#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2igl n MET 23 N 0.00 2.28 -1.52 -0.41 2.00 -1.26 -0.90 117.12 117.31 2igl n MET 23 Ca 0.00 0.80 -0.40 0.00 0.00 0.00 0.00 57.70 58.11 2igl n MET 23 Cb 0.00 -2.46 0.03 0.00 0.00 0.00 0.00 33.22 30.79 2igl n MET 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2igl n ALA 24 N 0.94 -0.74 -2.53 3.04 0.00 -1.26 -4.02 120.51 115.95 2igl n ALA 24 Ca 0.06 0.09 -0.26 0.00 0.00 0.00 0.00 53.44 53.33 2igl n ALA 24 Cb 0.36 -1.91 -0.08 0.00 0.00 0.00 0.00 19.45 17.81 2igl n ALA 24 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2igl s GLN 25 N -2.03 1.95 0.30 0.00 -0.21 -1.26 -4.88 119.66 113.53 2igl s GLN 25 Ca 0.67 -2.20 -0.01 0.00 0.02 0.00 0.00 55.36 53.84 2igl s GLN 25 Cb -0.51 -0.65 0.46 0.00 1.00 0.00 0.00 33.01 33.30 2igl s GLN 25 CO 0.55 -0.48 1.93 1.96 -2.12 0.00 0.00 175.29 177.12 2igl h GLN 26 N 1.75 0.96 -6.45 2.91 1.08 -1.96 -3.41 115.11 110.00 2igl h GLN 26 Ca -0.36 -0.10 -0.69 0.00 -1.45 0.00 0.00 58.65 56.06 2igl h GLN 26 Cb 1.28 -0.19 -0.22 0.00 -0.05 0.00 0.00 27.48 28.29 2igl h GLN 26 CO 0.57 0.70 -0.78 1.21 -0.95 0.00 0.00 178.83 179.58 2igl s ASN 27 N -6.42 3.94 0.47 1.46 3.84 -1.26 -5.03 114.94 111.94 2igl s ASN 27 Ca -0.11 -0.31 0.30 0.00 0.21 0.00 0.00 52.86 52.96 2igl s ASN 27 Cb 0.17 -0.74 1.11 0.00 -0.55 0.00 0.00 41.25 41.24 2igl s ASN 27 CO 0.79 0.30 1.87 -0.29 -2.79 0.00 0.00 177.10 176.98 2igl h ILE 28 N 4.10 0.00 -3.55 -5.21 2.10 -1.87 -3.45 117.51 109.63 2igl h ILE 28 Ca -0.47 -0.55 -0.38 0.00 1.08 0.00 0.00 64.86 64.55 2igl h ILE 28 Cb 1.15 1.51 -0.33 0.00 -1.09 0.00 0.00 36.82 38.06 2igl h ILE 28 CO 0.49 0.00 -0.76 -0.22 -1.08 0.00 0.00 178.15 176.58 2igl s LEU 29 N -5.85 1.40 0.08 2.19 2.96 -1.26 -0.63 118.68 117.58 2igl s LEU 29 Ca 0.03 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 2igl s LEU 29 Cb 0.08 -0.35 -0.03 0.00 0.50 0.00 0.00 46.19 46.39 2igl s LEU 29 CO 0.54 -0.05 -0.08 -0.94 -1.32 0.00 0.00 176.35 174.51 2igl s SER 30 N 0.76 1.10 0.10 3.68 1.04 -0.44 -0.85 113.70 119.08 2igl s SER 30 Ca -0.09 -0.79 0.02 0.00 0.48 0.00 0.00 55.95 55.57 2igl s SER 30 Cb -0.12 0.05 -0.04 0.00 0.10 0.00 0.00 66.02 66.01 2igl s SER 30 CO -0.00 -0.32 -0.07 0.68 0.98 0.00 0.00 173.24 174.51 2igl s VAL 31 N -2.50 0.71 -0.14 5.02 -7.23 -0.76 -1.07 120.40 114.43 2igl s VAL 31 Ca 0.02 -1.86 -0.06 0.00 -1.81 0.00 0.00 61.98 58.27 2igl s VAL 31 Cb -0.02 -1.58 0.06 0.00 0.56 0.00 0.00 36.38 35.39 2igl s VAL 31 CO -0.02 -0.81 0.31 -2.28 -0.31 0.00 0.00 175.10 171.98 2igl s HIS 32 N -3.37 -0.47 -0.21 2.82 2.46 -1.17 -1.88 115.29 113.46 2igl s HIS 32 Ca 0.10 1.03 -0.03 0.00 0.47 0.00 0.00 55.06 56.63 2igl s HIS 32 Cb 0.04 0.10 -0.01 0.00 -0.13 0.00 0.00 32.58 32.58 2igl s HIS 32 CO -0.04 -0.32 -0.07 0.42 -2.47 0.00 0.00 174.74 172.26 2igl s ILE 33 N 1.76 3.20 -0.22 0.89 1.01 0.30 -0.16 121.20 127.96 2igl s ILE 33 Ca -0.06 -0.56 -0.04 0.00 0.00 0.00 0.00 60.65 59.99 2igl s ILE 33 Cb -0.11 -2.44 -0.01 0.00 0.01 0.00 0.00 42.46 39.92 2igl s ILE 33 CO -0.10 0.45 -0.03 -0.76 0.00 0.00 0.00 174.94 174.50 2igl s LEU 34 N 1.35 2.97 -0.52 2.97 1.43 -0.34 -1.29 118.68 125.25 2igl s LEU 34 Ca 0.04 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.49 2igl s LEU 34 Cb -0.14 -1.76 0.03 0.00 0.03 0.00 0.00 46.19 44.34 2igl s LEU 34 CO -0.04 -0.02 1.21 0.21 0.23 0.00 0.00 176.35 177.94 2igl s ASN 35 N 1.48 6.48 0.00 2.29 3.84 0.02 -0.79 114.94 128.26 2igl s ASN 35 Ca 0.06 0.33 0.16 0.00 0.21 0.00 0.00 52.86 53.62 2igl s ASN 35 Cb -0.14 -2.55 0.72 0.00 -0.55 0.00 0.00 41.25 38.73 2igl s ASN 35 CO -0.02 -1.41 1.52 0.00 -2.79 0.00 0.00 177.10 174.40 2igl n GLN 36 N 8.20 0.04 0.04 0.43 1.13 0.43 -0.53 117.38 127.12 2igl n GLN 36 Ca 0.11 0.20 0.04 0.00 -1.94 0.00 0.00 57.00 55.41 2igl n GLN 36 Cb 0.49 -1.50 -0.07 0.00 0.11 0.00 0.00 30.24 29.27 2igl n GLN 36 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2igl n GLN 37 N -1.46 0.63 -0.00 -1.09 6.02 -1.26 -4.28 117.38 115.93 2igl n GLN 37 Ca 0.05 0.13 0.04 0.00 -0.01 0.00 0.00 57.00 57.21 2igl n GLN 37 Cb 0.18 -1.76 -0.07 0.00 1.02 0.00 0.00 30.24 29.61 2igl n GLN 37 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2igl n THR 38 N -2.75 0.00 -1.28 5.09 -2.24 -1.11 -4.99 114.28 107.00 2igl n THR 38 Ca -0.08 -0.22 -0.08 0.00 -2.27 0.00 0.00 64.05 61.40 2igl n THR 38 Cb 0.75 0.43 -0.03 0.00 -2.10 0.00 0.00 70.33 69.37 2igl n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2igl n GLY 39 N 1.84 0.96 3.34 3.38 0.00 0.32 -5.00 105.19 110.02 2igl n GLY 39 Ca -0.01 -0.67 -0.17 0.00 0.00 0.00 0.00 46.02 45.17 2igl n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2igl s LYS 40 N -2.78 1.33 0.71 1.61 -0.14 -1.18 -4.96 119.74 114.32 2igl s LYS 40 Ca 0.00 -1.65 -0.15 0.00 -1.36 0.00 0.00 55.97 52.80 2igl s LYS 40 Cb 0.00 -0.74 0.03 0.00 -1.68 0.00 0.00 37.83 35.43 2igl s LYS 40 CO 0.00 -0.03 1.19 -2.14 -0.76 0.00 0.00 175.35 173.62 2igl s PRO 41 N -3.81 2.32 -0.50 -1.68 0.02 -1.26 -0.80 135.00 129.29 2igl s PRO 41 Ca 0.26 1.71 -0.17 0.00 0.02 0.00 0.00 61.00 62.83 2igl s PRO 41 Cb 0.04 -1.86 0.08 0.00 0.02 0.00 0.00 34.50 32.78 2igl s PRO 41 CO 0.08 -1.69 0.49 0.00 -0.33 0.00 0.00 177.00 175.54 2igl s ALA 42 N -2.00 3.52 0.37 -1.55 0.00 -0.41 -4.64 121.76 117.05 2igl s ALA 42 Ca 0.74 -2.08 -0.06 0.00 0.00 0.00 0.00 51.96 50.56 2igl s ALA 42 Cb -0.28 -3.20 -0.05 0.00 0.00 0.00 0.00 23.12 19.60 2igl s ALA 42 CO 0.44 -1.88 0.65 0.00 0.00 0.00 0.00 175.76 174.97 2igl s ALA 43 N 1.95 3.52 -1.46 0.00 0.00 -1.26 -4.18 121.76 120.33 2igl s ALA 43 Ca 0.07 -0.51 -0.08 0.00 0.00 0.00 0.00 51.96 51.44 2igl s ALA 43 Cb -0.24 -2.43 0.04 0.00 0.00 0.00 0.00 23.12 20.49 2igl s ALA 43 CO 0.07 0.02 0.75 -3.47 0.00 0.00 0.00 175.76 173.13 2igl n ASP 44 N -1.42 -5.42 -4.71 0.00 2.03 -0.38 -4.93 116.55 101.72 2igl n ASP 44 Ca -0.01 -0.44 -0.37 0.00 0.52 0.00 0.00 54.79 54.49 2igl n ASP 44 Cb 0.54 -4.36 -0.07 0.00 -0.72 0.00 0.00 41.12 36.51 2igl n ASP 44 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2igl s VAL 45 N -3.17 5.25 0.20 5.18 1.01 -1.26 -4.75 120.40 122.86 2igl s VAL 45 Ca 0.44 0.67 -0.30 0.00 0.00 0.00 0.00 61.98 62.79 2igl s VAL 45 Cb -0.21 -3.69 -0.08 0.00 0.00 0.00 0.00 36.38 32.39 2igl s VAL 45 CO 0.54 0.33 1.15 -0.89 0.00 0.00 0.00 175.10 176.24 2igl s THR 46 N 0.77 3.66 -0.04 3.92 2.01 -1.26 -1.34 115.64 123.36 2igl s THR 46 Ca 0.19 1.45 0.00 0.00 0.31 0.00 0.00 61.69 63.64 2igl s THR 46 Cb -0.14 -3.92 0.03 0.00 0.01 0.00 0.00 72.50 68.47 2igl s THR 46 CO 0.06 0.26 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.56 2igl s VAL 47 N -0.29 0.25 0.25 3.82 1.01 0.38 -1.06 120.40 124.76 2igl s VAL 47 Ca 0.50 0.09 0.08 0.00 0.00 0.00 0.00 61.98 62.65 2igl s VAL 47 Cb -0.31 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 2igl s VAL 47 CO 0.37 0.18 0.11 0.42 0.00 0.00 0.00 175.10 176.18 2igl s THR 48 N 1.27 4.05 -0.08 3.92 -4.23 -0.70 -1.56 115.64 118.31 2igl s THR 48 Ca -0.06 -1.59 0.02 0.00 -1.18 0.00 0.00 61.69 58.88 2igl s THR 48 Cb -0.13 -3.17 0.01 0.00 1.34 0.00 0.00 72.50 70.55 2igl s THR 48 CO -0.02 -0.34 -0.14 -0.22 -0.54 0.00 0.00 174.62 173.36 2igl s LEU 49 N -3.72 1.68 0.09 4.79 2.96 -0.18 -1.00 118.68 123.31 2igl s LEU 49 Ca 0.32 -0.36 0.06 0.00 -0.22 0.00 0.00 54.13 53.93 2igl s LEU 49 Cb -0.07 -0.95 -0.03 0.00 0.50 0.00 0.00 46.19 45.63 2igl s LEU 49 CO 0.23 0.03 -0.15 -1.61 -1.32 0.00 0.00 176.35 173.53 2igl s GLU 50 N 0.77 0.93 -0.09 1.98 2.02 0.57 -0.33 118.70 124.55 2igl s GLU 50 Ca -0.12 -1.09 0.00 0.00 0.02 0.00 0.00 54.97 53.79 2igl s GLU 50 Cb -0.16 -0.94 -0.03 0.00 0.10 0.00 0.00 34.13 33.11 2igl s GLU 50 CO 0.02 0.20 -0.08 0.21 0.02 0.00 0.00 175.26 175.64 2igl s LYS 51 N -2.09 2.98 -0.05 1.61 2.20 0.16 -1.01 119.74 123.53 2igl s LYS 51 Ca 0.03 -0.57 -0.30 0.00 -0.36 0.00 0.00 55.97 54.77 2igl s LYS 51 Cb -0.08 -2.64 -0.03 0.00 -1.51 0.00 0.00 37.83 33.57 2igl s LYS 51 CO 0.03 0.53 1.04 0.21 -0.36 0.00 0.00 175.35 176.80 2igl s LYS 52 N -0.45 4.46 0.00 4.03 2.20 -0.45 -1.10 119.74 128.43 2igl s LYS 52 Ca 0.06 1.48 0.00 0.00 -0.36 0.00 0.00 55.97 57.15 2igl s LYS 52 Cb -0.12 -3.50 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 2igl s LYS 52 CO 0.02 -0.24 0.00 0.00 -0.36 0.00 0.00 175.35 174.77 2igl n ALA 53 N 4.56 0.00 -1.95 3.13 0.00 -0.48 -4.80 120.51 120.97 2igl n ALA 53 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.16 2igl n ALA 53 Cb 0.49 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.91 2igl n ALA 53 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2igl s ASP 54 N 0.95 5.09 0.00 0.00 1.01 -1.26 -3.82 116.67 118.64 2igl s ASP 54 Ca 0.00 0.34 0.00 0.00 0.71 0.00 0.00 52.55 53.60 2igl s ASP 54 Cb 0.00 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.40 2igl s ASP 54 CO 0.00 -2.53 0.00 -3.20 0.21 0.00 0.00 175.17 169.65 2igl n ASN 55 N 13.53 0.00 -0.26 0.27 5.15 -1.26 -4.89 115.26 127.81 2igl n ASN 55 Ca 0.26 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.24 2igl n ASN 55 Cb 0.52 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.77 2igl n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2igl n GLY 56 N 0.00 5.12 3.04 8.20 0.00 -1.25 -5.16 105.19 115.14 2igl n GLY 56 Ca 0.00 -2.05 -0.14 0.00 0.00 0.00 0.00 46.02 43.82 2igl n GLY 56 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2igl s TRP 57 N 1.21 0.65 -0.10 1.61 0.52 -1.26 -1.39 118.94 120.19 2igl s TRP 57 Ca 0.00 -0.37 0.03 0.00 0.02 0.00 0.00 56.10 55.78 2igl s TRP 57 Cb 0.00 -0.40 -0.01 0.00 -1.15 0.00 0.00 33.47 31.92 2igl s TRP 57 CO 0.00 -0.05 -0.21 -1.17 0.02 0.00 0.00 176.95 175.54 2igl s LEU 58 N -1.13 2.30 -0.19 2.99 2.96 -0.26 -4.93 118.68 120.42 2igl s LEU 58 Ca -0.06 -0.46 -0.24 0.00 -0.22 0.00 0.00 54.13 53.15 2igl s LEU 58 Cb -0.08 -1.47 -0.02 0.00 0.50 0.00 0.00 46.19 45.13 2igl s LEU 58 CO 0.00 0.19 0.77 -1.58 -1.32 0.00 0.00 176.35 174.41 2igl s GLN 59 N 0.16 4.26 -0.06 1.98 0.74 -1.26 0.37 119.66 125.84 2igl s GLN 59 Ca -0.11 0.88 0.15 0.00 0.05 0.00 0.00 55.36 56.33 2igl s GLN 59 Cb -0.16 -3.58 -0.22 0.00 1.10 0.00 0.00 33.01 30.15 2igl s GLN 59 CO 0.06 -0.32 0.55 1.28 -0.55 0.00 0.00 175.29 176.32 2igl n LEU 60 N 5.25 0.64 -3.64 3.68 4.77 0.55 -4.96 117.00 123.29 2igl n LEU 60 Ca 0.03 0.30 -0.02 0.00 -0.03 0.00 0.00 56.01 56.28 2igl n LEU 60 Cb 0.49 0.22 -0.01 0.00 -2.33 0.00 0.00 43.42 41.79 2igl n LEU 60 CO 0.47 0.35 0.91 0.21 -1.33 0.00 0.00 177.39 177.99 2igl s ASN 61 N -5.83 -0.14 -0.13 -1.43 2.47 -1.14 -4.55 114.94 104.18 2igl s ASN 61 Ca -0.06 -0.17 -0.10 0.00 0.42 0.00 0.00 52.86 52.95 2igl s ASN 61 Cb 0.08 0.28 0.04 0.00 -1.45 0.00 0.00 41.25 40.20 2igl s ASN 61 CO 0.83 -0.50 0.34 0.28 -3.72 0.00 0.00 177.10 174.32 2igl s THR 62 N -2.76 -0.01 0.33 -5.21 -1.32 -1.26 -1.01 115.64 104.40 2igl s THR 62 Ca 0.12 0.04 -0.10 0.00 -1.21 0.00 0.00 61.69 60.54 2igl s THR 62 Cb 0.01 -0.49 0.02 0.00 -1.51 0.00 0.00 72.50 70.53 2igl s THR 62 CO -0.03 0.02 0.59 0.00 -2.21 0.00 0.00 174.62 172.98 2igl s ALA 63 N 0.59 -0.04 -0.02 11.08 0.00 -0.60 -5.00 121.76 127.77 2igl s ALA 63 Ca -0.03 -1.07 0.06 0.00 0.00 0.00 0.00 51.96 50.92 2igl s ALA 63 Cb -0.05 0.97 -0.02 0.00 0.00 0.00 0.00 23.12 24.03 2igl s ALA 63 CO -0.04 -0.88 -0.21 0.15 0.00 0.00 0.00 175.76 174.78 2igl s LYS 64 N -3.10 1.71 0.53 0.00 1.02 -1.26 -0.47 119.74 118.17 2igl s LYS 64 Ca 0.23 -0.75 -0.21 0.00 0.02 0.00 0.00 55.97 55.26 2igl s LYS 64 Cb -0.02 -1.65 -0.05 0.00 -0.52 0.00 0.00 37.83 35.59 2igl s LYS 64 CO 0.14 0.45 1.27 0.95 -0.92 0.00 0.00 175.35 177.24 2igl s THR 65 N -0.48 2.49 0.09 2.17 -4.23 -0.45 -4.82 115.64 110.40 2igl s THR 65 Ca 0.08 0.35 -0.01 0.00 -1.18 0.00 0.00 61.69 60.93 2igl s THR 65 Cb -0.08 -3.17 0.02 0.00 1.34 0.00 0.00 72.50 70.61 2igl s THR 65 CO -0.01 -0.02 0.12 -0.90 -0.54 0.00 0.00 174.62 173.27 2igl n ASP 66 N -1.00 0.01 0.32 3.99 5.68 0.34 -1.25 116.55 124.64 2igl n ASP 66 Ca 0.10 -1.04 0.22 0.00 -0.50 0.00 0.00 54.79 53.57 2igl n ASP 66 Cb 0.47 -0.09 1.16 0.00 -1.14 0.00 0.00 41.12 41.52 2igl n ASP 66 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2igl h LYS 67 N 0.00 0.00 -0.70 0.11 2.10 -1.94 0.14 116.57 116.28 2igl h LYS 67 Ca -0.04 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 2igl h LYS 67 Cb 0.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.44 2igl h LYS 67 CO 0.03 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.23 2igl n ASP 68 N -3.01 3.99 -1.09 7.07 8.00 -1.26 -4.74 116.55 125.52 2igl n ASP 68 Ca -0.03 -2.10 -0.12 0.00 0.71 0.00 0.00 54.79 53.24 2igl n ASP 68 Cb 0.07 -0.50 -0.04 0.00 -0.02 0.00 0.00 41.12 40.63 2igl n ASP 68 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2igl n GLY 69 N 1.50 0.93 3.49 0.44 0.00 0.50 -4.75 105.19 107.31 2igl n GLY 69 Ca 0.24 -0.42 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 2igl n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2igl s ARG 70 N -3.49 1.74 -0.32 1.61 0.52 -1.26 -0.54 118.95 117.21 2igl s ARG 70 Ca 0.00 -1.55 -0.01 0.00 -0.52 0.00 0.00 55.73 53.65 2igl s ARG 70 Cb 0.00 -1.91 0.11 0.00 0.52 0.00 0.00 34.95 33.67 2igl s ARG 70 CO 0.00 0.38 0.12 0.42 0.02 0.00 0.00 175.30 176.24 2igl s ILE 71 N -2.02 0.76 0.19 1.52 1.01 -0.79 -0.51 121.20 121.37 2igl s ILE 71 Ca 0.26 -1.44 0.21 0.00 0.00 0.00 0.00 60.65 59.67 2igl s ILE 71 Cb -0.07 -1.57 0.18 0.00 0.01 0.00 0.00 42.46 41.00 2igl s ILE 71 CO 0.13 -0.72 1.80 0.11 0.00 0.00 0.00 174.94 176.26 2igl h LYS 72 N 7.94 0.00 -2.70 2.79 1.57 -1.87 -2.01 116.57 122.29 2igl h LYS 72 Ca -0.12 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.06 2igl h LYS 72 Cb 1.00 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 32.92 2igl h LYS 72 CO 0.46 0.30 -0.82 0.00 -0.57 0.00 0.00 179.45 178.82 2igl s ALA 73 N -3.71 1.53 -0.08 3.86 0.00 -1.26 -4.41 121.76 117.69 2igl s ALA 73 Ca -0.00 -2.29 0.14 0.00 0.00 0.00 0.00 51.96 49.82 2igl s ALA 73 Cb 0.11 -1.72 -0.15 0.00 0.00 0.00 0.00 23.12 21.36 2igl s ALA 73 CO 0.66 -2.07 0.87 1.25 0.00 0.00 0.00 175.76 176.47 2igl h LEU 74 N 6.61 0.00 -9.81 0.00 5.85 -1.18 -3.46 115.31 113.32 2igl h LEU 74 Ca 0.08 0.00 -0.51 0.00 0.84 0.00 0.00 57.88 58.28 2igl h LEU 74 Cb 0.94 0.00 0.04 0.00 0.37 0.00 0.00 40.66 42.00 2igl h LEU 74 CO 0.37 0.74 0.56 0.86 -0.34 0.00 0.00 178.44 180.63 2igl s TRP 75 N -2.80 3.34 0.83 1.25 -0.11 -1.26 -4.80 118.94 115.39 2igl s TRP 75 Ca -0.02 1.53 -0.10 0.00 1.22 0.00 0.00 56.10 58.72 2igl s TRP 75 Cb 0.08 -3.47 0.09 0.00 -1.50 0.00 0.00 33.47 28.68 2igl s TRP 75 CO 0.81 -1.20 1.11 -1.25 -4.62 0.00 0.00 176.95 171.80 2igl s PRO 76 N -1.36 1.77 -1.04 5.86 0.04 -1.26 -4.81 135.00 134.19 2igl s PRO 76 Ca 0.48 1.29 -0.21 0.00 0.04 0.00 0.00 61.00 62.60 2igl s PRO 76 Cb -0.35 -1.83 -0.09 0.00 0.04 0.00 0.00 34.50 32.26 2igl s PRO 76 CO 0.45 -2.03 1.94 0.39 0.04 0.00 0.00 177.00 177.79 2igl n GLU 77 N -3.80 1.86 -3.96 4.56 -0.58 -1.26 -4.79 120.64 112.68 2igl n GLU 77 Ca 0.10 -2.29 -0.10 0.00 -0.42 0.00 0.00 57.16 54.46 2igl n GLU 77 Cb 0.53 -3.29 -0.06 0.00 -0.57 0.00 0.00 31.44 28.05 2igl n GLU 77 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2igl s GLN 78 N 5.20 1.31 0.08 3.49 -0.21 -1.26 -5.13 119.66 123.13 2igl s GLN 78 Ca 0.59 -1.18 -0.31 0.00 0.02 0.00 0.00 55.36 54.48 2igl s GLN 78 Cb 0.08 0.42 -0.07 0.00 1.00 0.00 0.00 33.01 34.44 2igl s GLN 78 CO 0.10 -0.51 1.34 0.99 -2.12 0.00 0.00 175.29 175.08 2igl s THR 79 N -3.98 3.60 0.39 -0.19 2.01 -1.26 -5.01 115.64 111.19 2igl s THR 79 Ca 0.19 1.12 -0.04 0.00 0.31 0.00 0.00 61.69 63.27 2igl s THR 79 Cb 0.02 -3.72 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 2igl s THR 79 CO 0.03 0.07 0.66 0.00 -0.69 0.00 0.00 174.62 174.69 2igl s ALA 80 N 1.34 3.54 0.10 7.40 0.00 -1.26 -5.11 121.76 127.77 2igl s ALA 80 Ca 0.63 -0.62 0.03 0.00 0.00 0.00 0.00 51.96 52.00 2igl s ALA 80 Cb -0.34 -2.38 -0.04 0.00 0.00 0.00 0.00 23.12 20.36 2igl s ALA 80 CO 0.29 -0.09 -0.09 0.95 0.00 0.00 0.00 175.76 176.82 2igl s THR 81 N -2.44 0.90 0.76 0.00 -4.23 -1.26 -4.96 115.64 104.41 2igl s THR 81 Ca 0.45 -1.76 -0.11 0.00 -1.18 0.00 0.00 61.69 59.08 2igl s THR 81 Cb -0.10 -1.49 0.05 0.00 1.34 0.00 0.00 72.50 72.30 2igl s THR 81 CO 0.38 -0.66 1.09 0.42 -0.54 0.00 0.00 174.62 175.30 2igl s THR 82 N -2.85 3.36 -4.73 3.99 -4.23 -1.26 -4.93 115.64 104.98 2igl s THR 82 Ca 0.08 0.45 0.00 0.00 -1.18 0.00 0.00 61.69 61.05 2igl s THR 82 Cb -0.00 -2.95 0.00 0.00 1.34 0.00 0.00 72.50 70.89 2igl s THR 82 CO -0.01 -0.56 0.00 0.61 -0.54 0.00 0.00 174.62 174.12 2igl n GLY 83 N -1.20 0.96 3.83 3.99 0.00 -0.04 -4.98 105.19 107.75 2igl n GLY 83 Ca 0.09 -1.94 -0.38 0.00 0.00 0.00 0.00 46.02 43.80 2igl n GLY 83 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2igl s ASP 84 N -3.53 6.75 0.31 1.61 1.01 -1.26 -0.99 116.67 120.57 2igl s ASP 84 Ca 0.00 0.90 0.03 0.00 0.71 0.00 0.00 52.55 54.19 2igl s ASP 84 Cb 0.00 -2.24 -0.04 0.00 1.01 0.00 0.00 42.92 41.66 2igl s ASP 84 CO 0.00 0.30 0.15 -0.31 0.21 0.00 0.00 175.17 175.53 2igl s TYR 85 N -0.91 1.61 -0.15 4.23 1.51 0.56 -1.34 117.35 122.86 2igl s TYR 85 Ca 0.23 -1.36 -0.09 0.00 -1.01 0.00 0.00 57.07 54.84 2igl s TYR 85 Cb -0.16 -0.87 0.05 0.00 -0.11 0.00 0.00 41.96 40.87 2igl s TYR 85 CO 0.12 -0.50 0.36 0.50 -1.11 0.00 0.00 175.55 174.92 2igl s ARG 86 N -3.82 0.35 -0.09 -0.62 3.52 -0.18 -1.06 118.95 117.05 2igl s ARG 86 Ca 0.35 0.68 -0.01 0.00 -0.13 0.00 0.00 55.73 56.63 2igl s ARG 86 Cb 0.05 -0.01 -0.03 0.00 -1.56 0.00 0.00 34.95 33.40 2igl s ARG 86 CO 0.17 -0.14 -0.04 0.14 -0.81 0.00 0.00 175.30 174.62 2igl s VAL 87 N 1.17 3.94 -0.23 7.11 -7.23 -0.53 -0.32 120.40 124.31 2igl s VAL 87 Ca -0.08 -0.38 0.02 0.00 -1.81 0.00 0.00 61.98 59.73 2igl s VAL 87 Cb -0.08 -2.64 0.04 0.00 0.56 0.00 0.00 36.38 34.26 2igl s VAL 87 CO -0.10 0.59 -0.14 -0.69 -0.31 0.00 0.00 175.10 174.45 2igl s VAL 88 N -0.66 2.20 -0.25 1.32 1.01 -0.17 -0.61 120.40 123.25 2igl s VAL 88 Ca 0.10 -1.34 -0.21 0.00 0.00 0.00 0.00 61.98 60.53 2igl s VAL 88 Cb -0.12 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 2igl s VAL 88 CO 0.02 0.19 0.68 -0.36 0.00 0.00 0.00 175.10 175.62 2igl s PHE 89 N 1.19 3.30 -1.39 5.22 0.40 -0.15 -1.72 117.98 124.83 2igl s PHE 89 Ca -0.03 0.91 -0.08 0.00 -0.60 0.00 0.00 56.93 57.12 2igl s PHE 89 Cb -0.17 -2.89 0.08 0.00 0.51 0.00 0.00 43.02 40.55 2igl s PHE 89 CO -0.08 -0.33 2.36 1.63 0.70 0.00 0.00 175.22 179.50 2igl n LYS 90 N 5.72 3.97 0.21 0.44 4.76 -0.22 -0.56 118.16 132.48 2igl n LYS 90 Ca 0.01 -3.13 0.10 0.00 -2.87 0.00 0.00 58.31 52.43 2igl n LYS 90 Cb 0.49 -2.81 0.26 0.00 -1.84 0.00 0.00 35.03 31.12 2igl n LYS 90 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 2igl h THR 91 N 3.13 0.28 -0.62 -0.18 1.35 -1.84 -3.01 112.91 112.02 2igl h THR 91 Ca 0.64 -1.23 -0.08 0.00 -0.55 0.00 0.00 66.41 65.19 2igl h THR 91 Cb 0.42 1.99 -0.02 0.00 -1.73 0.00 0.00 68.15 68.81 2igl h THR 91 CO 1.63 0.15 0.06 1.23 -0.25 0.00 0.00 175.52 178.33 2igl h GLY 92 N 3.31 1.14 1.31 5.82 0.00 -1.61 -1.76 103.07 111.29 2igl h GLY 92 Ca -0.00 -0.79 -0.14 0.00 0.00 0.00 0.00 47.33 46.40 2igl h GLY 92 CO 0.02 0.73 -0.36 -0.55 0.00 0.00 0.00 176.54 176.38 2igl h ASP 93 N 0.96 0.80 -0.57 0.19 3.32 -1.72 -0.24 116.42 119.16 2igl h ASP 93 Ca 0.18 -0.35 0.07 0.00 0.02 0.00 0.00 57.03 56.95 2igl h ASP 93 Cb 0.49 -0.22 -0.06 0.00 0.22 0.00 0.00 39.33 39.75 2igl h ASP 93 CO 0.02 1.08 0.26 0.22 -1.72 0.00 0.00 179.24 179.10 2igl h TYR 94 N 0.63 0.46 -0.01 4.55 3.20 -1.34 -0.81 116.97 123.66 2igl h TYR 94 Ca 0.06 0.03 -0.26 0.00 3.14 0.00 0.00 58.73 61.69 2igl h TYR 94 Cb 0.90 -0.12 0.02 0.00 1.54 0.00 0.00 36.73 39.07 2igl h TYR 94 CO 0.05 0.18 -1.02 0.74 -1.64 0.00 0.00 178.16 176.46 2igl h PHE 95 N 0.48 1.05 -0.19 -3.82 0.05 -1.20 -3.26 116.94 110.04 2igl h PHE 95 Ca 0.27 -0.56 -0.00 0.00 3.82 0.00 0.00 57.97 61.50 2igl h PHE 95 Cb 0.26 -0.12 -0.01 0.00 2.00 0.00 0.00 35.95 38.08 2igl h PHE 95 CO -0.13 1.40 0.11 0.87 -0.18 0.00 0.00 178.31 180.38 2igl h LYS 96 N 0.40 0.25 0.00 1.51 1.57 -0.68 0.14 116.57 119.76 2igl h LYS 96 Ca -0.13 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2igl h LYS 96 Cb 1.68 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.93 2igl h LYS 96 CO 0.20 0.19 0.00 0.87 -0.57 0.00 0.00 179.45 180.14 2igl h LYS 97 N 0.26 0.00 -0.47 3.15 1.57 -1.20 0.35 116.57 120.24 2igl h LYS 97 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2igl h LYS 97 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2igl h LYS 97 CO -0.01 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 179.91 2igl n GLN 98 N -3.03 2.52 -3.04 3.15 6.02 -0.10 -4.94 117.38 117.95 2igl n GLN 98 Ca -0.01 -2.27 -0.21 0.00 -0.01 0.00 0.00 57.00 54.51 2igl n GLN 98 Cb 0.22 -1.44 0.04 0.00 1.02 0.00 0.00 30.24 30.07 2igl n GLN 98 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2igl n ASN 99 N 1.22 -5.80 -4.54 1.08 5.15 0.11 -5.00 115.26 107.49 2igl n ASN 99 Ca 0.18 -0.30 -0.33 0.00 -0.60 0.00 0.00 54.58 53.53 2igl n ASN 99 Cb 0.54 -4.58 -0.12 0.00 -0.53 0.00 0.00 39.78 35.09 2igl n ASN 99 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2igl s LEU 100 N -6.23 2.98 0.37 1.20 1.43 0.30 -4.98 118.68 113.75 2igl s LEU 100 Ca 0.32 -0.13 -0.06 0.00 -1.03 0.00 0.00 54.13 53.24 2igl s LEU 100 Cb -0.14 -1.65 -0.05 0.00 0.03 0.00 0.00 46.19 44.38 2igl s LEU 100 CO 0.40 0.34 0.66 -1.61 0.23 0.00 0.00 176.35 176.37 2igl s GLU 101 N -0.92 3.64 -0.02 1.70 2.02 -1.26 -3.06 118.70 120.80 2igl s GLU 101 Ca 0.13 0.13 -0.07 0.00 0.02 0.00 0.00 54.97 55.18 2igl s GLU 101 Cb -0.11 -2.52 0.01 0.00 0.10 0.00 0.00 34.13 31.61 2igl s GLU 101 CO 0.02 0.05 0.15 0.45 0.02 0.00 0.00 175.26 175.95 2igl s SER 102 N -3.47 -0.04 0.40 -0.19 0.15 -1.26 -4.83 113.70 104.46 2igl s SER 102 Ca 0.46 -0.04 0.21 0.00 0.70 0.00 0.00 55.95 57.29 2igl s SER 102 Cb -0.10 0.25 0.77 0.00 -1.71 0.00 0.00 66.02 65.23 2igl s SER 102 CO 0.34 -0.28 1.77 0.15 1.20 0.00 0.00 173.24 176.42 2igl h PHE 103 N 4.73 0.00 -3.58 3.44 3.57 -1.79 -3.42 116.94 119.89 2igl h PHE 103 Ca -0.29 0.00 -0.67 0.00 3.53 0.00 0.00 57.97 60.54 2igl h PHE 103 Cb 1.19 0.00 -0.27 0.00 2.79 0.00 0.00 35.95 39.67 2igl h PHE 103 CO 0.54 0.31 -0.65 -0.06 -2.23 0.00 0.00 178.31 176.22 2igl s PHE 104 N -3.62 3.11 0.47 0.41 0.40 -1.26 -4.97 117.98 112.52 2igl s PHE 104 Ca 0.00 -0.98 0.18 0.00 -0.60 0.00 0.00 56.93 55.53 2igl s PHE 104 Cb 0.11 -2.21 1.18 0.00 0.51 0.00 0.00 43.02 42.60 2igl s PHE 104 CO 0.67 -0.57 2.05 -1.00 0.70 0.00 0.00 175.22 177.07 2igl h PRO 105 N 8.20 0.00 -2.44 0.24 0.13 -1.96 -3.32 132.00 132.84 2igl h PRO 105 Ca -0.33 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 64.88 2igl h PRO 105 Cb 1.13 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.12 2igl h PRO 105 CO 0.60 0.13 0.43 -1.83 -0.23 0.00 0.00 178.00 177.10 2igl s GLU 106 N -4.66 0.93 -0.31 0.86 -1.05 -1.26 -2.58 118.70 110.63 2igl s GLU 106 Ca -0.04 -0.35 0.03 0.00 -0.15 0.00 0.00 54.97 54.47 2igl s GLU 106 Cb 0.16 0.42 0.09 0.00 -0.44 0.00 0.00 34.13 34.36 2igl s GLU 106 CO 0.67 -0.41 0.00 0.42 0.95 0.00 0.00 175.26 176.89 2igl s ILE 107 N -3.26 2.13 0.04 1.83 1.01 0.27 -4.94 121.20 118.29 2igl s ILE 107 Ca 0.04 -2.04 -0.21 0.00 0.00 0.00 0.00 60.65 58.44 2igl s ILE 107 Cb -0.01 -2.47 -0.06 0.00 0.01 0.00 0.00 42.46 39.93 2igl s ILE 107 CO -0.10 -0.42 0.63 -2.16 0.00 0.00 0.00 174.94 172.90 2igl s PRO 108 N 1.02 4.34 -0.19 2.79 0.04 -1.26 -0.97 135.00 140.76 2igl s PRO 108 Ca 0.05 0.83 0.00 0.00 0.04 0.00 0.00 61.00 61.92 2igl s PRO 108 Cb -0.19 -3.31 0.04 0.00 0.04 0.00 0.00 34.50 31.08 2igl s PRO 108 CO -0.08 0.45 -0.08 0.08 0.04 0.00 0.00 177.00 177.41 2igl s VAL 109 N -0.52 1.47 -0.15 -0.36 1.01 0.22 -4.98 120.40 117.08 2igl s VAL 109 Ca 0.32 -0.93 -0.13 0.00 0.00 0.00 0.00 61.98 61.25 2igl s VAL 109 Cb -0.19 -1.60 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 2igl s VAL 109 CO 0.19 0.12 0.27 -0.70 0.00 0.00 0.00 175.10 174.98 2igl s GLU 110 N 1.47 4.14 0.18 2.72 2.12 -1.26 -1.45 118.70 126.61 2igl s GLU 110 Ca -0.01 0.06 -0.07 0.00 0.36 0.00 0.00 54.97 55.31 2igl s GLU 110 Cb -0.16 -3.38 -0.02 0.00 0.26 0.00 0.00 34.13 30.82 2igl s GLU 110 CO -0.08 0.34 0.25 -0.59 -0.54 0.00 0.00 175.26 174.64 2igl s PHE 111 N 0.16 0.65 -0.08 5.30 -0.12 -0.23 -5.00 117.98 118.67 2igl s PHE 111 Ca 0.16 -0.98 0.02 0.00 -0.05 0.00 0.00 56.93 56.08 2igl s PHE 111 Cb -0.13 -0.19 -0.02 0.00 -0.63 0.00 0.00 43.02 42.05 2igl s PHE 111 CO 0.04 -0.72 -0.14 -1.58 -0.05 0.00 0.00 175.22 172.76 2igl s HIS 112 N -4.04 2.73 -0.28 3.49 5.65 -1.26 -0.32 115.29 121.26 2igl s HIS 112 Ca 0.25 -0.39 -0.04 0.00 0.25 0.00 0.00 55.06 55.12 2igl s HIS 112 Cb 0.04 -1.72 0.02 0.00 -1.18 0.00 0.00 32.58 29.75 2igl s HIS 112 CO 0.05 -0.00 0.01 0.42 -0.65 0.00 0.00 174.74 174.57 2igl s ILE 113 N -0.25 3.37 -0.55 0.89 1.01 -0.16 -4.96 121.20 120.55 2igl s ILE 113 Ca 0.01 -0.95 0.15 0.00 0.00 0.00 0.00 60.65 59.86 2igl s ILE 113 Cb -0.13 -2.76 -0.18 0.00 0.01 0.00 0.00 42.46 39.40 2igl s ILE 113 CO 0.03 0.09 0.57 -0.46 0.00 0.00 0.00 174.94 175.17 2igl n ASN 114 N 4.75 0.88 -3.71 3.58 6.94 -1.26 -0.87 115.26 125.57 2igl n ASN 114 Ca -0.15 -0.66 -0.21 0.00 -0.02 0.00 0.00 54.58 53.54 2igl n ASN 114 Cb 0.47 1.16 -0.18 0.00 -2.36 0.00 0.00 39.78 38.87 2igl n ASN 114 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2igl s LYS 115 N -2.57 0.18 0.00 -3.83 1.02 -1.26 -4.93 119.74 108.34 2igl s LYS 115 Ca 0.03 0.27 0.29 0.00 0.02 0.00 0.00 55.97 56.59 2igl s LYS 115 Cb 0.11 -0.70 1.32 0.00 -0.52 0.00 0.00 37.83 38.04 2igl s LYS 115 CO 0.63 -0.32 1.90 1.33 -0.92 0.00 0.00 175.35 177.96 2igl n VAL 116 N 5.24 0.00 -0.12 3.17 0.24 -1.26 -3.73 118.33 121.87 2igl n VAL 116 Ca -0.05 -0.10 0.09 0.00 -2.04 0.00 0.00 64.34 62.24 2igl n VAL 116 Cb 0.50 0.00 0.29 0.00 -1.47 0.00 0.00 33.84 33.17 2igl n VAL 116 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2igl n ASN 117 N -0.62 3.69 -4.39 -1.34 5.03 -1.26 -4.93 115.26 111.43 2igl n ASN 117 Ca 0.18 -2.15 -0.20 0.00 0.87 0.00 0.00 54.58 53.28 2igl n ASN 117 Cb 0.26 -0.47 -0.10 0.00 -1.02 0.00 0.00 39.78 38.45 2igl n ASN 117 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.26 173.60 2igl s GLU 118 N -1.41 1.56 0.04 3.52 -1.05 -1.24 -4.24 118.70 115.88 2igl s GLU 118 Ca 0.43 -1.86 -0.05 0.00 -0.15 0.00 0.00 54.97 53.34 2igl s GLU 118 Cb 0.24 -0.62 -0.05 0.00 -0.44 0.00 0.00 34.13 33.26 2igl s GLU 118 CO 0.26 -0.23 0.28 -1.58 0.95 0.00 0.00 175.26 174.94 2igl s HIS 119 N -3.48 3.55 -0.18 4.83 5.65 -0.08 -4.80 115.29 120.78 2igl s HIS 119 Ca 0.37 0.53 0.01 0.00 0.25 0.00 0.00 55.06 56.22 2igl s HIS 119 Cb 0.08 -1.96 0.02 0.00 -1.18 0.00 0.00 32.58 29.54 2igl s HIS 119 CO 0.15 0.57 -0.18 0.71 -0.65 0.00 0.00 174.74 175.34 2igl s TYR 120 N -1.40 2.66 -0.17 3.88 1.51 0.20 -4.76 117.35 119.27 2igl s TYR 120 Ca 0.31 -1.59 -0.01 0.00 -1.01 0.00 0.00 57.07 54.78 2igl s TYR 120 Cb -0.13 -1.84 -0.00 0.00 -0.11 0.00 0.00 41.96 39.88 2igl s TYR 120 CO 0.19 -0.78 -0.13 -1.58 -1.11 0.00 0.00 175.55 172.15 2igl s HIS 121 N 1.33 2.83 -0.41 2.71 2.46 -1.26 -1.33 115.29 121.62 2igl s HIS 121 Ca 0.04 -1.01 0.04 0.00 0.47 0.00 0.00 55.06 54.60 2igl s HIS 121 Cb -0.13 -1.93 0.11 0.00 -0.13 0.00 0.00 32.58 30.50 2igl s HIS 121 CO -0.12 -0.48 0.14 0.08 -2.47 0.00 0.00 174.74 171.89 2igl s VAL 122 N 0.93 2.31 0.53 0.89 1.01 -0.23 0.19 120.40 126.03 2igl s VAL 122 Ca -0.03 -2.68 -0.10 0.00 0.00 0.00 0.00 61.98 59.18 2igl s VAL 122 Cb -0.15 -2.66 -0.05 0.00 0.00 0.00 0.00 36.38 33.52 2igl s VAL 122 CO -0.01 -0.69 0.91 -2.84 0.00 0.00 0.00 175.10 172.47 2igl s PRO 123 N 0.47 3.64 -0.10 2.72 0.02 -1.23 -3.07 135.00 137.44 2igl s PRO 123 Ca 0.13 0.55 -0.01 0.00 0.02 0.00 0.00 61.00 61.69 2igl s PRO 123 Cb -0.22 -2.23 0.03 0.00 0.02 0.00 0.00 34.50 32.11 2igl s PRO 123 CO -0.05 -0.34 -0.01 -1.17 -0.33 0.00 0.00 177.00 175.09 2igl s LEU 124 N -4.73 0.83 -0.44 -5.54 2.96 0.77 -3.63 118.68 108.91 2igl s LEU 124 Ca 0.52 -0.26 -0.18 0.00 -0.22 0.00 0.00 54.13 53.99 2igl s LEU 124 Cb -0.11 -0.56 0.03 0.00 0.50 0.00 0.00 46.19 46.05 2igl s LEU 124 CO 0.45 -0.20 0.51 -0.76 -1.32 0.00 0.00 176.35 175.04 2igl s LEU 125 N 1.89 4.80 -0.14 -0.68 1.43 -0.16 -1.19 118.68 124.62 2igl s LEU 125 Ca 0.04 -0.63 -0.04 0.00 -1.03 0.00 0.00 54.13 52.47 2igl s LEU 125 Cb -0.13 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.58 2igl s LEU 125 CO -0.06 -0.67 0.01 -0.22 0.23 0.00 0.00 176.35 175.64 2igl s LEU 126 N 2.35 3.56 0.13 1.79 2.96 0.02 -1.81 118.68 127.69 2igl s LEU 126 Ca 0.15 0.04 0.01 0.00 -0.22 0.00 0.00 54.13 54.10 2igl s LEU 126 Cb -0.17 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.62 2igl s LEU 126 CO 0.15 0.24 -0.00 -0.44 -1.32 0.00 0.00 176.35 174.97 2igl s SER 127 N -0.05 0.86 0.28 3.68 0.01 -0.68 -0.43 113.70 117.37 2igl s SER 127 Ca 0.04 -1.12 -0.01 0.00 1.31 0.00 0.00 55.95 56.16 2igl s SER 127 Cb -0.13 0.17 0.40 0.00 0.21 0.00 0.00 66.02 66.68 2igl s SER 127 CO 0.02 -0.59 1.82 1.56 0.41 0.00 0.00 173.24 176.45 2igl h GLN 128 N 2.86 0.81 0.00 12.44 4.20 -1.99 -3.26 115.11 130.17 2igl h GLN 128 Ca -0.36 -0.17 -0.00 0.00 0.06 0.00 0.00 58.65 58.18 2igl h GLN 128 Cb 1.19 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.84 2igl h GLN 128 CO 0.63 0.74 -0.16 0.66 -0.67 0.00 0.00 178.83 180.03 2igl n TYR 129 N -4.27 0.00 -3.57 2.96 4.02 -1.26 -2.07 117.16 112.97 2igl n TYR 129 Ca 0.04 -1.09 -0.07 0.00 -0.01 0.00 0.00 57.90 56.76 2igl n TYR 129 Cb 0.24 -0.17 -0.03 0.00 -0.02 0.00 0.00 39.34 39.35 2igl n TYR 129 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 2igl s GLY 130 N -2.90 -0.28 0.19 2.72 0.00 -1.23 -4.97 107.32 100.85 2igl s GLY 130 Ca 0.33 1.78 -0.22 0.00 0.00 0.00 0.00 44.72 46.60 2igl s GLY 130 CO 0.00 0.75 0.62 -2.52 0.00 0.00 0.00 173.10 171.96 2igl s TYR 131 N -1.90 -0.46 0.05 1.90 -0.85 -1.26 -1.69 117.35 113.15 2igl s TYR 131 Ca 0.04 0.19 0.04 0.00 -0.52 0.00 0.00 57.07 56.81 2igl s TYR 131 Cb -0.01 0.59 -0.02 0.00 0.38 0.00 0.00 41.96 42.90 2igl s TYR 131 CO -0.04 -0.94 -0.11 -1.12 -1.52 0.00 0.00 175.55 171.82 2igl s SER 132 N -2.79 1.30 0.09 -0.18 0.01 -0.75 -4.99 113.70 106.39 2igl s SER 132 Ca 0.03 -0.52 -0.11 0.00 1.31 0.00 0.00 55.95 56.66 2igl s SER 132 Cb -0.02 -0.03 0.01 0.00 0.21 0.00 0.00 66.02 66.19 2igl s SER 132 CO -0.08 -0.09 0.25 0.28 0.41 0.00 0.00 173.24 174.00 2igl s THR 133 N -1.14 0.12 0.08 1.44 -1.32 -1.26 -0.99 115.64 112.57 2igl s THR 133 Ca -0.04 -0.97 -0.27 0.00 -1.21 0.00 0.00 61.69 59.21 2igl s THR 133 Cb -0.09 -1.21 0.09 0.00 -1.51 0.00 0.00 72.50 69.78 2igl s THR 133 CO 0.01 -0.53 1.14 -0.72 -2.21 0.00 0.00 174.62 172.31 2igl s TYR 134 N -3.56 -0.02 -0.31 9.09 -0.85 -1.24 -5.05 117.35 115.41 2igl s TYR 134 Ca 0.02 -0.21 -0.21 0.00 -0.52 0.00 0.00 57.07 56.15 2igl s TYR 134 Cb 0.03 0.61 -0.01 0.00 0.38 0.00 0.00 41.96 42.98 2igl s TYR 134 CO -0.10 -0.58 0.67 0.50 -1.52 0.00 0.00 175.55 174.52 2igl s ARG 135 N -2.50 3.89 0.90 -3.49 3.52 -1.26 -3.57 118.95 116.43 2igl s ARG 135 Ca 0.18 0.34 -0.10 0.00 -0.13 0.00 0.00 55.73 56.02 2igl s ARG 135 Cb 0.00 -3.74 0.19 0.00 -1.56 0.00 0.00 34.95 29.85 2igl s ARG 135 CO 0.01 -0.62 1.22 0.20 -0.81 0.00 0.00 175.30 175.30 2igl s GLY 136 N 1.65 1.79 0.00 8.12 0.00 0.13 -5.00 107.32 114.01 2igl s GLY 136 Ca 0.27 -1.53 0.14 0.00 0.00 0.00 0.00 44.72 43.60 2igl s GLY 136 CO 0.12 -0.78 0.95 -1.14 0.00 0.00 0.00 173.10 172.25