#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2za4 s VAL 3 N 0.00 3.42 -0.28 -0.39 1.01 -1.26 -4.99 120.40 117.90 2za4 s VAL 3 Ca 0.00 0.94 -0.05 0.00 0.00 0.00 0.00 61.98 62.87 2za4 s VAL 3 Cb 0.00 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.80 2za4 s VAL 3 CO 0.00 0.04 0.03 -0.63 0.00 0.00 0.00 175.10 174.53 2za4 s ILE 4 N 1.77 3.52 0.00 2.22 1.09 -1.26 -4.95 121.20 123.60 2za4 s ILE 4 Ca 0.65 -0.87 0.00 0.00 -1.10 0.00 0.00 60.65 59.34 2za4 s ILE 4 Cb -0.35 -2.83 0.01 0.00 -1.06 0.00 0.00 42.46 38.23 2za4 s ILE 4 CO 0.29 0.10 0.79 -0.46 -0.10 0.00 0.00 174.94 175.56 2za4 n ASN 5 N 4.78 0.00 -4.97 3.58 6.94 -1.26 -4.80 115.26 119.54 2za4 n ASN 5 Ca -0.15 -1.58 -0.21 0.00 -0.02 0.00 0.00 54.58 52.61 2za4 n ASN 5 Cb 0.47 -0.11 -0.00 0.00 -2.36 0.00 0.00 39.78 37.78 2za4 n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2za4 s THR 6 N 0.00 4.38 0.11 5.53 -4.23 -1.26 -0.74 115.64 119.42 2za4 s THR 6 Ca 0.01 -0.75 -0.25 0.00 -1.18 0.00 0.00 61.69 59.52 2za4 s THR 6 Cb 0.01 -3.57 -0.09 0.00 1.34 0.00 0.00 72.50 70.18 2za4 s THR 6 CO -0.00 -0.30 1.68 -0.26 -0.54 0.00 0.00 174.62 175.20 2za4 h PHE 7 N 0.75 -0.37 -0.14 3.99 0.04 -1.99 -0.30 116.94 118.93 2za4 h PHE 7 Ca -0.47 0.01 -0.13 0.00 2.80 0.00 0.00 57.97 60.17 2za4 h PHE 7 Cb 1.25 0.16 -0.01 0.00 2.20 0.00 0.00 35.95 39.54 2za4 h PHE 7 CO 0.45 -0.21 -0.49 -0.44 -0.60 0.00 0.00 178.31 177.02 2za4 h ASP 8 N -0.27 0.40 -0.21 2.17 3.32 -1.98 -1.01 116.42 118.84 2za4 h ASP 8 Ca 0.03 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 56.85 2za4 h ASP 8 Cb 0.30 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 2za4 h ASP 8 CO -0.09 0.82 0.01 1.23 -1.72 0.00 0.00 179.24 179.49 2za4 h GLY 9 N 1.23 0.39 1.50 2.75 0.00 -1.91 -0.74 103.07 106.30 2za4 h GLY 9 Ca 0.01 -0.28 -0.17 0.00 0.00 0.00 0.00 47.33 46.90 2za4 h GLY 9 CO 0.08 0.26 -0.61 -2.08 0.00 0.00 0.00 176.54 174.19 2za4 h VAL 10 N 0.13 1.34 -0.40 4.60 2.07 -1.05 -2.03 116.25 120.91 2za4 h VAL 10 Ca 0.06 -1.90 -0.01 0.00 0.82 0.00 0.00 66.70 65.67 2za4 h VAL 10 Cb 0.37 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 2za4 h VAL 10 CO 0.01 0.58 0.20 0.00 0.02 0.00 0.00 177.57 178.39 2za4 h ALA 11 N 0.95 0.51 -0.54 1.67 0.00 -1.10 0.35 119.26 121.10 2za4 h ALA 11 Ca -0.01 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2za4 h ALA 11 Cb 1.16 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2za4 h ALA 11 CO 0.11 0.05 0.17 0.22 0.00 0.00 0.00 179.25 179.80 2za4 h ASP 12 N 0.50 0.78 -0.62 0.00 -0.00 -1.09 -1.97 116.42 114.03 2za4 h ASP 12 Ca 0.14 -0.21 -0.02 0.00 -0.00 0.00 0.00 57.03 56.94 2za4 h ASP 12 Cb 0.09 -0.21 -0.03 0.00 -0.00 0.00 0.00 39.33 39.18 2za4 h ASP 12 CO -0.02 0.78 0.31 0.22 -0.00 0.00 0.00 179.24 180.53 2za4 h TYR 13 N 0.74 0.88 -0.50 0.28 5.03 -1.04 -0.99 116.97 121.37 2za4 h TYR 13 Ca 0.17 -0.04 -0.02 0.00 2.58 0.00 0.00 58.73 61.42 2za4 h TYR 13 Cb 0.28 -0.27 -0.02 0.00 1.55 0.00 0.00 36.73 38.26 2za4 h TYR 13 CO 0.02 0.66 0.23 -0.07 -1.32 0.00 0.00 178.16 177.68 2za4 h LEU 14 N 0.85 0.66 -1.03 2.82 3.38 -0.76 0.50 115.31 121.72 2za4 h LEU 14 Ca 0.21 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 2za4 h LEU 14 Cb 0.10 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2za4 h LEU 14 CO -0.03 0.61 -0.10 1.56 0.09 0.00 0.00 178.44 180.58 2za4 h GLN 15 N 0.67 0.58 0.09 1.13 4.20 -1.11 0.26 115.11 120.92 2za4 h GLN 15 Ca 0.17 -0.17 -0.13 0.00 0.06 0.00 0.00 58.65 58.59 2za4 h GLN 15 Cb 0.13 -0.06 0.01 0.00 0.30 0.00 0.00 27.48 27.87 2za4 h GLN 15 CO -0.02 0.68 -0.56 1.15 -0.67 0.00 0.00 178.83 179.41 2za4 h THR 16 N 0.54 1.59 -0.01 -0.54 2.02 -0.90 -3.39 112.91 112.21 2za4 h THR 16 Ca 0.10 -2.44 0.00 0.00 0.77 0.00 0.00 66.41 64.84 2za4 h THR 16 Cb 0.50 3.21 0.00 0.00 -1.74 0.00 0.00 68.15 70.11 2za4 h THR 16 CO 0.03 0.67 -0.38 -1.22 0.37 0.00 0.00 175.52 174.99 2za4 n TYR 17 N -4.28 0.00 -3.74 3.16 4.01 0.14 -5.01 117.16 111.45 2za4 n TYR 17 Ca -0.12 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.36 2za4 n TYR 17 Cb 0.71 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.79 2za4 n TYR 17 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2za4 n HIS 18 N -0.40 -2.42 -3.58 -0.72 8.25 0.90 -4.95 115.22 112.30 2za4 n HIS 18 Ca 0.05 0.94 -0.05 0.00 -0.26 0.00 0.00 57.72 58.40 2za4 n HIS 18 Cb 0.29 -4.49 -0.02 0.00 1.12 0.00 0.00 29.99 26.89 2za4 n HIS 18 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 2za4 s LYS 19 N -6.30 0.48 0.57 -0.41 -2.85 -1.26 -5.08 119.74 104.90 2za4 s LYS 19 Ca 0.47 -0.19 -0.15 0.00 -1.00 0.00 0.00 55.97 55.10 2za4 s LYS 19 Cb -0.22 0.21 -0.05 0.00 -2.06 0.00 0.00 37.83 35.71 2za4 s LYS 19 CO 0.79 -0.21 1.02 -0.51 0.10 0.00 0.00 175.35 176.54 2za4 s LEU 20 N -2.34 3.48 1.00 2.77 1.43 -1.26 -4.15 118.68 119.61 2za4 s LEU 20 Ca 0.09 1.65 -0.12 0.00 -1.03 0.00 0.00 54.13 54.72 2za4 s LEU 20 Cb -0.01 -4.51 0.16 0.00 0.03 0.00 0.00 46.19 41.86 2za4 s LEU 20 CO -0.06 -0.92 0.90 -2.65 0.23 0.00 0.00 176.35 173.86 2za4 n PRO 21 N -2.03 -0.99 0.02 1.29 -0.02 -1.26 -4.87 135.00 127.14 2za4 n PRO 21 Ca 0.07 -0.24 0.06 0.00 -2.02 0.00 0.00 63.50 61.38 2za4 n PRO 21 Cb 0.54 -2.19 0.28 0.00 -0.02 0.00 0.00 33.50 32.11 2za4 n PRO 21 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2za4 n ASP 22 N -3.72 0.10 -0.37 2.55 8.00 -1.26 -2.73 116.55 119.11 2za4 n ASP 22 Ca 0.08 0.53 0.04 0.00 0.71 0.00 0.00 54.79 56.15 2za4 n ASP 22 Cb 0.53 -0.55 0.14 0.00 -0.02 0.00 0.00 41.12 41.23 2za4 n ASP 22 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2za4 n ASN 23 N -1.61 1.09 -4.69 -2.24 0.23 -1.26 -4.85 115.26 101.93 2za4 n ASN 23 Ca 0.02 -1.95 -0.35 0.00 -0.53 0.00 0.00 54.58 51.78 2za4 n ASN 23 Cb 0.14 -0.13 -0.09 0.00 -2.08 0.00 0.00 39.78 37.62 2za4 n ASN 23 CO 0.00 0.00 0.00 -0.31 -0.93 0.00 0.00 177.26 176.02 2za4 s TYR 24 N -1.74 3.16 0.04 -2.53 2.02 -1.10 -0.69 117.35 116.50 2za4 s TYR 24 Ca 0.16 0.19 0.01 0.00 -0.37 0.00 0.00 57.07 57.06 2za4 s TYR 24 Cb 0.08 -1.78 -0.02 0.00 -0.40 0.00 0.00 41.96 39.84 2za4 s TYR 24 CO 0.11 0.47 -0.06 0.96 -1.57 0.00 0.00 175.55 175.46 2za4 s ILE 25 N -0.92 0.43 0.84 2.71 -0.00 -0.23 -4.91 121.20 119.12 2za4 s ILE 25 Ca 0.14 -1.13 -0.12 0.00 -0.00 0.00 0.00 60.65 59.55 2za4 s ILE 25 Cb -0.11 -0.64 0.09 0.00 -0.00 0.00 0.00 42.46 41.80 2za4 s ILE 25 CO 0.03 -0.47 1.10 0.42 -0.00 0.00 0.00 174.94 176.02 2za4 s THR 26 N -1.67 2.84 0.22 8.37 -4.23 -1.22 -0.64 115.64 119.31 2za4 s THR 26 Ca -0.09 0.27 -0.09 0.00 -1.18 0.00 0.00 61.69 60.60 2za4 s THR 26 Cb -0.08 -2.95 0.18 0.00 1.34 0.00 0.00 72.50 70.99 2za4 s THR 26 CO -0.01 -0.36 1.88 0.50 -0.54 0.00 0.00 174.62 176.09 2za4 h LYS 27 N -1.26 1.11 -0.71 3.99 3.64 -1.96 -0.98 116.57 120.41 2za4 h LYS 27 Ca -0.48 -0.09 -0.06 0.00 -1.27 0.00 0.00 60.65 58.75 2za4 h LYS 27 Cb 1.28 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 32.83 2za4 h LYS 27 CO 0.58 0.76 0.20 0.77 -2.27 0.00 0.00 179.45 179.50 2za4 h SER 28 N 1.13 1.04 -0.64 4.20 0.02 -1.99 -0.49 113.55 116.82 2za4 h SER 28 Ca 0.30 -0.20 -0.06 0.00 -0.84 0.00 0.00 61.79 60.99 2za4 h SER 28 Cb -0.08 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.16 2za4 h SER 28 CO -0.06 0.97 0.15 -0.33 -1.14 0.00 0.00 176.83 176.43 2za4 h GLU 29 N 1.06 1.03 -0.51 3.45 5.08 -1.78 -1.18 114.58 121.72 2za4 h GLU 29 Ca 0.23 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 2za4 h GLU 29 Cb 0.32 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 2za4 h GLU 29 CO -0.00 0.93 0.19 0.00 -1.00 0.00 0.00 179.01 179.12 2za4 h ALA 30 N 1.05 0.67 -0.78 3.43 0.00 -0.81 -2.60 119.26 120.23 2za4 h ALA 30 Ca 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2za4 h ALA 30 Cb 0.36 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2za4 h ALA 30 CO 0.00 0.30 0.42 1.96 0.00 0.00 0.00 179.25 181.93 2za4 h GLN 31 N 0.69 1.09 0.00 0.00 4.20 -0.82 -1.17 115.11 119.10 2za4 h GLN 31 Ca 0.17 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 2za4 h GLN 31 Cb 0.23 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 2za4 h GLN 31 CO -0.01 0.80 -0.05 0.00 -0.67 0.00 0.00 178.83 178.90 2za4 h ALA 32 N 1.37 1.08 -0.00 3.87 0.00 -0.86 -1.56 119.26 123.15 2za4 h ALA 32 Ca 0.28 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2za4 h ALA 32 Cb 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2za4 h ALA 32 CO -0.04 0.07 -0.35 1.28 0.00 0.00 0.00 179.25 180.20 2za4 n LEU 33 N -3.26 0.74 0.00 0.00 4.77 -0.64 -4.92 117.00 113.68 2za4 n LEU 33 Ca -0.01 -0.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 2za4 n LEU 33 Cb 0.24 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2za4 n LEU 33 CO 0.27 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 2za4 n GLY 34 N 1.41 1.14 3.72 -0.72 0.00 -0.59 -4.84 105.19 105.32 2za4 n GLY 34 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2za4 n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2za4 s TRP 35 N -2.00 3.18 -0.21 1.61 -0.00 -0.54 -4.99 118.94 115.99 2za4 s TRP 35 Ca 0.00 0.91 -0.02 0.00 -0.00 0.00 0.00 56.10 56.99 2za4 s TRP 35 Cb 0.00 -3.74 0.06 0.00 -0.00 0.00 0.00 33.47 29.79 2za4 s TRP 35 CO 0.00 -2.60 0.02 0.08 -0.00 0.00 0.00 176.95 174.45 2za4 s VAL 36 N 0.90 0.77 0.23 5.86 1.01 -1.26 -4.45 120.40 123.45 2za4 s VAL 36 Ca 0.64 -0.78 -0.16 0.00 0.00 0.00 0.00 61.98 61.68 2za4 s VAL 36 Cb -0.39 -1.26 0.26 0.00 0.00 0.00 0.00 36.38 34.99 2za4 s VAL 36 CO 0.32 -0.24 1.57 0.00 0.00 0.00 0.00 175.10 176.76 2za4 h ALA 37 N 8.17 0.25 -0.00 5.51 0.00 -2.00 0.14 119.26 131.33 2za4 h ALA 37 Ca -0.16 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2za4 h ALA 37 Cb 1.10 0.84 -0.00 0.00 0.00 0.00 0.00 17.79 19.72 2za4 h ALA 37 CO 0.37 -0.56 0.03 0.66 0.00 0.00 0.00 179.25 179.74 2za4 h SER 38 N -0.04 0.00 1.01 0.00 4.64 -2.03 -1.05 113.55 116.07 2za4 h SER 38 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 2za4 h SER 38 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2za4 h SER 38 CO -0.88 0.00 -0.68 0.11 -0.87 0.00 0.00 176.83 174.51 2za4 h LYS 39 N 0.00 0.00 -5.87 4.77 1.57 -1.15 -3.48 116.57 112.41 2za4 h LYS 39 Ca 0.00 0.00 -0.44 0.00 -1.87 0.00 0.00 60.65 58.35 2za4 h LYS 39 Cb 0.06 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.40 2za4 h LYS 39 CO -0.00 0.00 -0.70 0.41 -0.57 0.00 0.00 179.45 178.59 2za4 n GLY 40 N 1.27 -0.52 1.47 3.86 0.00 -0.40 -4.90 105.19 105.97 2za4 n GLY 40 Ca 0.02 0.20 0.04 0.00 0.00 0.00 0.00 46.02 46.29 2za4 n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2za4 n ASN 41 N -2.82 4.64 -0.10 1.61 6.94 -1.26 -4.22 115.26 120.04 2za4 n ASN 41 Ca 0.01 -3.08 -0.06 0.00 -0.02 0.00 0.00 54.58 51.44 2za4 n ASN 41 Cb 0.55 -0.64 0.02 0.00 -2.36 0.00 0.00 39.78 37.35 2za4 n ASN 41 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 2za4 h LEU 42 N 2.68 -0.02 -1.90 -4.53 5.85 -1.89 -1.70 115.31 113.79 2za4 h LEU 42 Ca 0.07 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 2za4 h LEU 42 Cb 1.82 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.94 2za4 h LEU 42 CO 0.43 0.02 -0.11 0.00 -0.34 0.00 0.00 178.44 178.44 2za4 h ALA 43 N 1.28 1.25 0.02 1.25 0.00 -1.84 0.21 119.26 121.43 2za4 h ALA 43 Ca 0.17 -0.10 -0.26 0.00 0.00 0.00 0.00 54.91 54.72 2za4 h ALA 43 Cb 0.21 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.99 2za4 h ALA 43 CO -0.24 0.14 -1.05 -0.44 0.00 0.00 0.00 179.25 177.67 2za4 h ASP 44 N 0.00 0.74 0.46 0.00 3.32 -1.67 -2.95 116.42 116.32 2za4 h ASP 44 Ca -0.00 -0.62 0.00 0.00 0.02 0.00 0.00 57.03 56.43 2za4 h ASP 44 Cb 0.35 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.67 2za4 h ASP 44 CO 0.01 1.42 -1.30 1.33 -1.72 0.00 0.00 179.24 178.99 2za4 n VAL 45 N -3.79 0.25 -3.15 -1.35 0.24 -0.93 -4.60 118.33 105.00 2za4 n VAL 45 Ca -0.10 -0.40 -0.22 0.00 -2.04 0.00 0.00 64.34 61.58 2za4 n VAL 45 Cb 0.89 0.02 -0.06 0.00 -1.47 0.00 0.00 33.84 33.21 2za4 n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2za4 n ALA 46 N -2.04 2.08 -1.60 2.33 0.00 0.71 -4.92 120.51 117.07 2za4 n ALA 46 Ca -0.00 -3.22 -0.52 0.00 0.00 0.00 0.00 53.44 49.70 2za4 n ALA 46 Cb 0.50 -0.86 -0.06 0.00 0.00 0.00 0.00 19.45 19.04 2za4 n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2za4 n PRO 47 N 1.41 1.21 -0.92 0.00 -0.02 -1.11 -1.51 135.00 134.06 2za4 n PRO 47 Ca 0.20 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2za4 n PRO 47 Cb 0.54 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 2za4 n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2za4 n GLY 48 N 2.67 0.47 3.91 -1.23 0.00 -1.26 -5.01 105.19 104.74 2za4 n GLY 48 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 2za4 n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2za4 s LYS 49 N -0.55 3.29 0.08 1.61 -0.14 -0.57 -4.81 119.74 118.65 2za4 s LYS 49 Ca 0.00 -0.70 0.05 0.00 -1.36 0.00 0.00 55.97 53.96 2za4 s LYS 49 Cb 0.00 -2.86 -0.03 0.00 -1.68 0.00 0.00 37.83 33.26 2za4 s LYS 49 CO 0.00 0.50 -0.14 -1.12 -0.76 0.00 0.00 175.35 173.83 2za4 s SER 50 N -3.31 1.69 0.17 2.83 0.01 0.13 -4.84 113.70 110.38 2za4 s SER 50 Ca 0.34 -0.66 -0.30 0.00 1.31 0.00 0.00 55.95 56.63 2za4 s SER 50 Cb -0.10 -0.04 -0.07 0.00 0.21 0.00 0.00 66.02 66.01 2za4 s SER 50 CO 0.27 -0.11 1.10 -0.63 0.41 0.00 0.00 173.24 174.28 2za4 s ILE 51 N -1.52 3.89 0.00 1.44 1.01 -1.26 -1.07 121.20 123.70 2za4 s ILE 51 Ca 0.00 1.62 0.00 0.00 0.00 0.00 0.00 60.65 62.27 2za4 s ILE 51 Cb -0.09 -4.03 0.00 0.00 0.01 0.00 0.00 42.46 38.35 2za4 s ILE 51 CO 0.02 0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.84 2za4 n GLY 52 N 2.09 0.89 0.00 6.18 0.00 0.18 -0.52 105.19 114.01 2za4 n GLY 52 Ca 0.03 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.63 2za4 n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2za4 n GLY 53 N -0.02 0.62 3.82 -0.02 0.00 0.57 -3.45 105.19 106.72 2za4 n GLY 53 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2za4 n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2za4 s ASP 54 N -1.94 6.92 0.45 1.61 1.01 -1.23 -4.76 116.67 118.73 2za4 s ASP 54 Ca 0.00 1.63 -0.25 0.00 0.71 0.00 0.00 52.55 54.63 2za4 s ASP 54 Cb 0.00 -2.51 -0.08 0.00 1.01 0.00 0.00 42.92 41.33 2za4 s ASP 54 CO 0.00 -0.33 1.43 -0.51 0.21 0.00 0.00 175.17 175.97 2za4 s ILE 55 N -2.13 2.06 -0.10 0.77 1.10 -1.26 -1.39 121.20 120.25 2za4 s ILE 55 Ca 0.60 0.06 0.03 0.00 -0.51 0.00 0.00 60.65 60.83 2za4 s ILE 55 Cb -0.09 -3.03 0.01 0.00 0.15 0.00 0.00 42.46 39.49 2za4 s ILE 55 CO 0.14 0.01 -0.19 0.12 -2.11 0.00 0.00 174.94 172.90 2za4 s PHE 56 N -1.20 2.25 -1.75 3.50 5.36 0.48 -4.77 117.98 121.85 2za4 s PHE 56 Ca 0.61 -0.99 0.28 0.00 -0.96 0.00 0.00 56.93 55.87 2za4 s PHE 56 Cb -0.44 -1.55 1.00 0.00 -0.34 0.00 0.00 43.02 41.69 2za4 s PHE 56 CO 0.56 -0.44 1.72 0.43 -1.46 0.00 0.00 175.22 176.03 2za4 n SER 57 N 3.84 0.79 -3.93 6.13 7.64 -1.26 -4.05 113.62 122.77 2za4 n SER 57 Ca -0.20 -0.78 -0.26 0.00 1.01 0.00 0.00 58.87 58.64 2za4 n SER 57 Cb 0.52 0.03 -0.01 0.00 -1.01 0.00 0.00 64.21 63.74 2za4 n SER 57 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2za4 n ASN 58 N -0.74 -1.18 0.16 6.43 5.15 -1.26 -4.84 115.26 118.98 2za4 n ASN 58 Ca 0.14 -0.95 0.10 0.00 -0.60 0.00 0.00 54.58 53.26 2za4 n ASN 58 Cb 0.31 -3.29 0.61 0.00 -0.53 0.00 0.00 39.78 36.89 2za4 n ASN 58 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 2za4 h ARG 59 N -1.83 0.09 -0.01 1.20 3.08 -2.00 -0.95 114.38 113.96 2za4 h ARG 59 Ca -0.62 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.43 2za4 h ARG 59 Cb 1.37 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.40 2za4 h ARG 59 CO 0.63 0.06 -0.08 0.39 -1.07 0.00 0.00 179.97 179.90 2za4 n GLU 60 N -4.50 1.37 -1.76 0.04 -0.58 -1.26 -4.95 120.64 109.00 2za4 n GLU 60 Ca 0.01 -0.79 -0.17 0.00 -0.42 0.00 0.00 57.16 55.79 2za4 n GLU 60 Cb 0.19 -1.48 -0.05 0.00 -0.57 0.00 0.00 31.44 29.52 2za4 n GLU 60 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2za4 n GLY 61 N 1.23 1.04 0.14 0.62 0.00 -0.36 -4.90 105.19 102.96 2za4 n GLY 61 Ca 0.17 -0.19 -0.04 0.00 0.00 0.00 0.00 46.02 45.95 2za4 n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2za4 h LYS 62 N 0.00 0.11 -6.55 1.61 1.79 -1.93 -3.44 116.57 108.16 2za4 h LYS 62 Ca -0.37 -0.09 -0.52 0.00 -2.18 0.00 0.00 60.65 57.49 2za4 h LYS 62 Cb 1.18 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.81 2za4 h LYS 62 CO 0.50 0.76 0.07 -0.51 -1.08 0.00 0.00 179.45 179.19 2za4 s LEU 63 N -7.58 4.29 0.23 2.94 1.43 -1.26 -5.02 118.68 113.70 2za4 s LEU 63 Ca -0.02 1.32 -0.30 0.00 -1.03 0.00 0.00 54.13 54.10 2za4 s LEU 63 Cb 0.12 -3.62 -0.10 0.00 0.03 0.00 0.00 46.19 42.62 2za4 s LEU 63 CO 0.79 -0.00 1.41 -2.16 0.23 0.00 0.00 176.35 176.62 2za4 s PRO 64 N -2.18 4.30 0.22 1.29 0.04 -1.26 -5.03 135.00 132.38 2za4 s PRO 64 Ca 0.44 2.23 0.05 0.00 0.04 0.00 0.00 61.00 63.76 2za4 s PRO 64 Cb -0.15 -3.14 -0.03 0.00 0.04 0.00 0.00 34.50 31.22 2za4 s PRO 64 CO 0.20 -0.38 0.32 0.20 0.04 0.00 0.00 177.00 177.38 2za4 s GLY 65 N 0.41 1.36 -0.12 0.56 0.00 -1.26 -5.09 107.32 103.18 2za4 s GLY 65 Ca 0.59 -1.20 -0.30 0.00 0.00 0.00 0.00 44.72 43.81 2za4 s GLY 65 CO 0.41 -1.22 0.84 1.25 0.00 0.00 0.00 173.10 174.39 2za4 s LYS 66 N -3.76 0.81 0.04 2.90 2.20 -1.26 -5.07 119.74 115.59 2za4 s LYS 66 Ca 0.34 0.27 -0.32 0.00 -0.36 0.00 0.00 55.97 55.89 2za4 s LYS 66 Cb -0.09 0.38 -0.11 0.00 -1.51 0.00 0.00 37.83 36.50 2za4 s LYS 66 CO 0.28 -0.24 1.84 0.43 -0.36 0.00 0.00 175.35 177.30 2za4 n SER 67 N 1.00 3.70 0.00 1.43 7.64 -1.26 -1.15 113.62 124.98 2za4 n SER 67 Ca -0.15 0.98 0.00 0.00 1.01 0.00 0.00 58.87 60.72 2za4 n SER 67 Cb 0.57 -1.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.31 2za4 n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2za4 n GLY 68 N 4.22 1.51 3.71 0.23 0.00 -1.26 -5.03 105.19 108.57 2za4 n GLY 68 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 2za4 n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2za4 s ARG 69 N -0.41 4.40 0.22 1.61 3.52 -0.30 -4.93 118.95 123.06 2za4 s ARG 69 Ca 0.00 0.81 0.10 0.00 -0.13 0.00 0.00 55.73 56.51 2za4 s ARG 69 Cb 0.00 -3.46 -0.05 0.00 -1.56 0.00 0.00 34.95 29.88 2za4 s ARG 69 CO 0.00 0.04 -0.19 0.95 -0.81 0.00 0.00 175.30 175.29 2za4 s THR 70 N 0.91 2.11 0.12 4.11 -4.23 -1.26 -4.73 115.64 112.67 2za4 s THR 70 Ca 0.35 -2.16 0.10 0.00 -1.18 0.00 0.00 61.69 58.80 2za4 s THR 70 Cb -0.17 -2.09 -0.04 0.00 1.34 0.00 0.00 72.50 71.54 2za4 s THR 70 CO 0.16 -0.37 -0.23 0.26 -0.54 0.00 0.00 174.62 173.90 2za4 s TRP 71 N -2.34 2.41 0.13 3.99 0.52 -1.26 -1.08 118.94 121.32 2za4 s TRP 71 Ca 0.23 -0.33 0.03 0.00 0.02 0.00 0.00 56.10 56.04 2za4 s TRP 71 Cb -0.05 -1.30 -0.04 0.00 -1.15 0.00 0.00 33.47 30.93 2za4 s TRP 71 CO 0.10 0.35 -0.06 1.03 0.02 0.00 0.00 176.95 178.39 2za4 s ARG 72 N -2.05 0.96 0.21 4.98 0.52 -0.25 -0.39 118.95 122.93 2za4 s ARG 72 Ca 0.16 -1.41 0.06 0.00 -0.52 0.00 0.00 55.73 54.02 2za4 s ARG 72 Cb -0.10 -0.34 -0.05 0.00 0.52 0.00 0.00 34.95 34.98 2za4 s ARG 72 CO 0.08 -0.02 -0.09 -1.83 0.02 0.00 0.00 175.30 173.46 2za4 s GLU 73 N -3.83 1.30 -0.10 3.54 -1.05 -0.48 -1.51 118.70 116.57 2za4 s GLU 73 Ca 0.16 -1.61 -0.20 0.00 -0.15 0.00 0.00 54.97 53.17 2za4 s GLU 73 Cb 0.05 -0.90 0.05 0.00 -0.44 0.00 0.00 34.13 32.88 2za4 s GLU 73 CO -0.01 0.08 0.48 0.00 0.95 0.00 0.00 175.26 176.75 2za4 s ALA 74 N -3.15 -1.22 0.25 -0.84 0.00 -0.60 -0.32 121.76 115.89 2za4 s ALA 74 Ca 0.23 1.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.95 2za4 s ALA 74 Cb 0.02 -0.35 -0.09 0.00 0.00 0.00 0.00 23.12 22.70 2za4 s ALA 74 CO 0.06 -0.27 1.11 -0.51 0.00 0.00 0.00 175.76 176.15 2za4 s ASP 75 N -0.57 7.24 0.12 0.00 1.11 0.32 -0.79 116.67 124.11 2za4 s ASP 75 Ca -0.07 2.24 0.09 0.00 0.18 0.00 0.00 52.55 54.99 2za4 s ASP 75 Cb -0.03 -2.62 -0.04 0.00 1.07 0.00 0.00 42.92 41.30 2za4 s ASP 75 CO 0.04 -0.18 -0.20 -0.63 1.18 0.00 0.00 175.17 175.38 2za4 s ILE 76 N -0.87 2.71 -1.97 0.77 1.09 -0.80 -4.72 121.20 117.40 2za4 s ILE 76 Ca 0.46 -1.57 0.00 0.00 -1.10 0.00 0.00 60.65 58.44 2za4 s ILE 76 Cb -0.32 -2.24 0.00 0.00 -1.06 0.00 0.00 42.46 38.85 2za4 s ILE 76 CO 0.40 0.09 0.00 0.59 -0.10 0.00 0.00 174.94 175.92 2za4 n ASN 77 N 0.80 -5.71 -4.86 3.58 3.02 0.08 -4.57 115.26 107.60 2za4 n ASN 77 Ca -0.16 0.23 -0.37 0.00 -0.03 0.00 0.00 54.58 54.25 2za4 n ASN 77 Cb 0.53 -4.87 -0.06 0.00 -0.61 0.00 0.00 39.78 34.77 2za4 n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2za4 s TYR 78 N -2.91 3.57 0.00 3.10 5.04 -1.26 -4.94 117.35 119.94 2za4 s TYR 78 Ca 0.00 0.50 0.00 0.00 -2.44 0.00 0.00 57.07 55.13 2za4 s TYR 78 Cb 0.00 -1.95 0.00 0.00 0.35 0.00 0.00 41.96 40.36 2za4 s TYR 78 CO 0.00 0.69 0.00 0.25 -1.34 0.00 0.00 175.55 175.15 2za4 n THR 79 N 2.12 0.00 -3.44 4.34 -2.24 -1.26 -4.89 114.28 108.91 2za4 n THR 79 Ca -0.20 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.47 2za4 n THR 79 Cb 0.55 -0.06 -0.02 0.00 -2.10 0.00 0.00 70.33 68.70 2za4 n THR 79 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2za4 s SER 80 N -3.12 -0.54 0.00 3.42 1.04 -1.26 -4.72 113.70 108.52 2za4 s SER 80 Ca 0.00 0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.46 2za4 s SER 80 Cb 0.00 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.68 2za4 s SER 80 CO 0.00 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 173.94 2za4 n GLY 81 N -0.30 -0.64 3.78 7.32 0.00 -1.26 -4.87 105.19 109.22 2za4 n GLY 81 Ca -0.16 -1.29 -0.32 0.00 0.00 0.00 0.00 46.02 44.26 2za4 n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2za4 s PHE 82 N 0.00 2.76 0.96 1.61 0.08 -1.26 -4.46 117.98 117.68 2za4 s PHE 82 Ca 0.00 1.52 -0.12 0.00 0.12 0.00 0.00 56.93 58.45 2za4 s PHE 82 Cb 0.00 -3.05 0.16 0.00 -0.57 0.00 0.00 43.02 39.56 2za4 s PHE 82 CO 0.00 -1.53 1.10 1.03 -0.10 0.00 0.00 175.22 175.72 2za4 s ARG 83 N -4.49 0.75 0.00 0.44 0.52 -1.26 -4.99 118.95 109.92 2za4 s ARG 83 Ca 0.63 0.56 0.00 0.00 -0.52 0.00 0.00 55.73 56.40 2za4 s ARG 83 Cb -0.18 -1.77 0.00 0.00 0.52 0.00 0.00 34.95 33.52 2za4 s ARG 83 CO 0.47 -2.52 0.00 0.27 0.02 0.00 0.00 175.30 173.54 2za4 n ASN 84 N -4.04 1.49 -1.33 0.23 0.23 -1.26 -5.05 115.26 105.52 2za4 n ASN 84 Ca 0.06 -0.56 0.12 0.00 -0.53 0.00 0.00 54.58 53.67 2za4 n ASN 84 Cb 0.57 0.00 0.31 0.00 -2.08 0.00 0.00 39.78 38.58 2za4 n ASN 84 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2za4 n SER 85 N -0.84 3.91 -4.68 0.53 3.41 -1.26 -4.94 113.62 109.75 2za4 n SER 85 Ca 0.00 -2.00 -0.38 0.00 -0.26 0.00 0.00 58.87 56.23 2za4 n SER 85 Cb 0.00 -0.46 -0.07 0.00 -0.26 0.00 0.00 64.21 63.41 2za4 n SER 85 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2za4 s ASP 86 N -1.06 6.49 -0.01 4.04 1.01 -1.26 -1.91 116.67 123.98 2za4 s ASP 86 Ca 0.48 0.58 -0.02 0.00 0.71 0.00 0.00 52.55 54.30 2za4 s ASP 86 Cb 0.25 -2.25 -0.00 0.00 1.01 0.00 0.00 42.92 41.93 2za4 s ASP 86 CO 0.33 -0.08 0.03 -0.13 0.21 0.00 0.00 175.17 175.53 2za4 s ARG 87 N 1.28 0.13 -0.12 8.23 1.81 -0.42 -1.91 118.95 127.95 2za4 s ARG 87 Ca 0.21 -0.11 -0.03 0.00 -1.72 0.00 0.00 55.73 54.07 2za4 s ARG 87 Cb -0.15 0.05 -0.03 0.00 -0.45 0.00 0.00 34.95 34.37 2za4 s ARG 87 CO 0.08 -0.02 0.00 -1.50 -0.68 0.00 0.00 175.30 173.18 2za4 s ILE 88 N -0.37 4.28 -0.14 1.52 1.10 0.03 -1.49 121.20 126.13 2za4 s ILE 88 Ca -0.04 -0.24 0.00 0.00 -0.51 0.00 0.00 60.65 59.86 2za4 s ILE 88 Cb -0.03 -2.85 -0.01 0.00 0.15 0.00 0.00 42.46 39.73 2za4 s ILE 88 CO -0.00 0.55 -0.15 -0.76 -2.11 0.00 0.00 174.94 172.47 2za4 s LEU 89 N -0.31 2.55 -0.01 8.50 2.01 0.46 -1.55 118.68 130.33 2za4 s LEU 89 Ca 0.06 -0.42 0.03 0.00 0.01 0.00 0.00 54.13 53.82 2za4 s LEU 89 Cb -0.12 -1.57 -0.01 0.00 0.01 0.00 0.00 46.19 44.50 2za4 s LEU 89 CO 0.02 0.12 -0.11 -0.72 1.01 0.00 0.00 176.35 176.68 2za4 s TYR 90 N 0.60 0.97 0.50 0.29 1.13 -0.57 -0.27 117.35 120.00 2za4 s TYR 90 Ca -0.09 -0.20 0.03 0.00 -1.41 0.00 0.00 57.07 55.41 2za4 s TYR 90 Cb -0.16 -0.64 0.02 0.00 -1.10 0.00 0.00 41.96 40.09 2za4 s TYR 90 CO 0.03 -0.03 0.70 -1.54 -2.51 0.00 0.00 175.55 172.20 2za4 s SER 91 N -0.18 5.45 0.58 -0.18 1.04 -0.52 -1.09 113.70 118.81 2za4 s SER 91 Ca 0.03 -0.11 0.36 0.00 0.48 0.00 0.00 55.95 56.71 2za4 s SER 91 Cb -0.05 -0.88 1.68 0.00 0.10 0.00 0.00 66.02 66.87 2za4 s SER 91 CO -0.00 -0.98 2.10 0.77 0.98 0.00 0.00 173.24 176.11 2za4 h SER 92 N 0.29 0.00 -0.42 7.02 4.64 -1.45 -0.98 113.55 122.65 2za4 h SER 92 Ca -0.42 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.87 2za4 h SER 92 Cb 1.29 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.36 2za4 h SER 92 CO 0.51 0.01 0.03 -0.90 -0.87 0.00 0.00 176.83 175.60 2za4 n ASP 93 N -3.12 4.51 -3.08 4.97 5.75 -1.26 -4.98 116.55 119.33 2za4 n ASP 93 Ca -0.01 -3.06 -0.21 0.00 -0.01 0.00 0.00 54.79 51.51 2za4 n ASP 93 Cb 0.24 -0.62 0.06 0.00 -1.03 0.00 0.00 41.12 39.77 2za4 n ASP 93 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2za4 n TRP 94 N -0.15 -2.33 -3.11 2.11 7.02 -0.37 -5.03 117.44 115.57 2za4 n TRP 94 Ca 0.26 0.78 -0.36 0.00 -1.02 0.00 0.00 57.50 57.16 2za4 n TRP 94 Cb 1.05 -4.45 -0.06 0.00 -2.42 0.00 0.00 31.31 25.43 2za4 n TRP 94 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2za4 s LEU 95 N -6.41 4.34 -0.05 -0.99 1.43 -1.26 -4.83 118.68 110.91 2za4 s LEU 95 Ca 0.45 1.40 0.02 0.00 -1.03 0.00 0.00 54.13 54.97 2za4 s LEU 95 Cb -0.20 -3.58 0.01 0.00 0.03 0.00 0.00 46.19 42.45 2za4 s LEU 95 CO 0.56 0.03 -0.09 -0.63 0.23 0.00 0.00 176.35 176.45 2za4 s ILE 96 N -1.53 0.85 0.17 -0.59 1.01 -0.55 -1.43 121.20 119.12 2za4 s ILE 96 Ca 0.43 -0.33 0.07 0.00 0.00 0.00 0.00 60.65 60.82 2za4 s ILE 96 Cb -0.16 -0.80 -0.04 0.00 0.01 0.00 0.00 42.46 41.47 2za4 s ILE 96 CO 0.21 0.29 -0.14 -0.31 0.00 0.00 0.00 174.94 174.98 2za4 s TYR 97 N 0.64 1.59 0.02 3.97 1.51 0.63 -0.55 117.35 125.16 2za4 s TYR 97 Ca -0.11 -0.58 0.07 0.00 -1.01 0.00 0.00 57.07 55.44 2za4 s TYR 97 Cb -0.14 -0.78 -0.02 0.00 -0.11 0.00 0.00 41.96 40.91 2za4 s TYR 97 CO 0.02 0.26 -0.20 0.00 -1.11 0.00 0.00 175.55 174.52 2za4 s ALA 98 N -2.66 1.71 -0.01 3.71 0.00 0.21 -0.40 121.76 124.32 2za4 s ALA 98 Ca 0.17 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 51.18 2za4 s ALA 98 Cb -0.02 -0.37 -0.00 0.00 0.00 0.00 0.00 23.12 22.72 2za4 s ALA 98 CO 0.05 0.40 -0.09 -0.08 0.00 0.00 0.00 175.76 176.04 2za4 s THR 99 N -0.66 0.72 0.00 0.00 -1.32 -0.55 -1.30 115.64 112.52 2za4 s THR 99 Ca 0.07 -0.36 0.00 0.00 -1.21 0.00 0.00 61.69 60.19 2za4 s THR 99 Cb -0.08 -0.62 0.00 0.00 -1.51 0.00 0.00 72.50 70.29 2za4 s THR 99 CO 0.01 0.21 0.78 0.35 -2.21 0.00 0.00 174.62 173.76 2za4 n THR 100 N 3.05 0.57 -2.27 5.08 -2.24 -1.26 -1.30 114.28 115.91 2za4 n THR 100 Ca -0.15 -0.77 -0.17 0.00 -2.27 0.00 0.00 64.05 60.69 2za4 n THR 100 Cb 0.56 0.72 0.03 0.00 -2.10 0.00 0.00 70.33 69.54 2za4 n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2za4 n ASP 101 N -0.29 3.89 -3.60 3.42 5.68 -1.21 -4.57 116.55 119.86 2za4 n ASP 101 Ca 0.00 -3.22 -0.24 0.00 -0.50 0.00 0.00 54.79 50.83 2za4 n ASP 101 Cb 0.15 -0.38 0.04 0.00 -1.14 0.00 0.00 41.12 39.79 2za4 n ASP 101 CO 0.00 0.00 0.00 1.57 -1.33 0.00 0.00 177.20 177.44 2za4 n HIS 102 N -0.68 -2.02 -0.97 2.11 -0.00 -0.80 -2.71 115.22 110.15 2za4 n HIS 102 Ca 0.33 0.70 0.00 0.00 -0.00 0.00 0.00 57.72 58.74 2za4 n HIS 102 Cb 0.92 -3.97 0.00 0.00 -0.00 0.00 0.00 29.99 26.94 2za4 n HIS 102 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 2za4 n TYR 103 N -4.02 0.00 -0.04 1.57 4.02 -1.26 -4.91 117.16 112.52 2za4 n TYR 103 Ca -0.18 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.58 2za4 n TYR 103 Cb 0.63 -0.88 -0.09 0.00 -0.02 0.00 0.00 39.34 38.99 2za4 n TYR 103 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 2za4 h GLN 104 N 0.69 0.22 -4.73 -0.72 4.15 -1.93 -3.46 115.11 109.33 2za4 h GLN 104 Ca 0.00 -0.15 -0.26 0.00 0.77 0.00 0.00 58.65 59.01 2za4 h GLN 104 Cb 0.39 0.02 -0.17 0.00 0.21 0.00 0.00 27.48 27.93 2za4 h GLN 104 CO 0.00 0.75 -0.71 0.95 -1.93 0.00 0.00 178.83 177.89 2za4 s THR 105 N -3.88 0.74 0.09 2.39 -4.23 -1.26 -5.09 115.64 104.41 2za4 s THR 105 Ca -0.15 -1.68 0.03 0.00 -1.18 0.00 0.00 61.69 58.72 2za4 s THR 105 Cb 0.03 -1.37 -0.04 0.00 1.34 0.00 0.00 72.50 72.46 2za4 s THR 105 CO 0.73 -0.68 -0.09 -0.36 -0.54 0.00 0.00 174.62 173.68 2za4 s PHE 106 N -2.81 1.01 -0.05 3.99 0.08 -1.26 -4.45 117.98 114.49 2za4 s PHE 106 Ca 0.06 -0.69 0.01 0.00 0.12 0.00 0.00 56.93 56.42 2za4 s PHE 106 Cb -0.00 -0.56 0.02 0.00 -0.57 0.00 0.00 43.02 41.91 2za4 s PHE 106 CO -0.02 -0.03 -0.04 0.99 -0.10 0.00 0.00 175.22 176.03 2za4 s THR 107 N -2.58 0.50 -0.03 0.64 2.01 -0.42 -4.95 115.64 110.81 2za4 s THR 107 Ca 0.06 -0.08 -0.30 0.00 0.31 0.00 0.00 61.69 61.67 2za4 s THR 107 Cb -0.02 -0.55 -0.04 0.00 0.01 0.00 0.00 72.50 71.90 2za4 s THR 107 CO -0.01 0.23 1.32 -0.75 -0.69 0.00 0.00 174.62 174.72 2za4 s LYS 108 N 1.06 4.30 -0.00 4.92 2.20 -1.26 -0.62 119.74 130.34 2za4 s LYS 108 Ca -0.09 1.84 0.06 0.00 -0.36 0.00 0.00 55.97 57.42 2za4 s LYS 108 Cb -0.14 -3.59 -0.07 0.00 -1.51 0.00 0.00 37.83 32.52 2za4 s LYS 108 CO -0.01 -0.54 0.24 0.44 -0.36 0.00 0.00 175.35 175.12 2za4 n ILE 109 N 4.71 0.00 -1.54 5.43 -5.35 0.29 -4.94 119.36 117.96 2za4 n ILE 109 Ca 0.12 -0.33 0.00 0.00 -0.27 0.00 0.00 62.75 62.28 2za4 n ILE 109 Cb 0.45 0.91 0.00 0.00 -1.74 0.00 0.00 39.64 39.25 2za4 n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33