#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 1.24 -1.94 -0.41 2.81 -1.26 -1.55 117.12 116.01 2igl n MET 23 Ca 0.00 0.46 -0.41 0.00 -1.81 0.00 0.00 57.70 55.94 2igl n MET 23 Cb 0.00 -2.21 -0.01 0.00 -0.71 0.00 0.00 33.22 30.28 2igl n MET 23 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2igl s ALA 24 N -1.39 3.58 0.00 3.04 0.00 -1.24 -3.56 121.76 122.20 2igl s ALA 24 Ca 0.70 1.42 0.00 0.00 0.00 0.00 0.00 51.96 54.09 2igl s ALA 24 Cb -0.46 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.09 2igl s ALA 24 CO 0.51 -0.85 0.00 1.04 0.00 0.00 0.00 175.76 176.46 2igl n GLN 25 N 1.19 0.00 0.00 0.00 6.02 -1.26 -4.90 117.38 118.43 2igl n GLN 25 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 2igl n GLN 25 Cb 0.40 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.66 2igl n GLN 25 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2igl n GLN 26 N 0.00 0.00 -1.65 -1.09 1.13 -1.26 -5.00 117.38 109.51 2igl n GLN 26 Ca 0.00 0.00 -0.45 0.00 -1.94 0.00 0.00 57.00 54.61 2igl n GLN 26 Cb 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.33 2igl n GLN 26 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2igl n ASN 27 N 0.00 2.33 0.24 1.08 2.85 -1.26 -4.84 115.26 115.65 2igl n ASN 27 Ca 0.00 1.16 0.16 0.00 -0.11 0.00 0.00 54.58 55.79 2igl n ASN 27 Cb 0.00 -1.38 0.67 0.00 1.24 0.00 0.00 39.78 40.31 2igl n ASN 27 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 2igl h ILE 28 N 2.78 0.00 -3.57 -1.44 2.10 -1.92 -3.45 117.51 112.01 2igl h ILE 28 Ca -0.44 -0.38 -0.40 0.00 1.08 0.00 0.00 64.86 64.72 2igl h ILE 28 Cb 1.30 1.29 -0.33 0.00 -1.09 0.00 0.00 36.82 37.99 2igl h ILE 28 CO 0.71 0.00 -0.77 -0.22 -1.08 0.00 0.00 178.15 176.79 2igl s LEU 29 N -5.66 1.50 0.05 2.19 2.96 -1.26 -0.23 118.68 118.24 2igl s LEU 29 Ca 0.01 -0.14 0.02 0.00 -0.22 0.00 0.00 54.13 53.80 2igl s LEU 29 Cb 0.09 -0.45 -0.03 0.00 0.50 0.00 0.00 46.19 46.31 2igl s LEU 29 CO 0.48 -0.02 -0.07 -0.94 -1.32 0.00 0.00 176.35 174.49 2igl s SER 30 N 0.65 0.79 0.17 3.68 1.04 -0.54 -0.87 113.70 118.61 2igl s SER 30 Ca -0.09 -0.63 0.02 0.00 0.48 0.00 0.00 55.95 55.73 2igl s SER 30 Cb -0.12 0.06 -0.05 0.00 0.10 0.00 0.00 66.02 66.01 2igl s SER 30 CO 0.00 -0.28 0.00 0.68 0.98 0.00 0.00 173.24 174.63 2igl s VAL 31 N -1.84 0.66 -0.19 5.02 -7.23 -0.85 -1.21 120.40 114.76 2igl s VAL 31 Ca -0.07 -1.98 -0.10 0.00 -1.81 0.00 0.00 61.98 58.02 2igl s VAL 31 Cb -0.07 -2.11 0.06 0.00 0.56 0.00 0.00 36.38 34.83 2igl s VAL 31 CO -0.01 -0.48 0.46 -2.28 -0.31 0.00 0.00 175.10 172.48 2igl s HIS 32 N -3.67 -0.70 -0.20 2.82 2.46 -1.16 -2.09 115.29 112.76 2igl s HIS 32 Ca 0.24 1.46 -0.03 0.00 0.47 0.00 0.00 55.06 57.20 2igl s HIS 32 Cb 0.06 0.34 -0.01 0.00 -0.13 0.00 0.00 32.58 32.84 2igl s HIS 32 CO 0.04 -0.39 -0.06 0.42 -2.47 0.00 0.00 174.74 172.28 2igl s ILE 33 N 1.51 3.36 -0.20 0.89 1.01 0.27 -0.22 121.20 127.82 2igl s ILE 33 Ca -0.09 -0.51 -0.02 0.00 0.00 0.00 0.00 60.65 60.03 2igl s ILE 33 Cb -0.08 -2.50 0.00 0.00 0.01 0.00 0.00 42.46 39.89 2igl s ILE 33 CO -0.14 0.45 -0.11 -0.76 0.00 0.00 0.00 174.94 174.38 2igl s LEU 34 N 1.16 2.59 -0.42 2.97 1.02 -0.04 -1.51 118.68 124.45 2igl s LEU 34 Ca 0.02 -0.49 -0.29 0.00 0.02 0.00 0.00 54.13 53.39 2igl s LEU 34 Cb -0.14 -1.63 0.02 0.00 0.02 0.00 0.00 46.19 44.45 2igl s LEU 34 CO -0.01 -0.01 1.23 0.21 0.02 0.00 0.00 176.35 177.79 2igl s ASN 35 N 1.37 6.59 0.00 2.29 3.84 -0.22 -0.75 114.94 128.06 2igl s ASN 35 Ca 0.05 0.73 0.27 0.00 0.21 0.00 0.00 52.86 54.12 2igl s ASN 35 Cb -0.14 -2.55 1.46 0.00 -0.55 0.00 0.00 41.25 39.48 2igl s ASN 35 CO -0.07 -1.24 1.94 0.00 -2.79 0.00 0.00 177.10 174.95 2igl n GLN 36 N 7.73 0.55 0.06 0.43 6.02 0.08 -0.33 117.38 131.92 2igl n GLN 36 Ca 0.14 0.02 0.07 0.00 -0.01 0.00 0.00 57.00 57.22 2igl n GLN 36 Cb 0.48 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.19 2igl n GLN 36 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2igl n GLN 37 N -1.19 0.62 -0.00 -1.09 6.02 -1.26 -4.34 117.38 116.14 2igl n GLN 37 Ca 0.16 0.11 0.02 0.00 -0.01 0.00 0.00 57.00 57.28 2igl n GLN 37 Cb 0.17 -1.78 -0.03 0.00 1.02 0.00 0.00 30.24 29.62 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 -2.70 0.02 -1.11 5.09 -2.24 -1.13 -4.99 114.28 107.22 2igl n THR 38 Ca -0.05 -0.10 -0.04 0.00 -2.27 0.00 0.00 64.05 61.60 2igl n THR 38 Cb 0.66 0.30 -0.02 0.00 -2.10 0.00 0.00 70.33 69.17 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 2.31 0.67 3.37 3.38 0.00 0.55 -5.02 105.19 110.45 2igl n GLY 39 Ca -0.01 -0.69 -0.22 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.02 1.38 0.70 1.61 -0.14 -1.18 -4.95 119.74 115.14 2igl s LYS 40 Ca 0.00 -1.51 -0.15 0.00 -1.36 0.00 0.00 55.97 52.95 2igl s LYS 40 Cb 0.00 -1.43 0.02 0.00 -1.68 0.00 0.00 37.83 34.75 2igl s LYS 40 CO 0.00 0.28 1.19 -2.14 -0.76 0.00 0.00 175.35 173.92 2igl s PRO 41 N -3.03 2.34 -0.51 -1.68 0.02 -1.26 -1.06 135.00 129.83 2igl s PRO 41 Ca 0.20 1.71 -0.18 0.00 0.02 0.00 0.00 61.00 62.75 2igl s PRO 41 Cb -0.05 -1.86 0.07 0.00 0.02 0.00 0.00 34.50 32.68 2igl s PRO 41 CO 0.08 -1.67 0.56 0.00 -0.33 0.00 0.00 177.00 175.65 2igl s ALA 42 N -1.99 3.45 0.33 -1.55 0.00 -0.57 -4.68 121.76 116.75 2igl s ALA 42 Ca 0.74 -1.93 -0.04 0.00 0.00 0.00 0.00 51.96 50.72 2igl s ALA 42 Cb -0.28 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 19.51 2igl s ALA 42 CO 0.43 -1.96 0.60 0.00 0.00 0.00 0.00 175.76 174.83 2igl s ALA 43 N 2.30 3.59 -1.51 0.00 0.00 -1.26 -4.17 121.76 120.70 2igl s ALA 43 Ca 0.11 -0.59 -0.13 0.00 0.00 0.00 0.00 51.96 51.35 2igl s ALA 43 Cb -0.22 -2.33 0.08 0.00 0.00 0.00 0.00 23.12 20.65 2igl s ALA 43 CO 0.09 0.10 0.99 -3.47 0.00 0.00 0.00 175.76 173.48 2igl n ASP 44 N -1.27 -5.02 -4.73 0.00 2.03 -0.08 -4.93 116.55 102.55 2igl n ASP 44 Ca -0.02 -0.73 -0.35 0.00 0.52 0.00 0.00 54.79 54.21 2igl n ASP 44 Cb 0.54 -4.00 -0.08 0.00 -0.72 0.00 0.00 41.12 36.86 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 -3.28 5.39 0.15 5.18 1.01 -1.26 -4.78 120.40 122.81 2igl s VAL 45 Ca 0.65 0.25 -0.30 0.00 0.00 0.00 0.00 61.98 62.58 2igl s VAL 45 Cb -0.32 -3.50 -0.07 0.00 0.00 0.00 0.00 36.38 32.49 2igl s VAL 45 CO 0.80 0.43 1.09 -0.89 0.00 0.00 0.00 175.10 176.53 2igl s THR 46 N 0.40 4.00 -0.05 3.92 2.01 -1.26 -0.99 115.64 123.67 2igl s THR 46 Ca 0.09 1.66 0.01 0.00 0.31 0.00 0.00 61.69 63.77 2igl s THR 46 Cb -0.11 -4.06 0.02 0.00 0.01 0.00 0.00 72.50 68.36 2igl s THR 46 CO -0.01 0.25 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.41 2igl s VAL 47 N 0.03 0.76 0.14 3.82 1.01 0.62 -1.00 120.40 125.79 2igl s VAL 47 Ca 0.51 -0.25 0.06 0.00 0.00 0.00 0.00 61.98 62.30 2igl s VAL 47 Cb -0.28 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 2igl s VAL 47 CO 0.33 0.28 0.03 0.42 0.00 0.00 0.00 175.10 176.15 2igl s THR 48 N 0.87 3.96 -0.07 3.92 -4.23 -0.74 -1.63 115.64 117.72 2igl s THR 48 Ca -0.11 -1.21 0.04 0.00 -1.18 0.00 0.00 61.69 59.22 2igl s THR 48 Cb -0.15 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 70.73 2igl s THR 48 CO 0.01 -0.03 -0.20 -0.22 -0.54 0.00 0.00 174.62 173.64 2igl s LEU 49 N -2.76 1.93 0.11 4.79 2.96 0.19 -1.08 118.68 124.82 2igl s LEU 49 Ca 0.27 -0.44 0.04 0.00 -0.22 0.00 0.00 54.13 53.79 2igl s LEU 49 Cb -0.10 -1.16 -0.04 0.00 0.50 0.00 0.00 46.19 45.39 2igl s LEU 49 CO 0.19 0.14 -0.11 -1.61 -1.32 0.00 0.00 176.35 173.64 2igl s GLU 50 N 0.28 0.93 -0.08 1.98 2.02 -0.43 -0.08 118.70 123.33 2igl s GLU 50 Ca -0.12 -1.23 0.03 0.00 0.02 0.00 0.00 54.97 53.67 2igl s GLU 50 Cb -0.15 -0.65 -0.02 0.00 0.10 0.00 0.00 34.13 33.41 2igl s GLU 50 CO 0.05 0.11 -0.17 0.21 0.02 0.00 0.00 175.26 175.48 2igl s LYS 51 N -2.90 2.79 -0.64 1.61 2.20 0.11 -1.95 119.74 120.95 2igl s LYS 51 Ca 0.08 -0.76 -0.26 0.00 -0.36 0.00 0.00 55.97 54.67 2igl s LYS 51 Cb -0.03 -2.39 0.04 0.00 -1.51 0.00 0.00 37.83 33.94 2igl s LYS 51 CO 0.01 0.42 1.16 0.21 -0.36 0.00 0.00 175.35 176.79 2igl s LYS 52 N -0.22 3.32 0.54 4.03 2.20 -0.38 -1.01 119.74 128.22 2igl s LYS 52 Ca -0.00 -0.13 0.06 0.00 -0.36 0.00 0.00 55.97 55.53 2igl s LYS 52 Cb -0.13 -4.10 0.06 0.00 -1.51 0.00 0.00 37.83 32.14 2igl s LYS 52 CO 0.03 -1.83 0.50 0.00 -0.36 0.00 0.00 175.35 173.69 2igl n ALA 53 N 8.54 0.92 -0.08 3.13 0.00 -0.22 -4.67 120.51 128.14 2igl n ALA 53 Ca 0.04 -2.10 -0.08 0.00 0.00 0.00 0.00 53.44 51.30 2igl n ALA 53 Cb 0.48 0.79 -0.06 0.00 0.00 0.00 0.00 19.45 20.66 2igl n ALA 53 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2igl h ASP 54 N 0.48 -1.05 -0.81 0.00 3.32 -2.01 -2.71 116.42 113.65 2igl h ASP 54 Ca -0.31 0.14 -0.43 0.00 0.02 0.00 0.00 57.03 56.44 2igl h ASP 54 Cb 1.22 0.43 -0.17 0.00 0.22 0.00 0.00 39.33 41.03 2igl h ASP 54 CO 0.48 -0.23 0.43 0.59 -1.72 0.00 0.00 179.24 178.80 2igl n ASN 55 N -4.20 6.55 0.00 6.45 3.02 -1.26 -4.99 115.26 120.83 2igl n ASN 55 Ca -0.02 -3.18 0.00 0.00 -0.03 0.00 0.00 54.58 51.35 2igl n ASN 55 Cb 0.19 -1.14 0.00 0.00 -0.61 0.00 0.00 39.78 38.22 2igl n ASN 55 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2igl n GLY 56 N 0.53 -1.56 3.79 7.41 0.00 -1.02 -4.99 105.19 109.35 2igl n GLY 56 Ca 0.41 -2.07 -0.38 0.00 0.00 0.00 0.00 46.02 43.99 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 0.00 3.77 -0.06 1.61 0.52 -1.26 -1.05 118.94 122.47 2igl s TRP 57 Ca 0.00 1.64 0.03 0.00 0.02 0.00 0.00 56.10 57.78 2igl s TRP 57 Cb 0.00 -2.79 0.01 0.00 -1.15 0.00 0.00 33.47 29.54 2igl s TRP 57 CO 0.00 0.36 -0.13 -0.51 0.02 0.00 0.00 176.95 176.69 2igl s LEU 58 N -1.68 1.71 0.26 2.99 1.43 -0.18 -4.92 118.68 118.29 2igl s LEU 58 Ca 0.43 -0.30 -0.30 0.00 -1.03 0.00 0.00 54.13 52.94 2igl s LEU 58 Cb -0.20 -0.83 -0.09 0.00 0.03 0.00 0.00 46.19 45.10 2igl s LEU 58 CO 0.24 0.06 1.23 -1.58 0.23 0.00 0.00 176.35 176.53 2igl s GLN 59 N 0.51 4.47 -0.12 1.70 0.74 -1.26 0.04 119.66 125.74 2igl s GLN 59 Ca -0.12 2.00 0.06 0.00 0.05 0.00 0.00 55.36 57.35 2igl s GLN 59 Cb -0.14 -3.17 -0.11 0.00 1.10 0.00 0.00 33.01 30.69 2igl s GLN 59 CO 0.03 -0.08 -0.03 1.28 -0.55 0.00 0.00 175.29 175.95 2igl n LEU 60 N 1.70 1.26 -3.63 3.68 4.77 0.89 -4.87 117.00 120.80 2igl n LEU 60 Ca 0.02 -0.03 -0.03 0.00 -0.03 0.00 0.00 56.01 55.94 2igl n LEU 60 Cb 0.43 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.46 2igl n LEU 60 CO 0.57 0.46 0.90 0.21 -1.33 0.00 0.00 177.39 178.19 2igl s ASN 61 N -4.72 -0.16 -0.11 -1.43 2.47 -1.13 -4.60 114.94 105.26 2igl s ASN 61 Ca -0.11 -0.15 -0.10 0.00 0.42 0.00 0.00 52.86 52.93 2igl s ASN 61 Cb 0.04 0.28 0.03 0.00 -1.45 0.00 0.00 41.25 40.14 2igl s ASN 61 CO 0.38 -0.49 0.28 -0.89 -3.72 0.00 0.00 177.10 172.66 2igl s THR 62 N -2.76 -0.00 0.31 -5.21 2.01 -1.26 -0.64 115.64 108.09 2igl s THR 62 Ca 0.11 0.01 -0.16 0.00 0.31 0.00 0.00 61.69 61.96 2igl s THR 62 Cb 0.01 -0.40 0.02 0.00 0.01 0.00 0.00 72.50 72.14 2igl s THR 62 CO -0.03 0.00 0.66 0.00 -0.69 0.00 0.00 174.62 174.56 2igl s ALA 63 N 0.20 -0.66 0.02 7.40 0.00 -0.65 -5.00 121.76 123.08 2igl s ALA 63 Ca -0.00 -0.69 0.09 0.00 0.00 0.00 0.00 51.96 51.35 2igl s ALA 63 Cb -0.02 0.88 -0.03 0.00 0.00 0.00 0.00 23.12 23.95 2igl s ALA 63 CO -0.00 -0.96 -0.26 0.15 0.00 0.00 0.00 175.76 174.70 2igl s LYS 64 N -3.36 1.85 0.47 0.00 1.02 -1.26 -0.27 119.74 118.19 2igl s LYS 64 Ca 0.17 -1.02 -0.24 0.00 0.02 0.00 0.00 55.97 54.89 2igl s LYS 64 Cb -0.04 -1.94 -0.07 0.00 -0.52 0.00 0.00 37.83 35.26 2igl s LYS 64 CO 0.10 0.51 1.34 0.95 -0.92 0.00 0.00 175.35 177.33 2igl s THR 65 N -0.73 2.34 0.00 2.17 -4.23 -0.16 -4.80 115.64 110.23 2igl s THR 65 Ca 0.11 0.28 0.00 0.00 -1.18 0.00 0.00 61.69 60.90 2igl s THR 65 Cb -0.10 -3.16 0.00 0.00 1.34 0.00 0.00 72.50 70.59 2igl s THR 65 CO 0.01 0.02 0.00 -0.90 -0.54 0.00 0.00 174.62 173.21 2igl n ASP 66 N -0.43 -0.03 0.32 3.99 5.68 0.12 -0.90 116.55 125.31 2igl n ASP 66 Ca 0.07 -0.95 0.20 0.00 -0.50 0.00 0.00 54.79 53.60 2igl n ASP 66 Cb 0.44 0.00 1.11 0.00 -1.14 0.00 0.00 41.12 41.53 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 -0.58 0.11 2.10 -1.95 0.33 116.57 116.58 2igl h LYS 67 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2igl h LYS 67 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2igl h LYS 67 CO 0.00 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.20 2igl n ASP 68 N -3.38 3.17 -0.71 7.07 8.00 -1.26 -4.72 116.55 124.72 2igl n ASP 68 Ca -0.03 -2.03 -0.09 0.00 0.71 0.00 0.00 54.79 53.35 2igl n ASP 68 Cb 0.08 -0.40 -0.03 0.00 -0.02 0.00 0.00 41.12 40.75 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 1.38 0.91 3.49 0.44 0.00 0.11 -4.74 105.19 106.77 2igl n GLY 69 Ca 0.19 -0.63 -0.24 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.96 1.74 -0.28 1.61 0.52 -1.26 -0.56 118.95 117.75 2igl s ARG 70 Ca 0.00 -1.78 -0.02 0.00 -0.52 0.00 0.00 55.73 53.41 2igl s ARG 70 Cb 0.00 -1.78 0.09 0.00 0.52 0.00 0.00 34.95 33.78 2igl s ARG 70 CO 0.00 0.30 0.10 0.42 0.02 0.00 0.00 175.30 176.14 2igl s ILE 71 N -2.52 0.50 0.19 1.52 1.01 -0.89 0.10 121.20 121.12 2igl s ILE 71 Ca 0.31 -1.05 0.20 0.00 0.00 0.00 0.00 60.65 60.11 2igl s ILE 71 Cb -0.04 -1.33 0.16 0.00 0.01 0.00 0.00 42.46 41.26 2igl s ILE 71 CO 0.16 -0.62 1.78 0.11 0.00 0.00 0.00 174.94 176.37 2igl h LYS 72 N 8.22 0.00 -2.20 2.79 1.79 -1.87 -2.27 116.57 123.03 2igl h LYS 72 Ca -0.16 0.00 -0.48 0.00 -2.18 0.00 0.00 60.65 57.83 2igl h LYS 72 Cb 1.03 0.00 -0.34 0.00 -1.58 0.00 0.00 32.23 31.34 2igl h LYS 72 CO 0.44 0.33 -0.81 0.00 -1.08 0.00 0.00 179.45 178.33 2igl s ALA 73 N -3.70 0.39 -0.16 3.86 0.00 -1.25 -4.45 121.76 116.45 2igl s ALA 73 Ca -0.00 -1.63 0.17 0.00 0.00 0.00 0.00 51.96 50.50 2igl s ALA 73 Cb 0.11 -1.83 -0.06 0.00 0.00 0.00 0.00 23.12 21.35 2igl s ALA 73 CO 0.67 -2.10 1.01 1.25 0.00 0.00 0.00 175.76 176.60 2igl h LEU 74 N 6.50 0.00 -9.86 0.00 5.85 -1.22 -3.47 115.31 113.12 2igl h LEU 74 Ca 0.12 0.00 -0.52 0.00 0.84 0.00 0.00 57.88 58.32 2igl h LEU 74 Cb 0.99 0.00 0.05 0.00 0.37 0.00 0.00 40.66 42.07 2igl h LEU 74 CO 0.25 0.45 0.57 0.86 -0.34 0.00 0.00 178.44 180.24 2igl s TRP 75 N -3.01 3.24 1.12 1.25 -0.11 -1.26 -4.80 118.94 115.37 2igl s TRP 75 Ca -0.01 1.52 -0.18 0.00 1.22 0.00 0.00 56.10 58.66 2igl s TRP 75 Cb 0.08 -3.52 0.26 0.00 -1.50 0.00 0.00 33.47 28.79 2igl s TRP 75 CO 0.79 -1.36 1.17 -1.25 -4.62 0.00 0.00 176.95 171.68 2igl s PRO 76 N -1.70 -0.60 -1.25 5.86 0.04 -1.26 -4.90 135.00 131.18 2igl s PRO 76 Ca 0.48 -0.15 -0.17 0.00 0.04 0.00 0.00 61.00 61.19 2igl s PRO 76 Cb -0.36 -1.68 0.09 0.00 0.04 0.00 0.00 34.50 32.59 2igl s PRO 76 CO 0.48 -3.29 1.64 -2.00 0.04 0.00 0.00 177.00 173.87 2igl s GLU 77 N -5.54 3.97 -0.19 4.56 2.56 -1.26 -4.83 118.70 117.98 2igl s GLU 77 Ca 0.72 -2.06 -0.29 0.00 0.00 0.00 0.00 54.97 53.34 2igl s GLU 77 Cb -0.08 -5.41 0.12 0.00 2.00 0.00 0.00 34.13 30.76 2igl s GLU 77 CO 0.55 -2.14 0.98 1.14 -0.56 0.00 0.00 175.26 175.24 2igl s GLN 78 N 3.67 0.60 0.19 4.30 -2.07 -1.26 -5.14 119.66 119.95 2igl s GLN 78 Ca 0.50 0.28 -0.32 0.00 -1.82 0.00 0.00 55.36 54.00 2igl s GLN 78 Cb 0.02 0.29 -0.12 0.00 -1.09 0.00 0.00 33.01 32.11 2igl s GLN 78 CO 0.04 -0.16 1.74 2.41 -1.32 0.00 0.00 175.29 178.01 2igl n THR 79 N 1.14 0.07 -2.94 3.63 -1.04 -1.26 -4.97 114.28 108.91 2igl n THR 79 Ca -0.11 -0.01 -0.33 0.00 -2.04 0.00 0.00 64.05 61.56 2igl n THR 79 Cb 0.57 -1.99 -0.07 0.00 -1.82 0.00 0.00 70.33 67.03 2igl n THR 79 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2igl s ALA 80 N 1.48 3.16 0.18 2.41 0.00 -1.26 -5.08 121.76 122.65 2igl s ALA 80 Ca 0.77 0.24 0.09 0.00 0.00 0.00 0.00 51.96 53.06 2igl s ALA 80 Cb -0.51 -2.99 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 2igl s ALA 80 CO 0.34 0.20 -0.20 0.95 0.00 0.00 0.00 175.76 177.05 2igl s THR 81 N -2.11 1.98 0.61 0.00 -4.23 -1.26 -4.93 115.64 105.69 2igl s THR 81 Ca 0.59 -1.98 -0.18 0.00 -1.18 0.00 0.00 61.69 58.93 2igl s THR 81 Cb -0.10 -1.94 -0.03 0.00 1.34 0.00 0.00 72.50 71.77 2igl s THR 81 CO 0.15 -0.28 1.23 0.42 -0.54 0.00 0.00 174.62 175.60 2igl s THR 82 N -2.01 2.49 -5.00 3.99 -4.23 -1.26 -4.90 115.64 104.72 2igl s THR 82 Ca 0.18 0.30 0.00 0.00 -1.18 0.00 0.00 61.69 60.99 2igl s THR 82 Cb -0.06 -3.11 0.00 0.00 1.34 0.00 0.00 72.50 70.67 2igl s THR 82 CO 0.08 -0.07 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 2igl n GLY 83 N 0.58 0.09 3.87 3.99 0.00 -0.84 -4.98 105.19 107.91 2igl n GLY 83 Ca 0.14 -1.70 -0.35 0.00 0.00 0.00 0.00 46.02 44.11 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 -3.03 6.59 0.30 1.61 1.01 -1.26 -1.48 116.67 120.41 2igl s ASP 84 Ca 0.00 0.70 0.03 0.00 0.71 0.00 0.00 52.55 53.99 2igl s ASP 84 Cb 0.00 -2.14 -0.03 0.00 1.01 0.00 0.00 42.92 41.76 2igl s ASP 84 CO 0.00 0.22 0.28 -0.31 0.21 0.00 0.00 175.17 175.58 2igl s TYR 85 N -1.32 1.45 -0.26 4.23 1.51 0.07 -1.25 117.35 121.79 2igl s TYR 85 Ca 0.30 -1.50 -0.22 0.00 -1.01 0.00 0.00 57.07 54.63 2igl s TYR 85 Cb -0.14 -0.54 0.07 0.00 -0.11 0.00 0.00 41.96 41.24 2igl s TYR 85 CO 0.17 -0.87 0.67 -0.98 -1.11 0.00 0.00 175.55 173.43 2igl s ARG 86 N -3.57 0.77 -0.04 -0.62 1.70 -0.82 -0.89 118.95 115.49 2igl s ARG 86 Ca 0.38 0.98 0.01 0.00 -0.47 0.00 0.00 55.73 56.63 2igl s ARG 86 Cb 0.03 0.35 -0.03 0.00 -0.57 0.00 0.00 34.95 34.72 2igl s ARG 86 CO 0.22 -0.10 -0.04 0.14 -1.08 0.00 0.00 175.30 174.44 2igl s VAL 87 N 0.54 3.90 -0.20 4.99 -7.23 -0.20 -1.31 120.40 120.89 2igl s VAL 87 Ca -0.01 -0.53 0.01 0.00 -1.81 0.00 0.00 61.98 59.63 2igl s VAL 87 Cb -0.05 -2.66 0.03 0.00 0.56 0.00 0.00 36.38 34.27 2igl s VAL 87 CO -0.02 0.50 -0.15 -0.69 -0.31 0.00 0.00 175.10 174.43 2igl s VAL 88 N -0.93 1.97 -0.25 1.32 1.01 -0.24 -0.26 120.40 123.01 2igl s VAL 88 Ca 0.15 -1.11 -0.19 0.00 0.00 0.00 0.00 61.98 60.83 2igl s VAL 88 Cb -0.11 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 2igl s VAL 88 CO 0.05 0.32 0.59 -0.36 0.00 0.00 0.00 175.10 175.69 2igl s PHE 89 N 1.28 3.28 -1.46 5.22 0.40 -0.00 -1.80 117.98 124.90 2igl s PHE 89 Ca 0.00 0.75 -0.11 0.00 -0.60 0.00 0.00 56.93 56.97 2igl s PHE 89 Cb -0.15 -2.79 0.04 0.00 0.51 0.00 0.00 43.02 40.62 2igl s PHE 89 CO -0.10 -0.30 2.36 1.63 0.70 0.00 0.00 175.22 179.51 2igl n LYS 90 N 5.62 3.34 0.20 0.44 4.76 -0.17 -0.49 118.16 131.86 2igl n LYS 90 Ca -0.02 -2.74 0.13 0.00 -2.87 0.00 0.00 58.31 52.81 2igl n LYS 90 Cb 0.49 -3.05 0.27 0.00 -1.84 0.00 0.00 35.03 30.90 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 3.60 0.00 -0.30 -0.18 1.35 -1.86 -3.22 112.91 112.30 2igl h THR 91 Ca 0.62 -0.83 -0.02 0.00 -0.55 0.00 0.00 66.41 65.63 2igl h THR 91 Cb 0.52 1.83 -0.01 0.00 -1.73 0.00 0.00 68.15 68.76 2igl h THR 91 CO 1.79 0.00 0.11 1.23 -0.25 0.00 0.00 175.52 178.39 2igl h GLY 92 N 3.86 0.49 1.78 5.82 0.00 -1.57 -1.80 103.07 111.66 2igl h GLY 92 Ca 0.00 -0.28 -0.09 0.00 0.00 0.00 0.00 47.33 46.97 2igl h GLY 92 CO 0.00 0.26 -0.30 -0.55 0.00 0.00 0.00 176.54 175.95 2igl h ASP 93 N 0.33 0.25 0.02 0.19 3.32 -1.76 -1.56 116.42 117.21 2igl h ASP 93 Ca 0.10 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 2igl h ASP 93 Cb 0.21 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2igl h ASP 93 CO -0.01 0.55 -0.01 0.22 -1.72 0.00 0.00 179.24 178.28 2igl h TYR 94 N 0.22 -0.02 -0.30 4.55 3.20 -1.49 -2.19 116.97 120.94 2igl h TYR 94 Ca 0.03 -0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.81 2igl h TYR 94 Cb 0.65 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 2igl h TYR 94 CO 0.01 0.08 -0.22 0.74 -1.64 0.00 0.00 178.16 177.14 2igl h PHE 95 N -0.12 0.63 -0.64 -3.82 0.05 -1.19 -2.94 116.94 108.91 2igl h PHE 95 Ca -0.00 -0.13 0.05 0.00 3.82 0.00 0.00 57.97 61.71 2igl h PHE 95 Cb 0.11 -0.16 -0.05 0.00 2.00 0.00 0.00 35.95 37.85 2igl h PHE 95 CO -0.04 0.74 0.36 -0.22 -0.18 0.00 0.00 178.31 178.97 2igl h LYS 96 N 0.50 0.66 0.00 1.51 1.63 -1.08 0.18 116.57 119.98 2igl h LYS 96 Ca 0.08 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 2igl h LYS 96 Cb 0.65 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 2igl h LYS 96 CO 0.05 0.43 0.00 1.63 -3.45 0.00 0.00 179.45 178.11 2igl n LYS 97 N -4.79 0.13 -0.37 1.90 5.02 -0.84 -0.74 118.16 118.47 2igl n LYS 97 Ca 0.08 0.55 0.08 0.00 -2.02 0.00 0.00 58.31 57.00 2igl n LYS 97 Cb 0.15 -1.87 0.25 0.00 -0.02 0.00 0.00 35.03 33.55 2igl n LYS 97 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2igl n GLN 98 N -2.13 3.10 -3.16 1.97 6.02 0.50 -4.95 117.38 118.74 2igl n GLN 98 Ca -0.00 -2.51 -0.21 0.00 -0.01 0.00 0.00 57.00 54.26 2igl n GLN 98 Cb 0.09 -1.59 0.05 0.00 1.02 0.00 0.00 30.24 29.81 2igl n GLN 98 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2igl n ASN 99 N 0.65 -5.94 -4.18 1.08 5.03 0.08 -4.99 115.26 106.98 2igl n ASN 99 Ca 0.19 -0.35 -0.23 0.00 0.87 0.00 0.00 54.58 55.06 2igl n ASN 99 Cb 0.67 -4.69 -0.14 0.00 -1.02 0.00 0.00 39.78 34.59 2igl n ASN 99 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2igl s LEU 100 N -6.47 2.13 0.26 3.41 1.43 -0.33 -5.01 118.68 114.10 2igl s LEU 100 Ca 0.37 -0.43 0.02 0.00 -1.03 0.00 0.00 54.13 53.06 2igl s LEU 100 Cb -0.16 -0.79 -0.03 0.00 0.03 0.00 0.00 46.19 45.23 2igl s LEU 100 CO 0.46 0.12 0.43 -1.61 0.23 0.00 0.00 176.35 175.98 2igl s GLU 101 N -0.94 3.48 0.01 1.70 2.02 -1.26 -3.20 118.70 120.51 2igl s GLU 101 Ca 0.05 -0.48 -0.04 0.00 0.02 0.00 0.00 54.97 54.51 2igl s GLU 101 Cb -0.08 -2.80 -0.01 0.00 0.10 0.00 0.00 34.13 31.35 2igl s GLU 101 CO 0.01 0.33 0.06 0.45 0.02 0.00 0.00 175.26 176.13 2igl s SER 102 N -3.73 0.12 0.40 -0.19 0.15 -1.26 -4.85 113.70 104.34 2igl s SER 102 Ca 0.37 -0.34 0.17 0.00 0.70 0.00 0.00 55.95 56.85 2igl s SER 102 Cb -0.10 0.16 0.85 0.00 -1.71 0.00 0.00 66.02 65.22 2igl s SER 102 CO 0.31 -0.33 1.85 0.15 1.20 0.00 0.00 173.24 176.42 2igl h PHE 103 N 4.46 0.00 -3.57 3.44 3.57 -1.76 -3.42 116.94 119.66 2igl h PHE 103 Ca -0.31 0.00 -0.64 0.00 3.53 0.00 0.00 57.97 60.54 2igl h PHE 103 Cb 1.20 0.00 -0.21 0.00 2.79 0.00 0.00 35.95 39.73 2igl h PHE 103 CO 0.62 0.33 -0.61 -0.06 -2.23 0.00 0.00 178.31 176.35 2igl s PHE 104 N -4.05 3.11 0.34 0.41 0.40 -1.26 -4.97 117.98 111.95 2igl s PHE 104 Ca -0.02 -0.31 0.04 0.00 -0.60 0.00 0.00 56.93 56.03 2igl s PHE 104 Cb 0.13 -2.20 0.60 0.00 0.51 0.00 0.00 43.02 42.06 2igl s PHE 104 CO 0.69 -0.24 1.89 -1.00 0.70 0.00 0.00 175.22 177.26 2igl h PRO 105 N 7.88 0.59 -2.75 0.24 0.13 -1.98 -3.34 132.00 132.77 2igl h PRO 105 Ca -0.37 -0.11 0.05 0.00 -0.87 0.00 0.00 66.00 64.70 2igl h PRO 105 Cb 1.18 -0.09 -0.11 0.00 0.13 0.00 0.00 31.00 32.10 2igl h PRO 105 CO 0.60 0.56 0.31 -1.83 -0.23 0.00 0.00 178.00 177.42 2igl s GLU 106 N -5.09 1.26 -0.28 0.86 -1.05 -1.26 -2.20 118.70 110.94 2igl s GLU 106 Ca -0.08 -0.56 0.03 0.00 -0.15 0.00 0.00 54.97 54.21 2igl s GLU 106 Cb 0.16 0.52 0.07 0.00 -0.44 0.00 0.00 34.13 34.44 2igl s GLU 106 CO 0.77 -0.56 -0.04 0.42 0.95 0.00 0.00 175.26 176.79 2igl s ILE 107 N -3.58 2.02 0.10 1.83 1.01 0.36 -4.93 121.20 118.01 2igl s ILE 107 Ca 0.05 -1.75 -0.21 0.00 0.00 0.00 0.00 60.65 58.75 2igl s ILE 107 Cb -0.02 -2.27 -0.07 0.00 0.01 0.00 0.00 42.46 40.11 2igl s ILE 107 CO -0.06 -0.23 0.62 -2.16 0.00 0.00 0.00 174.94 173.11 2igl s PRO 108 N 1.12 4.28 -0.19 2.79 0.04 -1.26 -0.82 135.00 140.96 2igl s PRO 108 Ca -0.02 0.83 -0.00 0.00 0.04 0.00 0.00 61.00 61.85 2igl s PRO 108 Cb -0.19 -3.22 0.05 0.00 0.04 0.00 0.00 34.50 31.18 2igl s PRO 108 CO -0.07 0.61 -0.05 0.08 0.04 0.00 0.00 177.00 177.61 2igl s VAL 109 N -1.15 1.24 -0.19 -0.36 1.01 0.63 -4.98 120.40 116.61 2igl s VAL 109 Ca 0.31 -0.83 -0.14 0.00 0.00 0.00 0.00 61.98 61.33 2igl s VAL 109 Cb -0.20 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 2igl s VAL 109 CO 0.21 0.05 0.31 -0.70 0.00 0.00 0.00 175.10 174.97 2igl s GLU 110 N 1.56 4.20 0.19 2.72 2.12 -1.26 -1.03 118.70 127.20 2igl s GLU 110 Ca -0.01 0.08 0.00 0.00 0.36 0.00 0.00 54.97 55.40 2igl s GLU 110 Cb -0.16 -3.49 -0.04 0.00 0.26 0.00 0.00 34.13 30.69 2igl s GLU 110 CO -0.07 0.10 0.08 -0.59 -0.54 0.00 0.00 175.26 174.23 2igl s PHE 111 N 0.91 1.21 -0.08 5.30 -0.12 -0.07 -4.98 117.98 120.15 2igl s PHE 111 Ca 0.16 -1.22 0.05 0.00 -0.05 0.00 0.00 56.93 55.87 2igl s PHE 111 Cb -0.14 -0.66 -0.00 0.00 -0.63 0.00 0.00 43.02 41.58 2igl s PHE 111 CO 0.06 -0.44 -0.24 -1.58 -0.05 0.00 0.00 175.22 172.97 2igl s HIS 112 N -3.92 2.44 -0.36 3.49 5.65 -1.26 -0.75 115.29 120.58 2igl s HIS 112 Ca 0.32 -0.86 -0.11 0.00 0.25 0.00 0.00 55.06 54.66 2igl s HIS 112 Cb 0.07 -1.62 0.01 0.00 -1.18 0.00 0.00 32.58 29.87 2igl s HIS 112 CO 0.08 -0.31 0.21 0.42 -0.65 0.00 0.00 174.74 174.49 2igl s ILE 113 N 0.09 4.76 -0.13 0.89 1.01 -0.55 -4.92 121.20 122.36 2igl s ILE 113 Ca -0.11 -0.65 0.18 0.00 0.00 0.00 0.00 60.65 60.07 2igl s ILE 113 Cb -0.16 -3.57 -0.23 0.00 0.01 0.00 0.00 42.46 38.51 2igl s ILE 113 CO 0.06 -0.14 0.44 -0.46 0.00 0.00 0.00 174.94 174.84 2igl n ASN 114 N 5.03 0.35 -3.82 3.58 6.94 -1.26 -1.98 115.26 124.10 2igl n ASN 114 Ca -0.12 0.16 -0.25 0.00 -0.02 0.00 0.00 54.58 54.35 2igl n ASN 114 Cb 0.47 0.83 -0.17 0.00 -2.36 0.00 0.00 39.78 38.55 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 -2.84 0.98 0.00 -3.83 1.02 -1.26 -4.92 119.74 108.89 2igl s LYS 115 Ca -0.07 -0.11 0.24 0.00 0.02 0.00 0.00 55.97 56.05 2igl s LYS 115 Cb 0.09 -1.36 1.04 0.00 -0.52 0.00 0.00 37.83 37.08 2igl s LYS 115 CO 0.84 -0.33 1.76 1.33 -0.92 0.00 0.00 175.35 178.03 2igl n VAL 116 N 5.05 0.35 -0.62 3.17 0.24 -1.26 -3.24 118.33 122.01 2igl n VAL 116 Ca -0.09 0.09 -0.11 0.00 -2.04 0.00 0.00 64.34 62.18 2igl n VAL 116 Cb 0.50 -0.68 0.19 0.00 -1.47 0.00 0.00 33.84 32.37 2igl n VAL 116 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2igl n ASN 117 N -1.47 3.90 -4.27 -1.34 6.94 -1.26 -4.88 115.26 112.88 2igl n ASN 117 Ca 0.07 -3.07 -0.17 0.00 -0.02 0.00 0.00 54.58 51.39 2igl n ASN 117 Cb 0.26 -0.72 -0.10 0.00 -2.36 0.00 0.00 39.78 36.86 2igl n ASN 117 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2igl s GLU 118 N -2.46 1.12 0.15 -3.83 2.02 -1.20 -3.59 118.70 110.90 2igl s GLU 118 Ca 0.43 -1.42 -0.06 0.00 0.02 0.00 0.00 54.97 53.94 2igl s GLU 118 Cb 0.35 -0.85 -0.06 0.00 0.10 0.00 0.00 34.13 33.67 2igl s GLU 118 CO 0.10 0.14 0.40 -1.58 0.02 0.00 0.00 175.26 174.33 2igl s HIS 119 N -2.84 3.48 -0.13 1.61 5.65 -0.60 -4.73 115.29 117.73 2igl s HIS 119 Ca 0.16 0.62 0.01 0.00 0.25 0.00 0.00 55.06 56.10 2igl s HIS 119 Cb -0.01 -2.05 0.02 0.00 -1.18 0.00 0.00 32.58 29.36 2igl s HIS 119 CO 0.03 0.42 -0.16 0.71 -0.65 0.00 0.00 174.74 175.09 2igl s TYR 120 N -1.65 2.15 -0.12 3.88 1.51 0.69 -4.85 117.35 118.95 2igl s TYR 120 Ca 0.41 -1.11 0.03 0.00 -1.01 0.00 0.00 57.07 55.39 2igl s TYR 120 Cb -0.12 -1.55 0.01 0.00 -0.11 0.00 0.00 41.96 40.19 2igl s TYR 120 CO 0.23 -0.58 -0.21 -1.58 -1.11 0.00 0.00 175.55 172.31 2igl s HIS 121 N 1.19 2.46 -0.36 2.71 2.46 -1.26 -1.47 115.29 121.01 2igl s HIS 121 Ca -0.01 -1.16 0.03 0.00 0.47 0.00 0.00 55.06 54.38 2igl s HIS 121 Cb -0.14 -1.68 0.11 0.00 -0.13 0.00 0.00 32.58 30.73 2igl s HIS 121 CO -0.06 -0.53 0.10 0.08 -2.47 0.00 0.00 174.74 171.87 2igl s VAL 122 N 0.73 1.85 0.46 0.89 1.01 -0.35 -0.59 120.40 124.40 2igl s VAL 122 Ca -0.10 -2.21 -0.11 0.00 0.00 0.00 0.00 61.98 59.56 2igl s VAL 122 Cb -0.16 -2.36 -0.06 0.00 0.00 0.00 0.00 36.38 33.80 2igl s VAL 122 CO 0.01 -0.67 0.84 -2.84 0.00 0.00 0.00 175.10 172.44 2igl s PRO 123 N 0.92 3.75 -0.10 2.72 0.02 -1.25 -2.96 135.00 138.10 2igl s PRO 123 Ca 0.12 0.54 -0.00 0.00 0.02 0.00 0.00 61.00 61.67 2igl s PRO 123 Cb -0.20 -2.31 0.02 0.00 0.02 0.00 0.00 34.50 32.04 2igl s PRO 123 CO -0.11 -0.16 -0.06 -1.17 -0.33 0.00 0.00 177.00 175.16 2igl s LEU 124 N -4.19 1.10 -0.42 -5.54 2.96 0.69 -3.83 118.68 109.45 2igl s LEU 124 Ca 0.52 -0.26 -0.17 0.00 -0.22 0.00 0.00 54.13 54.00 2igl s LEU 124 Cb -0.10 -0.76 0.02 0.00 0.50 0.00 0.00 46.19 45.85 2igl s LEU 124 CO 0.36 -0.12 0.44 -0.76 -1.32 0.00 0.00 176.35 174.94 2igl s LEU 125 N 1.69 4.90 -0.14 -0.68 1.43 0.15 -0.86 118.68 125.17 2igl s LEU 125 Ca 0.04 -0.71 -0.03 0.00 -1.03 0.00 0.00 54.13 52.39 2igl s LEU 125 Cb -0.13 -2.37 -0.03 0.00 0.03 0.00 0.00 46.19 43.69 2igl s LEU 125 CO -0.07 -0.59 -0.03 -0.22 0.23 0.00 0.00 176.35 175.67 2igl s LEU 126 N 2.12 3.31 0.20 1.79 2.96 0.07 -1.39 118.68 127.74 2igl s LEU 126 Ca 0.12 -0.07 0.03 0.00 -0.22 0.00 0.00 54.13 53.98 2igl s LEU 126 Cb -0.17 -1.79 -0.05 0.00 0.50 0.00 0.00 46.19 44.68 2igl s LEU 126 CO 0.13 0.21 -0.01 -0.44 -1.32 0.00 0.00 176.35 174.92 2igl s SER 127 N 0.09 1.60 0.30 3.68 0.01 -0.20 -0.74 113.70 118.44 2igl s SER 127 Ca -0.00 -1.18 -0.00 0.00 1.31 0.00 0.00 55.95 56.07 2igl s SER 127 Cb -0.13 0.05 0.47 0.00 0.21 0.00 0.00 66.02 66.61 2igl s SER 127 CO 0.03 -0.51 1.90 1.56 0.41 0.00 0.00 173.24 176.62 2igl h GLN 128 N 2.59 0.88 0.00 12.44 4.20 -1.99 -3.24 115.11 129.98 2igl h GLN 128 Ca -0.37 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.22 2igl h GLN 128 Cb 1.21 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.83 2igl h GLN 128 CO 0.64 0.69 -0.03 0.66 -0.67 0.00 0.00 178.83 180.12 2igl n TYR 129 N -4.34 0.00 -3.55 2.96 4.02 -1.26 -1.96 117.16 113.03 2igl n TYR 129 Ca 0.06 -0.89 -0.10 0.00 -0.01 0.00 0.00 57.90 56.95 2igl n TYR 129 Cb 0.14 -0.13 -0.04 0.00 -0.02 0.00 0.00 39.34 39.29 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 -2.58 -0.36 0.22 2.72 0.00 -1.22 -4.95 107.32 101.14 2igl s GLY 130 Ca 0.27 1.60 -0.19 0.00 0.00 0.00 0.00 44.72 46.40 2igl s GLY 130 CO 0.03 0.75 0.58 -2.52 0.00 0.00 0.00 173.10 171.94 2igl s TYR 131 N -1.90 -0.17 0.04 1.90 -0.85 -1.26 -1.03 117.35 114.07 2igl s TYR 131 Ca 0.01 -0.18 0.01 0.00 -0.52 0.00 0.00 57.07 56.38 2igl s TYR 131 Cb -0.01 0.49 -0.02 0.00 0.38 0.00 0.00 41.96 42.80 2igl s TYR 131 CO -0.02 -1.00 -0.06 -1.12 -1.52 0.00 0.00 175.55 171.84 2igl s SER 132 N -2.88 0.60 0.13 -0.18 0.01 -0.49 -4.98 113.70 105.92 2igl s SER 132 Ca 0.09 -0.58 -0.12 0.00 1.31 0.00 0.00 55.95 56.66 2igl s SER 132 Cb -0.02 0.07 0.01 0.00 0.21 0.00 0.00 66.02 66.29 2igl s SER 132 CO -0.01 -0.28 0.32 0.28 0.41 0.00 0.00 173.24 173.96 2igl s THR 133 N -1.66 0.09 0.05 1.44 -1.32 -1.26 -0.68 115.64 112.30 2igl s THR 133 Ca -0.10 -1.01 -0.28 0.00 -1.21 0.00 0.00 61.69 59.09 2igl s THR 133 Cb -0.08 -1.45 0.10 0.00 -1.51 0.00 0.00 72.50 69.56 2igl s THR 133 CO -0.01 -0.40 1.17 -0.72 -2.21 0.00 0.00 174.62 172.45 2igl s TYR 134 N -3.87 -0.07 -0.38 9.09 -0.85 -1.25 -5.06 117.35 114.97 2igl s TYR 134 Ca 0.08 -0.12 -0.26 0.00 -0.52 0.00 0.00 57.07 56.26 2igl s TYR 134 Cb 0.03 0.58 0.02 0.00 0.38 0.00 0.00 41.96 42.97 2igl s TYR 134 CO -0.08 -0.49 0.91 0.50 -1.52 0.00 0.00 175.55 174.88 2igl s ARG 135 N -2.71 3.81 0.94 -3.49 3.52 -1.26 -3.84 118.95 115.92 2igl s ARG 135 Ca 0.14 0.52 -0.15 0.00 -0.13 0.00 0.00 55.73 56.11 2igl s ARG 135 Cb 0.02 -3.81 0.17 0.00 -1.56 0.00 0.00 34.95 29.77 2igl s ARG 135 CO -0.01 -0.96 1.22 0.20 -0.81 0.00 0.00 175.30 174.94 2igl s GLY 136 N 1.91 1.67 0.00 8.12 0.00 0.24 -5.02 107.32 114.25 2igl s GLY 136 Ca 0.37 -0.90 0.29 0.00 0.00 0.00 0.00 44.72 44.49 2igl s GLY 136 CO 0.19 -0.23 1.92 1.44 0.00 0.00 0.00 173.10 176.42