.26 0.00 0.00 60.65 59.50 2iz3 s ILE 76 Cb -0.12 -1.16 0.01 0.00 1.25 0.00 0.00 42.46 42.44 2iz3 s ILE 76 CO 0.02 0.13 -0.21 0.68 0.24 0.00 0.00 174.94 175.80 2iz3 s VAL 77 N -0.75 1.92 0.19 8.37 -7.23 -1.26 -0.28 120.40 121.35 2iz3 s VAL 77 Ca 0.04 -0.92 0.05 0.00 -1.81 0.00 0.00 61.98 59.34 2iz3 s VAL 77 Cb -0.08 -1.68 -0.05 0.00 0.56 0.00 0.00 36.38 35.13 2iz3 s VAL 77 CO 0.01 0.53 -0.07 0.68 -0.31 0.00 0.00 175.10 175.94 2iz3 s VAL 78 N 0.59 1.20 0.57 1.32 -7.23 -1.18 0.64 120.40 116.30 2iz3 s VAL 78 Ca -0.14 -2.07 -0.19 0.00 -1.81 0.00 0.00 61.98 57.78 2iz3 s VAL 78 Cb -0.17 -2.06 -0.05 0.00 0.56 0.00 0.00 36.38 34.67 2iz3 s VAL 78 CO 0.04 -0.57 1.14 -1.61 -0.31 0.00 0.00 175.10 173.79 2iz3 s GLU 79 N -3.78 3.20 0.13 4.82 2.02 -1.19 -2.06 118.70 121.84 2iz3 s GLU 79 Ca 0.22 1.62 -0.08 0.00 0.02 0.00 0.00 54.97 56.75 2iz3 s GLU 79 Cb 0.03 -1.98 -0.08 0.00 0.10 0.00 0.00 34.13 32.20 2iz3 s GLU 79 CO 0.04 -0.98 1.34 0.87 0.02 0.00 0.00 175.26 176.56 2iz3 h LYS 80 N 0.97 0.63 -0.48 1.61 1.57 -1.59 -2.33 116.57 116.95 2iz3 h LYS 80 Ca -0.50 -0.54 -0.02 0.00 -1.87 0.00 0.00 60.65 57.72 2iz3 h LYS 80 Cb 1.27 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.67 2iz3 h LYS 80 CO 0.56 1.16 0.21 0.87 -0.57 0.00 0.00 179.45 181.67 2iz3 h LYS 81 N 0.42 0.71 -2.69 3.15 6.56 -1.93 -3.37 116.57 119.42 2iz3 h LYS 81 Ca -0.05 -0.12 -0.60 0.00 -1.06 0.00 0.00 60.65 58.82 2iz3 h LYS 81 Cb 1.41 -0.12 -0.39 0.00 -0.57 0.00 0.00 32.23 32.55 2iz3 h LYS 81 CO 0.15 0.62 -0.83 -0.51 -2.06 0.00 0.00 179.45 176.83 2iz3 s ASP 82 N -5.92 2.92 0.45 0.86 1.01 -1.22 -4.98 116.67 109.79 2iz3 s ASP 82 Ca -0.13 -2.68 0.28 0.00 0.71 0.00 0.00 52.55 50.73 2iz3 s ASP 82 Cb 0.11 -0.70 1.50 0.00 1.01 0.00 0.00 42.92 44.85 2iz3 s ASP 82 CO 0.77 -0.24 1.83 -0.65 0.21 0.00 0.00 175.17 177.08 2iz3 h PRO 83 N 6.45 0.00 -0.71 8.23 0.11 -1.60 -1.99 132.00 142.49 2iz3 h PRO 83 Ca 0.10 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.16 2iz3 h PRO 83 Cb 0.92 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.00 2iz3 h PRO 83 CO 0.39 0.00 0.24 0.87 -0.21 0.00 0.00 178.00 179.29 2iz3 h LYS 84 N 0.00 1.09 -6.75 1.05 1.57 -1.94 -3.44 116.57 108.16 2iz3 h LYS 84 Ca 0.00 -0.22 -0.49 0.00 -1.87 0.00 0.00 60.65 58.07 2iz3 h LYS 84 Cb 0.16 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 2iz3 h LYS 84 CO 0.00 0.92 0.19 0.15 -0.57 0.00 0.00 179.45 180.14 2iz3 s LYS 85 N -5.46 4.25 0.67 3.15 -0.14 -0.75 -5.05 119.74 116.42 2iz3 s LYS 85 Ca -0.12 0.95 -0.09 0.00 -1.36 0.00 0.00 55.97 55.35 2iz3 s LYS 85 Cb 0.14 -2.64 0.02 0.00 -1.68 0.00 0.00 37.83 33.67 2iz3 s LYS 85 CO 0.83 0.25 1.02 0.95 -0.76 0.00 0.00 175.35 177.64 2iz3 s THR 86 N -1.76 3.34 0.17 2.17 -4.23 -1.26 -3.17 115.64 110.91 2iz3 s THR 86 Ca 0.50 0.20 0.06 0.00 -1.18 0.00 0.00 61.69 61.28 2iz3 s THR 86 Cb -0.14 -3.39 -0.04 0.00 1.34 0.00 0.00 72.50 70.26 2iz3 s THR 86 CO 0.19 -0.47 0.06 0.00 -0.54 0.00 0.00 174.62 173.86 2iz3 s SER 88 N -3.03 7.58 -0.03 0.00 1.04 -1.26 -4.87 113.70 113.14 2iz3 s SER 88 Ca 0.29 1.97 0.02 0.00 0.48 0.00 0.00 55.95 58.71 2iz3 s SER 88 Cb -0.10 -2.61 0.01 0.00 0.10 0.00 0.00 66.02 63.42 2iz3 s SER 88 CO 0.21 0.09 -0.08 -0.69 0.98 0.00 0.00 173.24 173.75 2iz3 s VAL 89 N -1.01 0.71 0.14 5.02 1.01 -1.26 -4.33 120.40 120.67 2iz3 s VAL 89 Ca 0.42 -0.30 -0.12 0.00 0.00 0.00 0.00 61.98 61.98 2iz3 s VAL 89 Cb -0.26 -0.64 -0.02 0.00 0.00 0.00 0.00 36.38 35.45 2iz3 s VAL 89 CO 0.33 0.23 1.52 -1.28 0.00 0.00 0.00 175.10 175.90 2iz3 h SER 90 N 6.51 0.91 -5.15 3.32 0.87 -1.26 -3.48 113.55 115.27 2iz3 h SER 90 Ca -0.34 -0.40 0.23 0.00 -1.23 0.00 0.00 61.79 60.06 2iz3 h SER 90 Cb 1.17 -0.25 -0.13 0.00 -0.44 0.00 0.00 62.40 62.75 2iz3 h SER 90 CO 0.49 1.11 0.67 -1.83 -0.53 0.00 0.00 176.83 176.74 2iz3 s GLU 91 N -4.64 0.68 0.07 2.24 -1.05 -1.12 -5.05 118.70 109.82 2iz3 s GLU 91 Ca -0.12 -0.34 0.10 0.00 -0.15 0.00 0.00 54.97 54.46 2iz3 s GLU 91 Cb 0.11 0.26 -0.03 0.00 -0.44 0.00 0.00 34.13 34.02 2iz3 s GLU 91 CO 0.85 -0.31 -0.26 -1.58 0.95 0.00 0.00 175.26 174.91 2iz3 s TRP 92 N -2.79 2.27 -0.22 4.83 0.52 -1.26 -2.83 118.94 119.46 2iz3 s TRP 92 Ca 0.11 -0.40 -0.10 0.00 0.02 0.00 0.00 56.10 55.73 2iz3 s TRP 92 Cb 0.01 -1.33 -0.05 0.00 -1.15 0.00 0.00 33.47 30.96 2iz3 s TRP 92 CO -0.03 0.18 0.13 0.42 0.02 0.00 0.00 176.95 177.66 2iz3 s ILE 93 N -0.87 5.19 0.00 2.03 1.01 -1.01 -4.91 121.20 122.64 2iz3 s ILE 93 Ca 0.12 0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.89 2iz3 s ILE 93 Cb -0.10 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 38.98 2iz3 s ILE 93 CO 0.03 0.39 0.00 0.00 0.00 0.00 0.00 174.94 175.36