#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ibz s ILE 2 N 0.00 4.80 -0.11 0.53 1.09 -1.26 -4.95 121.20 121.29 2ibz s ILE 2 Ca 0.00 0.59 -0.07 0.00 -1.10 0.00 0.00 60.65 60.07 2ibz s ILE 2 Cb 0.00 -3.74 0.04 0.00 -1.06 0.00 0.00 42.46 37.70 2ibz s ILE 2 CO 0.00 -0.53 0.26 -1.83 -0.10 0.00 0.00 174.94 172.74 2ibz s GLU 3 N -3.89 0.25 0.26 2.79 -1.05 -1.26 -4.80 118.70 111.00 2ibz s GLU 3 Ca 0.51 0.49 0.01 0.00 -0.15 0.00 0.00 54.97 55.83 2ibz s GLU 3 Cb -0.10 -0.02 -0.04 0.00 -0.44 0.00 0.00 34.13 33.53 2ibz s GLU 3 CO 0.32 -0.12 0.44 -0.51 0.95 0.00 0.00 175.26 176.34 2ibz s LEU 4 N 0.88 4.17 -0.33 1.83 1.02 -1.26 -1.97 118.68 123.03 2ibz s LEU 4 Ca -0.06 0.36 0.00 0.00 0.02 0.00 0.00 54.13 54.45 2ibz s LEU 4 Cb -0.07 -3.16 0.10 0.00 0.02 0.00 0.00 46.19 43.08 2ibz s LEU 4 CO -0.06 -0.13 0.11 -0.89 0.02 0.00 0.00 176.35 175.40 2ibz s THR 5 N -2.04 1.13 -0.41 5.49 2.01 -0.64 -4.23 115.64 116.96 2ibz s THR 5 Ca 0.38 -1.67 -0.29 0.00 0.31 0.00 0.00 61.69 60.42 2ibz s THR 5 Cb -0.10 -1.85 0.02 0.00 0.01 0.00 0.00 72.50 70.58 2ibz s THR 5 CO 0.31 -0.69 1.23 -1.10 -0.69 0.00 0.00 174.62 173.68 2ibz s GLN 6 N 1.37 3.76 -0.00 4.92 -0.21 -1.26 -3.53 119.66 124.70 2ibz s GLN 6 Ca 0.11 0.84 0.02 0.00 0.02 0.00 0.00 55.36 56.35 2ibz s GLN 6 Cb -0.18 -3.91 -0.01 0.00 1.00 0.00 0.00 33.01 29.91 2ibz s GLN 6 CO -0.20 -1.33 -0.07 -0.08 -2.12 0.00 0.00 175.29 171.49 2ibz s THR 7 N 4.60 0.56 0.60 -0.19 -1.32 -1.18 -3.99 115.64 114.72 2ibz s THR 7 Ca 0.52 -0.34 -0.18 0.00 -1.21 0.00 0.00 61.69 60.49 2ibz s THR 7 Cb -0.11 -0.48 -0.03 0.00 -1.51 0.00 0.00 72.50 70.37 2ibz s THR 7 CO 0.29 0.13 1.16 -2.16 -2.21 0.00 0.00 174.62 171.83 2ibz s PRO 8 N -0.24 2.98 -0.41 7.08 0.04 -1.26 -1.58 135.00 141.61 2ibz s PRO 8 Ca 0.02 1.65 -0.21 0.00 0.04 0.00 0.00 61.00 62.50 2ibz s PRO 8 Cb -0.03 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.58 2ibz s PRO 8 CO -0.00 -1.16 0.67 0.08 0.04 0.00 0.00 177.00 176.63 2ibz s VAL 9 N -1.86 4.81 -1.10 -0.36 1.01 -1.26 -4.49 120.40 117.16 2ibz s VAL 9 Ca 0.73 0.36 -0.17 0.00 0.00 0.00 0.00 61.98 62.90 2ibz s VAL 9 Cb -0.26 -4.18 -0.02 0.00 0.00 0.00 0.00 36.38 31.92 2ibz s VAL 9 CO 0.34 -0.51 0.82 -1.20 0.00 0.00 0.00 175.10 174.55 2ibz n SER 10 N 6.27 -5.72 -4.88 3.32 7.64 -1.26 -4.91 113.62 114.09 2ibz n SER 10 Ca -0.01 -0.92 -0.36 0.00 1.01 0.00 0.00 58.87 58.59 2ibz n SER 10 Cb 0.48 -3.83 -0.06 0.00 -1.01 0.00 0.00 64.21 59.79 2ibz n SER 10 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2ibz s LEU 11 N -6.13 4.39 0.43 -3.43 2.96 -1.11 -4.83 118.68 110.97 2ibz s LEU 11 Ca 0.45 0.55 0.08 0.00 -0.22 0.00 0.00 54.13 55.00 2ibz s LEU 11 Cb -0.14 -2.41 0.01 0.00 0.50 0.00 0.00 46.19 44.16 2ibz s LEU 11 CO 0.83 0.33 0.55 0.00 -1.32 0.00 0.00 176.35 176.74 2ibz s ALA 12 N -1.16 4.46 0.00 5.97 0.00 -1.26 -3.83 121.76 125.94 2ibz s ALA 12 Ca 0.22 -1.74 0.00 0.00 0.00 0.00 0.00 51.96 50.44 2ibz s ALA 12 Cb -0.13 -1.50 0.00 0.00 0.00 0.00 0.00 23.12 21.48 2ibz s ALA 12 CO 0.11 -0.31 0.00 0.00 0.00 0.00 0.00 175.76 175.55 2ibz n ALA 13 N -1.83 0.00 -1.43 0.00 0.00 -0.73 -4.93 120.51 111.59 2ibz n ALA 13 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2ibz n ALA 13 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 2ibz n ALA 13 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2ibz n SER 14 N -1.27 0.00 -0.96 0.00 7.64 -1.26 -2.72 113.62 115.04 2ibz n SER 14 Ca 0.00 -0.40 0.04 0.00 1.01 0.00 0.00 58.87 59.52 2ibz n SER 14 Cb 0.00 0.00 0.17 0.00 -1.01 0.00 0.00 64.21 63.37 2ibz n SER 14 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2ibz n LEU 15 N 0.00 2.68 0.00 -3.43 4.32 -1.26 -4.70 117.00 114.60 2ibz n LEU 15 Ca 0.00 -1.35 0.00 0.00 -0.02 0.00 0.00 56.01 54.64 2ibz n LEU 15 Cb 0.00 -0.47 0.00 0.00 -1.62 0.00 0.00 43.42 41.33 2ibz n LEU 15 CO 0.00 0.42 0.00 0.61 -1.22 0.00 0.00 177.39 177.20 2ibz n GLY 16 N 0.49 -1.45 3.49 -0.72 0.00 -1.26 -4.20 105.19 101.54 2ibz n GLY 16 Ca 0.12 0.75 -0.10 0.00 0.00 0.00 0.00 46.02 46.79 2ibz n GLY 16 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2ibz s ASP 17 N 0.00 -0.43 0.64 1.61 1.47 -1.26 -4.79 116.67 113.91 2ibz s ASP 17 Ca 0.00 0.09 -0.18 0.00 1.18 0.00 0.00 52.55 53.64 2ibz s ASP 17 Cb 0.00 0.43 -0.02 0.00 -0.34 0.00 0.00 42.92 43.00 2ibz s ASP 17 CO 0.00 -0.67 1.22 -2.11 0.68 0.00 0.00 175.17 174.29 2ibz n ARG 18 N -0.09 1.06 -3.72 2.11 -4.01 -1.14 -4.28 116.66 106.58 2ibz n ARG 18 Ca -0.11 0.41 -0.12 0.00 -1.04 0.00 0.00 57.85 56.99 2ibz n ARG 18 Cb 0.62 -2.46 -0.10 0.00 -3.04 0.00 0.00 32.46 27.48 2ibz n ARG 18 CO 0.00 0.00 0.00 0.54 -3.04 0.00 0.00 177.63 175.13 2ibz s VAL 19 N -1.42 -0.01 -0.24 8.89 0.11 -1.24 -4.97 120.40 121.53 2ibz s VAL 19 Ca 0.82 0.04 0.02 0.00 -2.93 0.00 0.00 61.98 59.92 2ibz s VAL 19 Cb -0.39 -0.57 0.06 0.00 -1.53 0.00 0.00 36.38 33.95 2ibz s VAL 19 CO 0.41 0.02 -0.08 -0.89 -3.33 0.00 0.00 175.10 171.23 2ibz s THR 20 N 0.66 1.78 0.29 5.04 2.01 -1.26 -2.65 115.64 121.50 2ibz s THR 20 Ca -0.04 -1.36 0.04 0.00 0.31 0.00 0.00 61.69 60.64 2ibz s THR 20 Cb -0.05 -1.97 -0.03 0.00 0.01 0.00 0.00 72.50 70.46 2ibz s THR 20 CO -0.04 -0.06 0.43 -0.63 -0.69 0.00 0.00 174.62 173.63 2ibz s ILE 21 N 1.29 4.98 0.18 1.82 1.01 -1.14 -4.67 121.20 124.67 2ibz s ILE 21 Ca -0.07 -0.85 -0.01 0.00 0.00 0.00 0.00 60.65 59.72 2ibz s ILE 21 Cb -0.19 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.47 2ibz s ILE 21 CO -0.06 -0.35 0.10 -0.94 0.00 0.00 0.00 174.94 173.69 2ibz s SER 22 N -4.03 0.36 -0.24 3.58 1.04 -0.62 -2.36 113.70 111.44 2ibz s SER 22 Ca 0.38 -1.32 -0.02 0.00 0.48 0.00 0.00 55.95 55.46 2ibz s SER 22 Cb -0.09 0.32 0.12 0.00 0.10 0.00 0.00 66.02 66.47 2ibz s SER 22 CO 0.31 -0.78 0.32 0.00 0.98 0.00 0.00 173.24 174.07 2ibz s ARG 24 N 2.45 3.69 0.20 0.00 3.52 -1.23 -2.51 118.95 125.07 2ibz s ARG 24 Ca 0.10 -0.49 -0.01 0.00 -0.13 0.00 0.00 55.73 55.20 2ibz s ARG 24 Cb -0.15 -3.08 -0.04 0.00 -1.56 0.00 0.00 34.95 30.12 2ibz s ARG 24 CO -0.18 0.09 0.38 0.00 -0.81 0.00 0.00 175.30 174.79 2ibz s ALA 25 N 0.79 3.84 0.06 6.12 0.00 -1.04 -1.62 121.76 129.92 2ibz s ALA 25 Ca 0.01 -0.83 -0.21 0.00 0.00 0.00 0.00 51.96 50.92 2ibz s ALA 25 Cb -0.14 -1.99 -0.12 0.00 0.00 0.00 0.00 23.12 20.87 2ibz s ALA 25 CO 0.02 0.45 1.53 0.66 0.00 0.00 0.00 175.76 178.42 2ibz h SER 26 N 2.03 0.22 -4.80 0.00 4.64 -1.77 -3.45 113.55 110.42 2ibz h SER 26 Ca -0.48 -0.26 -0.16 0.00 -0.47 0.00 0.00 61.79 60.42 2ibz h SER 26 Cb 1.19 -0.06 0.01 0.00 -0.31 0.00 0.00 62.40 63.23 2ibz h SER 26 CO 0.68 0.42 -0.02 1.67 -0.87 0.00 0.00 176.83 178.71 2ibz n GLN 27 N -4.81 0.82 -3.63 4.77 7.27 -1.26 -5.03 117.38 115.51 2ibz n GLN 27 Ca -0.05 -1.04 -0.37 0.00 0.07 0.00 0.00 57.00 55.60 2ibz n GLN 27 Cb 0.17 -0.09 -0.11 0.00 2.41 0.00 0.00 30.24 32.62 2ibz n GLN 27 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2ibz s ASP 28 N -2.23 6.01 -0.15 1.69 -1.08 -1.26 -4.83 116.67 114.82 2ibz s ASP 28 Ca 0.21 0.02 -0.02 0.00 -0.52 0.00 0.00 52.55 52.24 2ibz s ASP 28 Cb -0.02 -2.11 -0.02 0.00 -1.46 0.00 0.00 42.92 39.32 2ibz s ASP 28 CO 0.13 -0.01 -0.09 0.27 0.52 0.00 0.00 175.17 176.00 2ibz s ILE 29 N 1.50 3.37 0.00 4.11 -4.36 -0.95 -5.06 121.20 119.81 2ibz s ILE 29 Ca 0.07 -0.54 0.00 0.00 -0.26 0.00 0.00 60.65 59.92 2ibz s ILE 29 Cb -0.15 -2.46 0.00 0.00 1.25 0.00 0.00 42.46 41.10 2ibz s ILE 29 CO 0.08 0.50 0.56 0.59 0.24 0.00 0.00 174.94 176.91 2ibz n ASN 30 N 3.77 0.00 0.00 4.36 3.02 -1.26 -4.00 115.26 121.15 2ibz n ASN 30 Ca -0.18 0.56 0.00 0.00 -0.03 0.00 0.00 54.58 54.93 2ibz n ASN 30 Cb 0.52 -0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 2ibz n ASN 30 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2ibz n ASN 31 N -1.11 0.00 -3.55 6.41 4.13 -1.26 -3.51 115.26 116.37 2ibz n ASN 31 Ca 0.00 -1.00 -0.40 0.00 1.68 0.00 0.00 54.58 54.86 2ibz n ASN 31 Cb 0.00 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.19 2ibz n ASN 31 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2ibz n PHE 32 N 0.00 1.80 -3.84 3.10 3.72 -1.26 -2.33 117.46 118.65 2ibz n PHE 32 Ca 0.00 -1.84 -0.27 0.00 -0.05 0.00 0.00 57.45 55.29 2ibz n PHE 32 Cb 0.48 -1.70 -0.17 0.00 -0.94 0.00 0.00 39.48 37.15 2ibz n PHE 32 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 2ibz s LEU 33 N 1.00 1.28 0.29 4.37 2.96 -1.26 -2.38 118.68 124.94 2ibz s LEU 33 Ca 0.54 -0.53 0.07 0.00 -0.22 0.00 0.00 54.13 53.99 2ibz s LEU 33 Cb 0.14 -0.75 -0.03 0.00 0.50 0.00 0.00 46.19 46.05 2ibz s LEU 33 CO 0.09 -0.20 0.31 0.20 -1.32 0.00 0.00 176.35 175.43 2ibz s ASN 34 N 1.75 5.67 -0.05 3.68 0.02 -0.54 -1.33 114.94 124.13 2ibz s ASN 34 Ca 0.02 -0.26 0.02 0.00 -1.02 0.00 0.00 52.86 51.61 2ibz s ASN 34 Cb -0.15 -1.31 0.02 0.00 0.02 0.00 0.00 41.25 39.83 2ibz s ASN 34 CO -0.07 -0.22 -0.07 0.26 0.02 0.00 0.00 177.10 177.01 2ibz s TRP 35 N -2.17 0.97 0.13 2.20 0.52 0.13 -1.73 118.94 118.99 2ibz s TRP 35 Ca 0.38 -0.30 0.10 0.00 0.02 0.00 0.00 56.10 56.29 2ibz s TRP 35 Cb -0.08 -0.78 -0.04 0.00 -1.15 0.00 0.00 33.47 31.43 2ibz s TRP 35 CO 0.27 -0.20 -0.19 0.71 0.02 0.00 0.00 176.95 177.56 2ibz s TYR 36 N 0.75 2.48 -0.23 -1.98 2.02 -0.96 -0.99 117.35 118.43 2ibz s TYR 36 Ca -0.12 -0.29 -0.01 0.00 -0.37 0.00 0.00 57.07 56.28 2ibz s TYR 36 Cb -0.14 -1.30 0.02 0.00 -0.40 0.00 0.00 41.96 40.14 2ibz s TYR 36 CO 0.01 0.40 -0.08 -1.14 -1.57 0.00 0.00 175.55 173.18 2ibz s GLN 37 N -2.26 2.92 -0.44 -0.62 0.74 0.89 -1.19 119.66 119.70 2ibz s GLN 37 Ca 0.18 -0.92 -0.12 0.00 0.05 0.00 0.00 55.36 54.56 2ibz s GLN 37 Cb -0.10 -2.92 0.07 0.00 1.10 0.00 0.00 33.01 31.17 2ibz s GLN 37 CO 0.10 -0.35 0.31 -1.14 -0.55 0.00 0.00 175.29 173.66 2ibz s GLN 38 N 1.33 2.75 0.67 1.67 0.74 0.72 -0.34 119.66 127.20 2ibz s GLN 38 Ca 0.01 -1.40 -0.17 0.00 0.05 0.00 0.00 55.36 53.85 2ibz s GLN 38 Cb -0.16 -3.91 0.01 0.00 1.10 0.00 0.00 33.01 30.05 2ibz s GLN 38 CO -0.06 -0.97 1.21 0.15 -0.55 0.00 0.00 175.29 175.07 2ibz s LYS 39 N 1.51 2.51 0.49 1.67 -0.14 0.72 -1.59 119.74 124.90 2ibz s LYS 39 Ca 0.03 1.79 0.21 0.00 -1.36 0.00 0.00 55.97 56.65 2ibz s LYS 39 Cb -0.23 -1.87 1.26 0.00 -1.68 0.00 0.00 37.83 35.30 2ibz s LYS 39 CO 0.04 -1.56 1.97 -1.35 -0.76 0.00 0.00 175.35 173.69 2ibz h PRO 40 N 0.22 0.16 0.00 -1.68 0.11 -1.88 0.44 132.00 129.36 2ibz h PRO 40 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2ibz h PRO 40 Cb 1.30 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2ibz h PRO 40 CO 0.52 0.11 0.00 -0.40 -0.21 0.00 0.00 178.00 178.02 2ibz n ASP 41 N -4.42 0.00 0.00 -2.05 5.75 -1.26 -4.88 116.55 109.70 2ibz n ASP 41 Ca 0.11 -1.30 0.00 0.00 -0.01 0.00 0.00 54.79 53.59 2ibz n ASP 41 Cb 0.57 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.66 2ibz n ASP 41 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ibz n GLY 42 N 0.68 0.78 3.63 6.12 0.00 0.14 -5.04 105.19 111.50 2ibz n GLY 42 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 2ibz n GLY 42 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ibz s THR 43 N -2.71 4.60 -0.17 2.61 2.01 -1.25 -4.82 115.64 115.91 2ibz s THR 43 Ca 0.00 1.58 -0.07 0.00 0.31 0.00 0.00 61.69 63.51 2ibz s THR 43 Cb 0.00 -4.34 -0.04 0.00 0.01 0.00 0.00 72.50 68.13 2ibz s THR 43 CO 0.00 -0.41 0.06 -0.51 -0.69 0.00 0.00 174.62 173.07 2ibz s ILE 44 N 3.43 4.79 0.15 1.82 2.07 -1.26 -0.20 121.20 132.00 2ibz s ILE 44 Ca 0.41 -0.04 0.07 0.00 -1.41 0.00 0.00 60.65 59.68 2ibz s ILE 44 Cb -0.13 -3.14 -0.04 0.00 0.13 0.00 0.00 42.46 39.28 2ibz s ILE 44 CO 0.14 0.48 -0.15 -0.54 -1.91 0.00 0.00 174.94 172.97 2ibz s LYS 45 N 0.21 1.14 0.02 3.50 1.02 0.54 -4.96 119.74 121.21 2ibz s LYS 45 Ca 0.04 -1.36 -0.22 0.00 0.02 0.00 0.00 55.97 54.45 2ibz s LYS 45 Cb -0.12 -1.01 -0.06 0.00 -0.52 0.00 0.00 37.83 36.12 2ibz s LYS 45 CO 0.00 0.19 0.65 -1.17 -0.92 0.00 0.00 175.35 174.10 2ibz s LEU 46 N -2.74 4.44 -0.04 3.17 2.96 -1.26 -0.07 118.68 125.14 2ibz s LEU 46 Ca 0.14 1.27 -0.00 0.00 -0.22 0.00 0.00 54.13 55.31 2ibz s LEU 46 Cb -0.03 -3.02 -0.02 0.00 0.50 0.00 0.00 46.19 43.61 2ibz s LEU 46 CO 0.04 0.10 -0.04 0.18 -1.32 0.00 0.00 176.35 175.31 2ibz n LEU 47 N 2.62 2.40 -3.80 -0.68 4.77 -0.17 -4.80 117.00 117.35 2ibz n LEU 47 Ca -0.06 -0.01 -0.13 0.00 -0.03 0.00 0.00 56.01 55.79 2ibz n LEU 47 Cb 0.51 -0.14 -0.12 0.00 -2.33 0.00 0.00 43.42 41.34 2ibz n LEU 47 CO 0.44 0.46 -0.15 -0.63 -1.33 0.00 0.00 177.39 176.18 2ibz s ILE 48 N -2.08 -0.01 0.09 -0.08 -1.09 -1.10 -3.04 121.20 113.89 2ibz s ILE 48 Ca -0.06 0.02 0.04 0.00 -2.23 0.00 0.00 60.65 58.43 2ibz s ILE 48 Cb 0.02 -0.28 -0.03 0.00 -1.58 0.00 0.00 42.46 40.58 2ibz s ILE 48 CO 0.09 0.01 -0.12 -0.72 -1.23 0.00 0.00 174.94 172.97 2ibz s TYR 49 N 0.27 1.11 -1.30 3.97 1.13 -0.41 0.17 117.35 122.30 2ibz s TYR 49 Ca -0.01 -0.57 -0.02 0.00 -1.41 0.00 0.00 57.07 55.06 2ibz s TYR 49 Cb -0.03 -0.61 -0.00 0.00 -1.10 0.00 0.00 41.96 40.22 2ibz s TYR 49 CO -0.01 0.03 0.68 0.98 -2.51 0.00 0.00 175.55 174.72 2ibz n TYR 50 N 0.86 -1.90 0.00 -3.49 4.19 -1.21 -1.59 117.16 114.03 2ibz n TYR 50 Ca -0.18 0.80 0.00 0.00 3.31 0.00 0.00 57.90 61.83 2ibz n TYR 50 Cb 0.56 -4.25 0.00 0.00 0.49 0.00 0.00 39.34 36.14 2ibz n TYR 50 CO 0.00 0.00 0.00 -2.37 0.91 0.00 0.00 176.86 175.40 2ibz n THR 51 N -4.24 0.00 -0.32 2.97 5.66 -0.45 -3.88 114.28 114.01 2ibz n THR 51 Ca -0.28 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.72 2ibz n THR 51 Cb 0.67 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.45 2ibz n THR 51 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2ibz n SER 52 N 0.00 0.00 -4.67 1.09 3.41 -1.19 -3.18 113.62 109.08 2ibz n SER 52 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.18 2ibz n SER 52 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 2ibz n SER 52 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2ibz s ARG 53 N 0.00 4.32 0.47 4.33 0.52 -0.62 -4.73 118.95 123.24 2ibz s ARG 53 Ca 0.00 1.44 -0.21 0.00 -0.52 0.00 0.00 55.73 56.44 2ibz s ARG 53 Cb 0.00 -3.62 -0.09 0.00 0.52 0.00 0.00 34.95 31.76 2ibz s ARG 53 CO 0.00 -0.52 1.03 -0.51 0.02 0.00 0.00 175.30 175.31 2ibz s LEU 54 N 2.77 3.88 0.50 2.53 1.02 -1.26 -1.29 118.68 126.83 2ibz s LEU 54 Ca 0.48 1.90 0.03 0.00 0.02 0.00 0.00 54.13 56.56 2ibz s LEU 54 Cb -0.18 -4.53 0.02 0.00 0.02 0.00 0.00 46.19 41.52 2ibz s LEU 54 CO 0.12 -0.70 0.70 -2.28 0.02 0.00 0.00 176.35 174.21 2ibz s HIS 55 N -1.99 2.90 0.03 0.29 2.46 -1.17 -4.91 115.29 112.89 2ibz s HIS 55 Ca 0.66 -0.09 -0.30 0.00 0.47 0.00 0.00 55.06 55.79 2ibz s HIS 55 Cb -0.16 -2.58 -0.07 0.00 -0.13 0.00 0.00 32.58 29.65 2ibz s HIS 55 CO 0.19 -0.67 1.55 0.00 -2.47 0.00 0.00 174.74 173.35 2ibz s ALA 56 N -2.61 3.64 0.00 1.58 0.00 -1.26 -3.05 121.76 120.06 2ibz s ALA 56 Ca 0.55 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.56 2ibz s ALA 56 Cb -0.10 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2ibz s ALA 56 CO 0.37 -1.06 0.00 0.41 0.00 0.00 0.00 175.76 175.47 2ibz n GLY 57 N 3.87 3.11 3.70 0.00 0.00 -1.26 -5.05 105.19 109.56 2ibz n GLY 57 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2ibz n GLY 57 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ibz s VAL 58 N -2.91 3.75 0.72 1.61 -7.23 -1.17 -4.98 120.40 110.19 2ibz s VAL 58 Ca 0.00 1.17 -0.16 0.00 -1.81 0.00 0.00 61.98 61.18 2ibz s VAL 58 Cb 0.00 -3.75 0.01 0.00 0.56 0.00 0.00 36.38 33.20 2ibz s VAL 58 CO 0.00 0.02 0.99 -2.65 -0.31 0.00 0.00 175.10 173.15 2ibz n PRO 59 N 4.95 0.51 0.25 4.82 -0.02 -1.26 -4.88 135.00 139.37 2ibz n PRO 59 Ca 0.12 0.23 0.15 0.00 -2.02 0.00 0.00 63.50 61.99 2ibz n PRO 59 Cb 0.44 -2.24 0.84 0.00 -0.02 0.00 0.00 33.50 32.52 2ibz n PRO 59 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2ibz h SER 60 N -0.26 0.00 0.04 2.55 4.64 -2.00 -2.89 113.55 115.63 2ibz h SER 60 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2ibz h SER 60 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 2ibz h SER 60 CO 0.47 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 174.32 2ibz n ARG 61 N -3.93 0.12 -3.72 4.77 1.85 -1.26 -4.64 116.66 109.85 2ibz n ARG 61 Ca -0.01 0.10 -0.36 0.00 -1.00 0.00 0.00 57.85 56.58 2ibz n ARG 61 Cb 0.20 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 30.03 2ibz n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2ibz s PHE 62 N -2.24 3.50 0.00 2.89 0.08 -1.10 -1.79 117.98 119.32 2ibz s PHE 62 Ca 0.06 0.49 0.00 0.00 0.12 0.00 0.00 56.93 57.60 2ibz s PHE 62 Cb 0.03 -2.14 0.00 0.00 -0.57 0.00 0.00 43.02 40.34 2ibz s PHE 62 CO 0.06 0.44 0.00 0.43 -0.10 0.00 0.00 175.22 176.05 2ibz n SER 63 N 2.96 1.72 0.00 1.36 7.64 -0.96 -5.02 113.62 121.32 2ibz n SER 63 Ca -0.16 -0.54 0.00 0.00 1.01 0.00 0.00 58.87 59.17 2ibz n SER 63 Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 2ibz n SER 63 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ibz n GLY 64 N 5.00 0.98 0.60 0.23 0.00 -1.26 -4.31 105.19 106.43 2ibz n GLY 64 Ca 0.00 0.57 -0.04 0.00 0.00 0.00 0.00 46.02 46.55 2ibz n GLY 64 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ibz n SER 65 N 0.00 -0.12 0.00 1.61 3.41 -1.19 -4.29 113.62 113.05 2ibz n SER 65 Ca 0.00 -1.41 0.00 0.00 -0.26 0.00 0.00 58.87 57.20 2ibz n SER 65 Cb 0.00 0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2ibz n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ibz n GLY 66 N -0.09 0.90 3.92 5.00 0.00 -1.26 -2.39 105.19 111.27 2ibz n GLY 66 Ca 0.01 -2.11 0.01 0.00 0.00 0.00 0.00 46.02 43.94 2ibz n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ibz s SER 67 N 0.00 -0.00 0.00 1.61 1.04 -0.57 -4.97 113.70 110.81 2ibz s SER 67 Ca 0.00 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.11 2ibz s SER 67 Cb 0.00 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.36 2ibz s SER 67 CO 0.00 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.35 2ibz n GLY 68 N -0.81 0.37 0.00 7.32 0.00 -1.23 -1.88 105.19 108.96 2ibz n GLY 68 Ca 0.01 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.77 2ibz n GLY 68 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2ibz n THR 69 N 0.00 0.00 -4.60 2.61 5.66 -1.26 -2.24 114.28 114.45 2ibz n THR 69 Ca 0.00 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.67 2ibz n THR 69 Cb 0.00 0.99 -0.13 0.00 -1.55 0.00 0.00 70.33 69.64 2ibz n THR 69 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2ibz s ASP 70 N 0.00 4.44 0.38 1.09 1.01 -0.79 -2.48 116.67 120.32 2ibz s ASP 70 Ca 0.00 -0.20 0.04 0.00 0.71 0.00 0.00 52.55 53.10 2ibz s ASP 70 Cb 0.00 -1.61 -0.03 0.00 1.01 0.00 0.00 42.92 42.29 2ibz s ASP 70 CO 0.00 0.20 0.14 -0.31 0.21 0.00 0.00 175.17 175.41 2ibz s TYR 71 N 0.18 1.76 0.28 4.23 1.51 -1.04 -1.52 117.35 122.75 2ibz s TYR 71 Ca -0.05 -1.31 -0.09 0.00 -1.01 0.00 0.00 57.07 54.61 2ibz s TYR 71 Cb -0.14 -1.08 -0.00 0.00 -0.11 0.00 0.00 41.96 40.62 2ibz s TYR 71 CO 0.04 -0.37 0.45 0.45 -1.11 0.00 0.00 175.55 175.02 2ibz s SER 72 N -3.54 0.23 -0.36 2.29 0.15 -1.01 -3.36 113.70 108.10 2ibz s SER 72 Ca 0.28 -1.15 0.06 0.00 0.70 0.00 0.00 55.95 55.83 2ibz s SER 72 Cb 0.03 0.60 0.19 0.00 -1.71 0.00 0.00 66.02 65.13 2ibz s SER 72 CO 0.16 -1.18 0.65 -0.22 1.20 0.00 0.00 173.24 173.86 2ibz s LEU 73 N -3.10 -1.47 0.28 3.45 1.98 -0.99 -3.97 118.68 114.86 2ibz s LEU 73 Ca 0.26 -0.40 -0.01 0.00 -2.89 0.00 0.00 54.13 51.09 2ibz s LEU 73 Cb 0.00 1.88 -0.04 0.00 0.66 0.00 0.00 46.19 48.69 2ibz s LEU 73 CO 0.13 -0.20 0.49 -0.89 -1.89 0.00 0.00 176.35 173.99 2ibz s THR 74 N 2.21 5.12 0.05 3.68 2.01 -1.26 -2.89 115.64 124.56 2ibz s THR 74 Ca 0.14 -0.33 0.03 0.00 0.31 0.00 0.00 61.69 61.84 2ibz s THR 74 Cb -0.05 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.64 2ibz s THR 74 CO -0.14 -0.37 -0.09 -0.63 -0.69 0.00 0.00 174.62 172.70 2ibz s ILE 75 N -2.11 0.67 -0.12 1.82 1.01 -1.09 -2.26 121.20 119.12 2ibz s ILE 75 Ca 0.40 -1.13 -0.08 0.00 0.00 0.00 0.00 60.65 59.84 2ibz s ILE 75 Cb -0.10 -0.71 -0.07 0.00 0.01 0.00 0.00 42.46 41.59 2ibz s ILE 75 CO 0.32 -0.35 0.15 -1.28 0.00 0.00 0.00 174.94 173.78 2ibz h SER 76 N 4.45 0.00 -3.65 3.58 0.87 -1.66 -3.28 113.55 113.85 2ibz h SER 76 Ca -0.37 -0.23 -0.12 0.00 -1.23 0.00 0.00 61.79 59.83 2ibz h SER 76 Cb 1.20 0.00 -0.25 0.00 -0.44 0.00 0.00 62.40 62.91 2ibz h SER 76 CO 0.41 0.69 -0.27 0.54 -0.53 0.00 0.00 176.83 177.66 2ibz s ASN 77 N -5.78 -0.44 0.00 6.23 2.20 -1.26 -2.89 114.94 113.00 2ibz s ASN 77 Ca -0.07 0.82 0.00 0.00 -0.94 0.00 0.00 52.86 52.67 2ibz s ASN 77 Cb -0.00 0.79 0.00 0.00 -2.00 0.00 0.00 41.25 40.04 2ibz s ASN 77 CO 0.20 -0.16 0.57 0.18 -2.94 0.00 0.00 177.10 174.96 2ibz n LEU 78 N 3.35 0.75 -4.57 3.54 4.32 -1.26 -4.84 117.00 118.29 2ibz n LEU 78 Ca -0.17 -0.37 -0.43 0.00 -0.02 0.00 0.00 56.01 55.02 2ibz n LEU 78 Cb 0.56 -0.37 -0.03 0.00 -1.62 0.00 0.00 43.42 41.96 2ibz n LEU 78 CO 0.12 0.19 0.98 -0.70 -1.22 0.00 0.00 177.39 176.76 2ibz s GLU 79 N -1.21 3.54 0.00 3.23 2.56 -1.26 -3.63 118.70 121.93 2ibz s GLU 79 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 54.97 55.21 2ibz s GLU 79 Cb 0.00 -3.98 0.00 0.00 2.00 0.00 0.00 34.13 32.15 2ibz s GLU 79 CO 0.00 -1.53 0.00 -0.35 -0.56 0.00 0.00 175.26 172.82 2ibz n PRO 80 N 8.01 4.51 -1.76 4.30 -0.04 -1.26 -4.91 135.00 143.85 2ibz n PRO 80 Ca 0.08 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.25 2ibz n PRO 80 Cb 0.49 -0.37 0.04 0.00 -0.04 0.00 0.00 33.50 33.63 2ibz n PRO 80 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2ibz n GLU 81 N -0.69 3.18 -0.06 0.54 0.00 -1.24 -4.62 120.64 117.75 2ibz n GLU 81 Ca 0.00 -3.79 0.11 0.00 0.00 0.00 0.00 57.16 53.47 2ibz n GLU 81 Cb 0.00 -2.28 0.41 0.00 0.00 0.00 0.00 31.44 29.57 2ibz n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2ibz n ASP 82 N -0.77 1.41 -4.58 -1.84 10.43 -1.24 -4.83 116.55 115.12 2ibz n ASP 82 Ca 0.52 -1.65 -0.42 0.00 2.57 0.00 0.00 54.79 55.81 2ibz n ASP 82 Cb 0.78 -0.08 -0.03 0.00 1.84 0.00 0.00 41.12 43.63 2ibz n ASP 82 CO 0.00 0.00 0.00 0.27 -1.07 0.00 0.00 177.20 176.40 2ibz s ILE 83 N -1.83 3.80 0.11 0.53 -4.36 -1.26 -4.91 121.20 113.28 2ibz s ILE 83 Ca 0.32 0.70 -0.24 0.00 -0.26 0.00 0.00 60.65 61.16 2ibz s ILE 83 Cb 0.17 -4.43 0.08 0.00 1.25 0.00 0.00 42.46 39.53 2ibz s ILE 83 CO 0.26 -1.15 1.14 0.00 0.24 0.00 0.00 174.94 175.43 2ibz s ALA 84 N 5.98 -1.93 -0.20 2.27 0.00 -1.25 -4.53 121.76 122.10 2ibz s ALA 84 Ca 0.53 -0.24 -0.11 0.00 0.00 0.00 0.00 51.96 52.13 2ibz s ALA 84 Cb -0.11 0.84 -0.05 0.00 0.00 0.00 0.00 23.12 23.80 2ibz s ALA 84 CO 0.26 -1.10 0.17 0.99 0.00 0.00 0.00 175.76 176.08 2ibz s THR 85 N -2.04 5.37 -0.17 0.00 2.01 -0.62 -2.17 115.64 118.01 2ibz s THR 85 Ca 0.26 0.26 -0.05 0.00 0.31 0.00 0.00 61.69 62.47 2ibz s THR 85 Cb -0.02 -3.51 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 2ibz s THR 85 CO 0.03 0.40 0.00 -0.31 -0.69 0.00 0.00 174.62 174.06 2ibz s TYR 86 N 0.58 3.10 0.50 4.92 1.51 -0.84 -0.20 117.35 126.92 2ibz s TYR 86 Ca 0.10 -0.18 0.05 0.00 -1.01 0.00 0.00 57.07 56.02 2ibz s TYR 86 Cb -0.12 -2.01 0.00 0.00 -0.11 0.00 0.00 41.96 39.72 2ibz s TYR 86 CO 0.01 0.02 0.23 -0.06 -1.11 0.00 0.00 175.55 174.63 2ibz s PHE 87 N 0.41 1.94 -0.24 2.71 0.40 -0.34 -2.44 117.98 120.42 2ibz s PHE 87 Ca -0.01 -0.81 -0.14 0.00 -0.60 0.00 0.00 56.93 55.37 2ibz s PHE 87 Cb -0.14 -1.84 0.07 0.00 0.51 0.00 0.00 43.02 41.63 2ibz s PHE 87 CO 0.02 -0.11 0.59 0.00 0.70 0.00 0.00 175.22 176.42 2ibz s GLN 89 N 1.50 1.79 0.22 0.00 -2.07 -0.71 -0.65 119.66 119.76 2ibz s GLN 89 Ca -0.09 -1.98 0.08 0.00 -1.82 0.00 0.00 55.36 51.55 2ibz s GLN 89 Cb -0.06 -1.38 -0.05 0.00 -1.09 0.00 0.00 33.01 30.43 2ibz s GLN 89 CO -0.17 -0.04 -0.14 -3.38 -1.32 0.00 0.00 175.29 170.24 2ibz s HIS 90 N -2.89 1.81 -0.12 9.60 -3.43 -1.15 -1.47 115.29 117.64 2ibz s HIS 90 Ca 0.34 -0.55 0.16 0.00 -0.80 0.00 0.00 55.06 54.21 2ibz s HIS 90 Cb 0.07 -0.85 0.33 0.00 -1.43 0.00 0.00 32.58 30.70 2ibz s HIS 90 CO 0.16 0.40 1.18 -2.39 -2.00 0.00 0.00 174.74 172.09 2ibz n HIS 91 N -0.43 -0.11 0.22 0.38 1.44 -1.00 -4.10 115.22 111.61 2ibz n HIS 91 Ca -0.07 -1.08 0.12 0.00 -2.01 0.00 0.00 57.72 54.68 2ibz n HIS 91 Cb 0.61 0.33 0.29 0.00 0.12 0.00 0.00 29.99 31.33 2ibz n HIS 91 CO 0.00 0.00 0.00 -0.84 -2.81 0.00 0.00 176.34 172.69 2ibz h ILE 92 N 5.60 0.13 -2.06 0.61 -2.65 -1.97 -3.46 117.51 113.72 2ibz h ILE 92 Ca -0.34 -1.04 0.00 0.00 1.03 0.00 0.00 64.86 64.51 2ibz h ILE 92 Cb 1.52 1.92 -0.19 0.00 -2.05 0.00 0.00 36.82 38.03 2ibz h ILE 92 CO -0.04 0.07 0.32 -0.75 0.03 0.00 0.00 178.15 177.78 2ibz s LYS 93 N -3.31 0.94 0.22 0.16 2.20 -1.26 -5.13 119.74 113.55 2ibz s LYS 93 Ca 0.05 0.06 -0.21 0.00 -0.36 0.00 0.00 55.97 55.50 2ibz s LYS 93 Cb 0.06 0.44 -0.08 0.00 -1.51 0.00 0.00 37.83 36.74 2ibz s LYS 93 CO 0.65 -0.33 0.75 -0.06 -0.36 0.00 0.00 175.35 176.00 2ibz s PHE 94 N -1.76 3.71 0.38 4.03 0.08 -1.26 -4.08 117.98 119.08 2ibz s PHE 94 Ca -0.05 1.47 -0.14 0.00 0.12 0.00 0.00 56.93 58.34 2ibz s PHE 94 Cb -0.00 -2.67 -0.08 0.00 -0.57 0.00 0.00 43.02 39.69 2ibz s PHE 94 CO 0.02 0.37 0.78 -1.25 -0.10 0.00 0.00 175.22 175.04 2ibz s PRO 95 N -1.78 3.92 0.38 0.24 0.04 -1.26 -5.06 135.00 131.47 2ibz s PRO 95 Ca 0.42 0.64 -0.26 0.00 0.04 0.00 0.00 61.00 61.84 2ibz s PRO 95 Cb -0.18 -2.38 -0.09 0.00 0.04 0.00 0.00 34.50 31.89 2ibz s PRO 95 CO 0.22 0.04 1.12 -1.58 0.04 0.00 0.00 177.00 176.84 2ibz s TRP 96 N -2.20 3.22 0.01 0.56 0.51 -1.26 -4.84 118.94 114.94 2ibz s TRP 96 Ca 0.54 1.61 0.03 0.00 -2.12 0.00 0.00 56.10 56.16 2ibz s TRP 96 Cb -0.10 -3.29 -0.01 0.00 -0.81 0.00 0.00 33.47 29.26 2ibz s TRP 96 CO 0.24 -0.96 -0.10 0.99 -0.51 0.00 0.00 176.95 176.61 2ibz s THR 97 N -1.45 0.76 0.56 2.01 2.01 -1.26 -5.00 115.64 113.27 2ibz s THR 97 Ca 0.55 -0.62 0.09 0.00 0.31 0.00 0.00 61.69 62.02 2ibz s THR 97 Cb -0.28 -0.68 0.08 0.00 0.01 0.00 0.00 72.50 71.63 2ibz s THR 97 CO 0.35 0.06 0.74 -0.36 -0.69 0.00 0.00 174.62 174.73 2ibz s PHE 98 N -0.53 1.54 0.83 4.92 0.08 -1.26 -2.96 117.98 120.61 2ibz s PHE 98 Ca 0.01 -0.71 -0.06 0.00 0.12 0.00 0.00 56.93 56.30 2ibz s PHE 98 Cb -0.05 -2.20 0.17 0.00 -0.57 0.00 0.00 43.02 40.37 2ibz s PHE 98 CO 0.00 -1.03 1.13 0.20 -0.10 0.00 0.00 175.22 175.42 2ibz s GLY 99 N -4.61 1.77 0.38 4.36 0.00 0.18 -4.14 107.32 105.27 2ibz s GLY 99 Ca 0.59 -1.69 0.16 0.00 0.00 0.00 0.00 44.72 43.78 2ibz s GLY 99 CO 0.37 -1.00 1.80 0.00 0.00 0.00 0.00 173.10 174.27 2ibz h ALA 100 N -0.98 1.20 0.00 3.20 0.00 -1.88 -3.46 119.26 117.34 2ibz h ALA 100 Ca -0.38 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.19 2ibz h ALA 100 Cb 1.25 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2ibz h ALA 100 CO 0.35 0.47 0.00 0.41 0.00 0.00 0.00 179.25 180.48 2ibz n GLY 101 N -0.20 2.72 2.96 0.00 0.00 -1.26 -5.02 105.19 104.39 2ibz n GLY 101 Ca -0.01 -1.98 -0.07 0.00 0.00 0.00 0.00 46.02 43.96 2ibz n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ibz s THR 102 N -2.80 -0.70 0.39 2.61 2.01 -1.02 -4.55 115.64 111.58 2ibz s THR 102 Ca 0.00 -0.27 -0.25 0.00 0.31 0.00 0.00 61.69 61.48 2ibz s THR 102 Cb 0.00 -0.92 -0.09 0.00 0.01 0.00 0.00 72.50 71.50 2ibz s THR 102 CO 0.00 -0.24 1.10 -0.75 -0.69 0.00 0.00 174.62 174.04 2ibz s LYS 103 N 2.49 4.14 -0.28 4.92 2.47 -1.26 -1.99 119.74 130.23 2ibz s LYS 103 Ca 0.10 1.65 0.03 0.00 -1.56 0.00 0.00 55.97 56.20 2ibz s LYS 103 Cb -0.12 -2.63 0.07 0.00 -1.46 0.00 0.00 37.83 33.69 2ibz s LYS 103 CO -0.27 -0.19 -0.06 -1.17 0.16 0.00 0.00 175.35 173.82 2ibz s LEU 104 N -2.52 3.63 0.26 5.43 2.96 -0.92 -2.74 118.68 124.78 2ibz s LEU 104 Ca 0.57 -1.55 0.07 0.00 -0.22 0.00 0.00 54.13 53.00 2ibz s LEU 104 Cb -0.26 -1.52 -0.04 0.00 0.50 0.00 0.00 46.19 44.88 2ibz s LEU 104 CO 0.32 -0.24 0.17 -1.61 -1.32 0.00 0.00 176.35 173.68 2ibz s GLU 105 N 1.10 2.81 -0.17 1.98 2.02 -1.25 -3.88 118.70 121.31 2ibz s GLU 105 Ca -0.04 -1.14 0.01 0.00 0.02 0.00 0.00 54.97 53.83 2ibz s GLU 105 Cb -0.20 -2.49 0.01 0.00 0.10 0.00 0.00 34.13 31.56 2ibz s GLU 105 CO -0.06 0.37 -0.20 0.96 0.02 0.00 0.00 175.26 176.35 2ibz s ILE 106 N -2.18 2.15 -2.53 -1.63 -4.36 -1.26 -1.78 121.20 109.60 2ibz s ILE 106 Ca 0.33 -0.93 0.28 0.00 -0.26 0.00 0.00 60.65 60.07 2ibz s ILE 106 Cb -0.07 -1.89 0.52 0.00 1.25 0.00 0.00 42.46 42.27 2ibz s ILE 106 CO 0.24 0.54 1.71 1.17 0.24 0.00 0.00 174.94 178.84