#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gi0 h GLU 2 N 0.00 0.45 -0.86 0.00 4.57 -2.03 -2.74 114.58 113.97 2gi0 h GLU 2 Ca 0.00 -0.07 -0.49 0.00 -1.18 0.00 0.00 59.36 57.61 2gi0 h GLU 2 Cb 0.00 -0.08 -0.27 0.00 -0.16 0.00 0.00 28.75 28.24 2gi0 h GLU 2 CO 0.00 0.43 0.49 0.00 -1.18 0.00 0.00 179.01 178.75 2gi0 s SER 4 N -1.80 0.13 -0.02 0.00 1.04 -1.04 -1.48 113.70 110.53 2gi0 s SER 4 Ca 0.56 -0.66 -0.09 0.00 0.48 0.00 0.00 55.95 56.24 2gi0 s SER 4 Cb 0.47 0.34 0.01 0.00 0.10 0.00 0.00 66.02 66.94 2gi0 s SER 4 CO 0.05 -0.73 0.20 0.54 0.98 0.00 0.00 173.24 174.29 2gi0 s VAL 5 N -3.86 0.06 -0.22 5.02 0.11 -0.40 -4.62 120.40 116.48 2gi0 s VAL 5 Ca 0.05 -0.46 -0.10 0.00 -2.93 0.00 0.00 61.98 58.55 2gi0 s VAL 5 Cb 0.05 -0.44 -0.05 0.00 -1.53 0.00 0.00 36.38 34.41 2gi0 s VAL 5 CO -0.11 -0.25 0.13 -1.81 -3.33 0.00 0.00 175.10 169.73 2gi0 s ASP 6 N -0.97 5.99 -0.02 3.54 1.01 -1.26 -1.08 116.67 123.88 2gi0 s ASP 6 Ca -0.11 0.11 0.07 0.00 0.71 0.00 0.00 52.55 53.33 2gi0 s ASP 6 Cb -0.05 -2.07 -0.02 0.00 1.01 0.00 0.00 42.92 41.79 2gi0 s ASP 6 CO 0.02 0.10 -0.23 -0.63 0.21 0.00 0.00 175.17 174.64 2gi0 s ILE 7 N 0.87 1.80 -0.01 0.77 -1.09 -0.13 -4.95 121.20 118.45 2gi0 s ILE 7 Ca 0.07 -0.97 0.08 0.00 -2.23 0.00 0.00 60.65 57.60 2gi0 s ILE 7 Cb -0.13 -1.49 -0.02 0.00 -1.58 0.00 0.00 42.46 39.24 2gi0 s ILE 7 CO 0.03 0.51 -0.25 -1.10 -1.23 0.00 0.00 174.94 172.89 2gi0 s GLN 8 N -0.52 2.04 -0.14 2.79 1.11 -1.26 -1.21 119.66 122.47 2gi0 s GLN 8 Ca 0.08 -0.92 0.02 0.00 0.01 0.00 0.00 55.36 54.55 2gi0 s GLN 8 Cb -0.09 -1.99 0.01 0.00 -1.01 0.00 0.00 33.01 29.93 2gi0 s GLN 8 CO -0.01 0.54 -0.21 0.20 0.01 0.00 0.00 175.29 175.82 2gi0 s GLY 9 N -0.65 1.33 0.00 3.09 0.00 -0.48 -1.86 107.32 108.75 2gi0 s GLY 9 Ca 0.10 -1.06 0.00 0.00 0.00 0.00 0.00 44.72 43.76 2gi0 s GLY 9 CO -0.01 -0.00 0.00 1.16 0.00 0.00 0.00 173.10 174.25 2gi0 n ASN 10 N 4.08 0.85 0.00 1.64 0.23 -0.84 -3.59 115.26 117.63 2gi0 n ASN 10 Ca -0.20 -0.90 0.11 0.00 -0.53 0.00 0.00 54.58 53.06 2gi0 n ASN 10 Cb 0.51 0.00 0.51 0.00 -2.08 0.00 0.00 39.78 38.72 2gi0 n ASN 10 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2gi0 n ASP 11 N -1.94 0.00 -1.49 0.53 8.00 -1.24 -3.01 116.55 117.41 2gi0 n ASP 11 Ca 0.00 0.41 0.05 0.00 0.71 0.00 0.00 54.79 55.96 2gi0 n ASP 11 Cb 0.00 -0.47 0.32 0.00 -0.02 0.00 0.00 41.12 40.95 2gi0 n ASP 11 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2gi0 n GLN 12 N -1.47 3.75 -3.48 -1.24 3.00 -1.26 -4.95 117.38 111.72 2gi0 n GLN 12 Ca 0.06 -3.03 -0.21 0.00 -0.01 0.00 0.00 57.00 53.81 2gi0 n GLN 12 Cb 0.26 -2.07 0.08 0.00 0.00 0.00 0.00 30.24 28.50 2gi0 n GLN 12 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.06 176.94 2gi0 n MET 13 N -0.07 -7.18 -4.49 -1.09 1.56 -1.16 -5.00 117.12 99.69 2gi0 n MET 13 Ca 0.28 0.80 -0.22 0.00 -0.27 0.00 0.00 57.70 58.29 2gi0 n MET 13 Cb 1.11 -5.72 -0.14 0.00 2.15 0.00 0.00 33.22 30.62 2gi0 n MET 13 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 2gi0 s GLN 14 N -5.93 1.11 0.38 2.12 -0.21 -1.26 -4.52 119.66 111.36 2gi0 s GLN 14 Ca 0.37 -0.79 -0.06 0.00 0.02 0.00 0.00 55.36 54.90 2gi0 s GLN 14 Cb -0.16 -1.15 -0.05 0.00 1.00 0.00 0.00 33.01 32.65 2gi0 s GLN 14 CO 0.70 0.29 0.68 -0.06 -2.12 0.00 0.00 175.29 174.78 2gi0 s PHE 15 N -0.77 3.50 -1.33 0.91 0.08 -1.26 -1.99 117.98 117.13 2gi0 s PHE 15 Ca 0.04 0.78 0.27 0.00 0.12 0.00 0.00 56.93 58.15 2gi0 s PHE 15 Cb -0.08 -2.24 1.33 0.00 -0.57 0.00 0.00 43.02 41.46 2gi0 s PHE 15 CO 0.01 -0.04 1.92 0.27 -0.10 0.00 0.00 175.22 177.28 2gi0 n ASN 16 N -1.50 0.00 -3.55 1.36 6.94 -0.78 -4.83 115.26 112.90 2gi0 n ASN 16 Ca -0.00 0.04 -0.15 0.00 -0.02 0.00 0.00 54.58 54.45 2gi0 n ASN 16 Cb 0.54 -0.34 -0.05 0.00 -2.36 0.00 0.00 39.78 37.58 2gi0 n ASN 16 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2gi0 s THR 17 N -2.67 0.02 -0.38 5.53 -1.32 -1.26 -5.03 115.64 110.52 2gi0 s THR 17 Ca 0.23 -0.18 0.13 0.00 -1.21 0.00 0.00 61.69 60.67 2gi0 s THR 17 Cb 0.18 -0.97 0.37 0.00 -1.51 0.00 0.00 72.50 70.57 2gi0 s THR 17 CO 0.44 -0.10 1.28 -0.46 -2.21 0.00 0.00 174.62 173.57 2gi0 n ASN 18 N 0.46 3.15 -3.67 8.08 6.94 -1.26 -4.83 115.26 124.14 2gi0 n ASN 18 Ca -0.18 -2.59 -0.08 0.00 -0.02 0.00 0.00 54.58 51.70 2gi0 n ASN 18 Cb 0.60 -0.37 -0.09 0.00 -2.36 0.00 0.00 39.78 37.56 2gi0 n ASN 18 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2gi0 s ALA 19 N -2.06 -1.33 -0.08 -2.53 0.00 -1.26 -1.84 121.76 112.66 2gi0 s ALA 19 Ca 0.30 1.78 0.05 0.00 0.00 0.00 0.00 51.96 54.09 2gi0 s ALA 19 Cb 0.22 -1.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.13 2gi0 s ALA 19 CO 0.09 -0.47 -0.24 0.42 0.00 0.00 0.00 175.76 175.56 2gi0 s ILE 20 N 1.88 2.13 -0.13 0.00 1.01 -0.06 -4.98 121.20 121.05 2gi0 s ILE 20 Ca -0.07 -1.02 -0.03 0.00 0.00 0.00 0.00 60.65 59.52 2gi0 s ILE 20 Cb -0.09 -1.79 -0.03 0.00 0.01 0.00 0.00 42.46 40.56 2gi0 s ILE 20 CO -0.15 0.57 -0.01 -0.89 0.00 0.00 0.00 174.94 174.45 2gi0 s THR 21 N 0.03 4.14 -0.17 2.92 2.01 -1.26 -1.30 115.64 122.01 2gi0 s THR 21 Ca -0.09 -0.28 0.01 0.00 0.31 0.00 0.00 61.69 61.64 2gi0 s THR 21 Cb -0.15 -2.79 0.01 0.00 0.01 0.00 0.00 72.50 69.58 2gi0 s THR 21 CO 0.06 0.53 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.63 2gi0 s VAL 22 N -0.08 2.20 -0.03 3.82 1.01 0.43 -4.94 120.40 122.82 2gi0 s VAL 22 Ca 0.03 -0.91 -0.29 0.00 0.00 0.00 0.00 61.98 60.81 2gi0 s VAL 22 Cb -0.13 -1.91 -0.08 0.00 0.00 0.00 0.00 36.38 34.26 2gi0 s VAL 22 CO 0.02 0.53 2.04 -0.62 0.00 0.00 0.00 175.10 177.08 2gi0 s ASP 23 N 1.09 6.18 0.25 3.32 -1.08 -1.26 -0.98 116.67 124.18 2gi0 s ASP 23 Ca -0.00 2.48 0.19 0.00 -0.52 0.00 0.00 52.55 54.70 2gi0 s ASP 23 Cb -0.14 -2.52 0.95 0.00 -1.46 0.00 0.00 42.92 39.74 2gi0 s ASP 23 CO -0.07 -1.30 1.57 2.29 0.52 0.00 0.00 175.17 178.18 2gi0 n LYS 24 N 7.87 0.13 0.01 4.34 2.85 -0.18 -0.83 118.16 132.35 2gi0 n LYS 24 Ca 0.23 0.56 0.12 0.00 -1.05 0.00 0.00 58.31 58.16 2gi0 n LYS 24 Cb 0.42 -1.86 0.22 0.00 -0.65 0.00 0.00 35.03 33.16 2gi0 n LYS 24 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2gi0 n SER 25 N -2.12 0.54 -4.69 -5.58 3.41 -1.26 -4.91 113.62 99.01 2gi0 n SER 25 Ca -0.00 -0.19 -0.44 0.00 -0.26 0.00 0.00 58.87 57.98 2gi0 n SER 25 Cb 0.08 0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 64.27 2gi0 n SER 25 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gi0 h LYS 27 N 5.60 0.65 -4.84 0.00 6.56 -1.90 -3.41 116.57 119.23 2gi0 h LYS 27 Ca -0.45 -0.37 -0.31 0.00 -1.06 0.00 0.00 60.65 58.46 2gi0 h LYS 27 Cb 1.24 0.03 -0.15 0.00 -0.57 0.00 0.00 32.23 32.78 2gi0 h LYS 27 CO 0.86 0.99 -0.65 -0.65 -2.06 0.00 0.00 179.45 177.93 2gi0 s GLN 28 N -4.23 1.18 0.00 3.15 -0.21 -1.26 -1.69 119.66 116.60 2gi0 s GLN 28 Ca -0.12 -1.58 0.00 0.00 0.02 0.00 0.00 55.36 53.67 2gi0 s GLN 28 Cb 0.08 -0.29 -0.00 0.00 1.00 0.00 0.00 33.01 33.80 2gi0 s GLN 28 CO 0.83 -0.16 -0.01 0.12 -2.12 0.00 0.00 175.29 173.95 2gi0 s PHE 29 N -3.66 0.07 -0.06 0.91 5.36 -0.25 -4.82 117.98 115.54 2gi0 s PHE 29 Ca 0.27 -0.10 0.05 0.00 -0.96 0.00 0.00 56.93 56.19 2gi0 s PHE 29 Cb 0.06 -0.05 -0.01 0.00 -0.34 0.00 0.00 43.02 42.69 2gi0 s PHE 29 CO 0.06 -0.03 -0.21 0.99 -1.46 0.00 0.00 175.22 174.56 2gi0 s THR 30 N -0.26 1.78 -0.17 0.12 2.01 -0.55 -0.95 115.64 117.63 2gi0 s THR 30 Ca -0.03 -0.91 -0.02 0.00 0.31 0.00 0.00 61.69 61.05 2gi0 s THR 30 Cb -0.02 -1.52 -0.01 0.00 0.01 0.00 0.00 72.50 70.96 2gi0 s THR 30 CO -0.00 0.50 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.66 2gi0 s VAL 31 N -0.01 3.31 -0.47 3.82 1.01 0.25 -1.27 120.40 127.04 2gi0 s VAL 31 Ca -0.06 -0.55 -0.12 0.00 0.00 0.00 0.00 61.98 61.25 2gi0 s VAL 31 Cb -0.13 -2.44 0.10 0.00 0.00 0.00 0.00 36.38 33.90 2gi0 s VAL 31 CO 0.04 0.49 0.37 0.20 0.00 0.00 0.00 175.10 176.19 2gi0 s ASN 32 N 0.73 5.91 -0.05 3.32 0.01 -0.24 -1.27 114.94 123.35 2gi0 s ASN 32 Ca -0.04 -1.60 -0.13 0.00 -0.71 0.00 0.00 52.86 50.38 2gi0 s ASN 32 Cb -0.15 -2.09 -0.05 0.00 0.41 0.00 0.00 41.25 39.36 2gi0 s ASN 32 CO 0.02 -0.67 0.34 -0.22 -1.51 0.00 0.00 177.10 175.06 2gi0 s LEU 33 N 1.51 4.42 0.30 0.60 2.96 0.89 -0.96 118.68 128.40 2gi0 s LEU 33 Ca 0.04 0.79 0.03 0.00 -0.22 0.00 0.00 54.13 54.77 2gi0 s LEU 33 Cb -0.26 -2.45 -0.04 0.00 0.50 0.00 0.00 46.19 43.95 2gi0 s LEU 33 CO 0.03 0.30 0.15 -0.94 -1.32 0.00 0.00 176.35 174.57 2gi0 s SER 34 N -0.80 1.56 -0.42 3.68 1.04 -0.35 -1.41 113.70 117.00 2gi0 s SER 34 Ca 0.21 -1.54 0.04 0.00 0.48 0.00 0.00 55.95 55.14 2gi0 s SER 34 Cb -0.15 0.35 0.17 0.00 0.10 0.00 0.00 66.02 66.49 2gi0 s SER 34 CO 0.10 -0.86 0.39 -2.28 0.98 0.00 0.00 173.24 171.56 2gi0 s HIS 35 N -3.60 0.58 0.85 5.02 2.46 -1.23 -1.38 115.29 118.00 2gi0 s HIS 35 Ca 0.35 -1.94 -0.13 0.00 0.47 0.00 0.00 55.06 53.81 2gi0 s HIS 35 Cb 0.05 -0.70 0.04 0.00 -0.13 0.00 0.00 32.58 31.84 2gi0 s HIS 35 CO 0.17 -0.90 0.71 -2.30 -2.47 0.00 0.00 174.74 169.94 2gi0 n PRO 36 N 3.03 -0.03 0.00 2.88 -0.02 -1.24 -1.03 135.00 138.59 2gi0 n PRO 36 Ca 0.26 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 2gi0 n PRO 36 Cb 0.48 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 2gi0 n PRO 36 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gi0 n GLY 37 N 1.19 -0.85 0.00 -1.23 0.00 -1.26 -3.66 105.19 99.37 2gi0 n GLY 37 Ca 0.10 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 43.96 2gi0 n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2gi0 n ASN 38 N 0.00 0.46 -4.74 1.61 5.03 -1.26 -4.39 115.26 111.97 2gi0 n ASN 38 Ca 0.00 -1.02 -0.40 0.00 0.87 0.00 0.00 54.58 54.03 2gi0 n ASN 38 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 38.71 2gi0 n ASN 38 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2gi0 s LEU 39 N -0.02 4.46 0.80 3.41 1.43 -1.26 -4.85 118.68 122.66 2gi0 s LEU 39 Ca 0.00 1.55 -0.11 0.00 -1.03 0.00 0.00 54.13 54.53 2gi0 s LEU 39 Cb 0.00 -3.33 0.09 0.00 0.03 0.00 0.00 46.19 42.97 2gi0 s LEU 39 CO 0.00 -0.01 1.16 -2.16 0.23 0.00 0.00 176.35 175.57 2gi0 s PRO 40 N -0.04 1.90 0.29 1.29 0.04 -1.26 -1.66 135.00 135.56 2gi0 s PRO 40 Ca 0.41 -0.00 0.03 0.00 0.04 0.00 0.00 61.00 61.48 2gi0 s PRO 40 Cb -0.21 -1.98 0.62 0.00 0.04 0.00 0.00 34.50 32.97 2gi0 s PRO 40 CO 0.25 -1.60 1.81 -0.22 0.04 0.00 0.00 177.00 177.27 2gi0 h LYS 41 N -1.02 0.86 0.00 4.56 3.64 -1.87 -0.43 116.57 122.30 2gi0 h LYS 41 Ca -0.46 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 2gi0 h LYS 41 Cb 1.32 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 2gi0 h LYS 41 CO 0.63 0.57 0.00 0.27 -2.27 0.00 0.00 179.45 178.64 2gi0 n ASN 42 N -4.69 0.00 -0.03 4.20 6.94 -1.26 -1.54 115.26 118.88 2gi0 n ASN 42 Ca 0.20 -0.37 -0.05 0.00 -0.02 0.00 0.00 54.58 54.34 2gi0 n ASN 42 Cb 0.44 -0.18 -0.03 0.00 -2.36 0.00 0.00 39.78 37.66 2gi0 n ASN 42 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 2gi0 n VAL 43 N -1.18 0.38 -2.73 3.53 0.31 -0.32 -4.90 118.33 113.43 2gi0 n VAL 43 Ca 0.15 -0.14 -0.05 0.00 -0.01 0.00 0.00 64.34 64.30 2gi0 n VAL 43 Cb 0.16 -0.80 0.07 0.00 -0.91 0.00 0.00 33.84 32.36 2gi0 n VAL 43 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 2gi0 n MET 44 N -2.74 1.38 -2.06 5.55 0.00 -0.34 -5.01 117.12 113.90 2gi0 n MET 44 Ca -0.12 -2.72 -0.39 0.00 -0.00 0.00 0.00 57.70 54.48 2gi0 n MET 44 Cb 0.62 -0.85 0.00 0.00 0.00 0.00 0.00 33.22 32.99 2gi0 n MET 44 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2gi0 s GLY 45 N -2.64 2.89 0.10 -5.12 0.00 -0.59 -4.77 107.32 97.19 2gi0 s GLY 45 Ca 0.23 1.18 0.09 0.00 0.00 0.00 0.00 44.72 46.22 2gi0 s GLY 45 CO -0.04 1.73 -0.22 0.30 0.00 0.00 0.00 173.10 174.87 2gi0 s HIS 46 N -1.33 1.90 0.43 1.90 3.76 -0.14 -4.82 115.29 116.99 2gi0 s HIS 46 Ca 0.60 -0.41 0.04 0.00 -0.15 0.00 0.00 55.06 55.14 2gi0 s HIS 46 Cb -0.36 -1.04 -0.04 0.00 1.11 0.00 0.00 32.58 32.24 2gi0 s HIS 46 CO 0.46 0.23 0.04 0.54 -0.85 0.00 0.00 174.74 175.15 2gi0 s ASN 47 N -1.90 3.45 -0.13 1.40 2.20 -1.26 -0.81 114.94 117.90 2gi0 s ASN 47 Ca 0.08 -1.53 0.01 0.00 -0.94 0.00 0.00 52.86 50.48 2gi0 s ASN 47 Cb -0.10 0.16 0.02 0.00 -2.00 0.00 0.00 41.25 39.33 2gi0 s ASN 47 CO 0.04 -0.72 -0.15 0.86 -2.94 0.00 0.00 177.10 174.20 2gi0 s TRP 48 N -2.98 2.11 -0.04 1.54 -0.00 -1.26 -4.41 118.94 113.90 2gi0 s TRP 48 Ca 0.23 -1.08 0.03 0.00 -0.00 0.00 0.00 56.10 55.28 2gi0 s TRP 48 Cb 0.05 -1.53 0.00 0.00 -0.00 0.00 0.00 33.47 32.00 2gi0 s TRP 48 CO 0.12 -0.57 -0.12 0.08 -0.00 0.00 0.00 176.95 176.45 2gi0 s VAL 49 N 1.19 1.06 -0.08 5.86 1.01 -0.20 -0.73 120.40 128.51 2gi0 s VAL 49 Ca -0.02 -0.50 0.05 0.00 0.00 0.00 0.00 61.98 61.51 2gi0 s VAL 49 Cb -0.14 -0.94 -0.00 0.00 0.00 0.00 0.00 36.38 35.30 2gi0 s VAL 49 CO -0.06 0.32 -0.23 -0.22 0.00 0.00 0.00 175.10 174.91 2gi0 s LEU 50 N 0.23 2.05 0.28 3.92 2.96 -0.26 -1.08 118.68 126.78 2gi0 s LEU 50 Ca -0.05 -0.52 -0.07 0.00 -0.22 0.00 0.00 54.13 53.27 2gi0 s LEU 50 Cb -0.11 -1.34 -0.01 0.00 0.50 0.00 0.00 46.19 45.24 2gi0 s LEU 50 CO 0.02 0.18 0.43 -0.94 -1.32 0.00 0.00 176.35 174.72 2gi0 s SER 51 N 0.17 0.31 0.79 3.68 1.04 -0.95 0.22 113.70 118.97 2gi0 s SER 51 Ca -0.13 -1.21 -0.13 0.00 0.48 0.00 0.00 55.95 54.97 2gi0 s SER 51 Cb -0.16 0.59 0.07 0.00 0.10 0.00 0.00 66.02 66.62 2gi0 s SER 51 CO 0.07 -1.16 1.17 0.42 0.98 0.00 0.00 173.24 174.71 2gi0 s THR 52 N -3.65 2.40 0.25 2.02 -4.23 -1.26 -1.17 115.64 109.99 2gi0 s THR 52 Ca 0.28 0.16 -0.04 0.00 -1.18 0.00 0.00 61.69 60.91 2gi0 s THR 52 Cb 0.01 -2.54 0.25 0.00 1.34 0.00 0.00 72.50 71.55 2gi0 s THR 52 CO 0.14 -0.13 1.88 0.00 -0.54 0.00 0.00 174.62 175.96 2gi0 h ALA 53 N -0.89 1.29 -0.43 3.99 0.00 -1.35 -2.23 119.26 119.64 2gi0 h ALA 53 Ca -0.46 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 2gi0 h ALA 53 Cb 1.28 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2gi0 h ALA 53 CO 0.47 0.42 0.23 0.00 0.00 0.00 0.00 179.25 180.37 2gi0 h ALA 54 N 1.42 1.61 0.00 0.00 0.00 -1.91 -2.85 119.26 117.52 2gi0 h ALA 54 Ca 0.40 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2gi0 h ALA 54 Cb 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2gi0 h ALA 54 CO -0.16 0.33 -0.48 -0.25 0.00 0.00 0.00 179.25 178.70 2gi0 n ASP 55 N -4.42 0.69 -0.08 0.00 8.00 -0.87 -4.43 116.55 115.43 2gi0 n ASP 55 Ca 0.03 0.20 -0.07 0.00 0.71 0.00 0.00 54.79 55.66 2gi0 n ASP 55 Cb 0.10 -0.04 -0.00 0.00 -0.02 0.00 0.00 41.12 41.16 2gi0 n ASP 55 CO 0.00 0.00 0.00 -0.03 -0.39 0.00 0.00 177.20 176.78 2gi0 h MET 56 N 0.00 -0.18 -0.23 -1.24 1.85 -1.23 -1.25 114.93 112.65 2gi0 h MET 56 Ca 0.00 0.01 0.04 0.00 -0.61 0.00 0.00 59.70 59.14 2gi0 h MET 56 Cb 0.72 0.04 -0.04 0.00 0.43 0.00 0.00 31.60 32.75 2gi0 h MET 56 CO 0.00 -0.12 -0.03 0.37 -0.40 0.00 0.00 176.91 176.73 2gi0 h GLN 57 N -0.18 0.03 -0.45 0.39 4.15 -1.78 0.12 115.11 117.39 2gi0 h GLN 57 Ca 0.17 -0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.56 2gi0 h GLN 57 Cb 0.44 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.10 2gi0 h GLN 57 CO -0.43 0.02 0.20 0.78 -1.93 0.00 0.00 178.83 177.46 2gi0 h GLY 58 N 0.04 0.71 0.34 2.39 0.00 -1.77 0.15 103.07 104.93 2gi0 h GLY 58 Ca 0.11 -0.37 0.09 0.00 0.00 0.00 0.00 47.33 47.16 2gi0 h GLY 58 CO -0.21 0.35 0.17 -2.08 0.00 0.00 0.00 176.54 174.77 2gi0 h VAL 59 N 0.58 0.73 -0.04 4.60 2.07 -0.85 -1.37 116.25 121.97 2gi0 h VAL 59 Ca 0.15 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.55 2gi0 h VAL 59 Cb 0.16 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.31 2gi0 h VAL 59 CO -0.02 0.06 -0.00 0.58 0.02 0.00 0.00 177.57 178.21 2gi0 h VAL 60 N 0.32 1.26 -0.32 2.57 2.07 -0.41 0.84 116.25 122.58 2gi0 h VAL 60 Ca 0.29 -0.81 0.07 0.00 0.82 0.00 0.00 66.70 67.07 2gi0 h VAL 60 Cb 0.38 1.72 -0.07 0.00 -1.52 0.00 0.00 31.29 31.80 2gi0 h VAL 60 CO -0.33 0.22 -0.11 0.74 0.02 0.00 0.00 177.57 178.11 2gi0 h THR 61 N -0.23 0.62 0.03 2.57 2.02 -0.53 0.08 112.91 117.46 2gi0 h THR 61 Ca 0.01 0.00 -0.22 0.00 0.77 0.00 0.00 66.41 66.97 2gi0 h THR 61 Cb 0.35 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 2gi0 h THR 61 CO 0.00 0.00 -0.97 0.44 0.37 0.00 0.00 175.52 175.36 2gi0 h ASP 62 N -0.04 0.29 0.01 4.18 3.32 -1.23 -3.12 116.42 119.84 2gi0 h ASP 62 Ca 0.16 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 2gi0 h ASP 62 Cb 0.28 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2gi0 h ASP 62 CO -0.36 1.10 -0.01 1.23 -1.72 0.00 0.00 179.24 179.49 2gi0 h GLY 63 N 1.86 -0.02 2.00 2.75 0.00 -0.56 -2.91 103.07 106.19 2gi0 h GLY 63 Ca -0.06 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2gi0 h GLY 63 CO 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 176.54 176.68 2gi0 h MET 64 N -0.31 0.00 0.00 4.80 -0.00 -1.05 -1.19 114.93 117.18 2gi0 h MET 64 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.69 2gi0 h MET 64 Cb 0.30 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.90 2gi0 h MET 64 CO 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 176.91 176.87 2gi0 h ALA 65 N 2.09 0.99 0.00 -3.00 0.00 -1.46 -3.33 119.26 114.55 2gi0 h ALA 65 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2gi0 h ALA 65 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2gi0 h ALA 65 CO 0.00 0.05 0.00 0.43 0.00 0.00 0.00 179.25 179.73 2gi0 n SER 66 N -3.13 0.67 -0.43 0.00 7.64 -0.45 -5.03 113.62 112.89 2gi0 n SER 66 Ca 0.02 0.57 0.06 0.00 1.01 0.00 0.00 58.87 60.52 2gi0 n SER 66 Cb 0.41 -0.75 -0.02 0.00 -1.01 0.00 0.00 64.21 62.85 2gi0 n SER 66 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gi0 n GLY 67 N 1.23 -2.15 0.27 0.23 0.00 -1.25 -4.23 105.19 99.29 2gi0 n GLY 67 Ca 0.06 -1.38 0.03 0.00 0.00 0.00 0.00 46.02 44.72 2gi0 n GLY 67 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2gi0 h LEU 68 N -0.42 0.44 -0.88 0.99 5.85 -1.94 -1.33 115.31 118.02 2gi0 h LEU 68 Ca -0.03 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2gi0 h LEU 68 Cb 0.41 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.44 2gi0 h LEU 68 CO 0.01 0.23 0.00 0.44 -0.34 0.00 0.00 178.44 178.79 2gi0 h ASP 69 N 0.58 0.00 -0.37 1.25 3.32 -2.02 -1.05 116.42 118.13 2gi0 h ASP 69 Ca 0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.42 2gi0 h ASP 69 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 2gi0 h ASP 69 CO -0.30 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.51 2gi0 n LYS 70 N -2.32 3.62 -2.05 3.56 5.02 -0.72 -4.95 118.16 120.33 2gi0 n LYS 70 Ca 0.01 -2.96 -0.16 0.00 -2.02 0.00 0.00 58.31 53.19 2gi0 n LYS 70 Cb 0.21 -2.00 -0.03 0.00 -0.02 0.00 0.00 35.03 33.19 2gi0 n LYS 70 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2gi0 n ASP 71 N -0.12 -4.44 -3.63 4.39 9.92 -0.40 -1.90 116.55 120.37 2gi0 n ASP 71 Ca 0.24 0.22 -0.27 0.00 -0.53 0.00 0.00 54.79 54.45 2gi0 n ASP 71 Cb 1.00 -3.85 0.04 0.00 -0.64 0.00 0.00 41.12 37.67 2gi0 n ASP 71 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2gi0 n TYR 72 N -3.00 -2.34 -4.49 1.24 4.01 -0.58 -4.75 117.16 107.24 2gi0 n TYR 72 Ca -0.17 0.82 -0.20 0.00 -0.16 0.00 0.00 57.90 58.19 2gi0 n TYR 72 Cb 0.59 -4.21 -0.15 0.00 -0.31 0.00 0.00 39.34 35.27 2gi0 n TYR 72 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2gi0 s LEU 73 N -7.11 2.04 0.01 7.72 1.43 -0.80 -3.88 118.68 118.09 2gi0 s LEU 73 Ca 0.56 -0.24 -0.30 0.00 -1.03 0.00 0.00 54.13 53.12 2gi0 s LEU 73 Cb -0.27 -0.59 -0.07 0.00 0.03 0.00 0.00 46.19 45.28 2gi0 s LEU 73 CO 0.69 0.13 1.74 -0.75 0.23 0.00 0.00 176.35 178.39 2gi0 s LYS 74 N -0.39 4.17 0.18 1.70 2.20 -1.26 -4.84 119.74 121.50 2gi0 s LYS 74 Ca 0.04 2.35 -0.33 0.00 -0.36 0.00 0.00 55.97 57.66 2gi0 s LYS 74 Cb -0.05 -3.91 -0.14 0.00 -1.51 0.00 0.00 37.83 32.21 2gi0 s LYS 74 CO -0.00 -0.84 1.46 -2.30 -0.36 0.00 0.00 175.35 173.31 2gi0 n PRO 75 N 6.77 1.91 -1.60 4.03 -0.02 -1.26 -2.24 135.00 142.59 2gi0 n PRO 75 Ca 0.18 0.69 -0.10 0.00 -2.02 0.00 0.00 63.50 62.24 2gi0 n PRO 75 Cb 0.42 -2.38 -0.03 0.00 -0.02 0.00 0.00 33.50 31.48 2gi0 n PRO 75 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2gi0 n ASP 76 N 2.80 -4.00 -4.59 2.55 8.00 -1.26 -4.92 116.55 115.13 2gi0 n ASP 76 Ca 0.15 0.17 -0.42 0.00 0.71 0.00 0.00 54.79 55.41 2gi0 n ASP 76 Cb 0.28 -2.70 -0.03 0.00 -0.02 0.00 0.00 41.12 38.65 2gi0 n ASP 76 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2gi0 s ASP 77 N -2.77 5.68 0.30 -2.24 -1.08 -0.95 -4.84 116.67 110.77 2gi0 s ASP 77 Ca 0.00 1.13 0.24 0.00 -0.52 0.00 0.00 52.55 53.41 2gi0 s ASP 77 Cb 0.00 -2.52 1.06 0.00 -1.46 0.00 0.00 42.92 40.00 2gi0 s ASP 77 CO 0.00 -1.90 1.73 0.77 0.52 0.00 0.00 175.17 176.29 2gi0 h SER 78 N 13.69 0.00 1.25 -0.34 4.64 -1.91 -2.13 113.55 128.75 2gi0 h SER 78 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2gi0 h SER 78 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2gi0 h SER 78 CO 1.07 0.00 0.00 0.03 -0.87 0.00 0.00 176.83 177.06 2gi0 h ARG 79 N 0.00 0.00 -5.70 4.77 3.08 -1.97 -3.42 114.38 111.14 2gi0 h ARG 79 Ca 0.00 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.42 2gi0 h ARG 79 Cb 0.30 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.22 2gi0 h ARG 79 CO 0.00 0.00 0.35 0.08 -1.07 0.00 0.00 179.97 179.33 2gi0 s VAL 80 N -3.23 4.63 0.18 2.04 1.01 -0.80 -4.48 120.40 119.74 2gi0 s VAL 80 Ca 0.07 0.29 -0.09 0.00 0.00 0.00 0.00 61.98 62.25 2gi0 s VAL 80 Cb 0.10 -4.36 0.06 0.00 0.00 0.00 0.00 36.38 32.19 2gi0 s VAL 80 CO 0.53 -0.80 1.64 0.40 0.00 0.00 0.00 175.10 176.87 2gi0 h ILE 81 N 5.97 1.27 -2.47 2.22 2.04 -0.49 -3.46 117.51 122.58 2gi0 h ILE 81 Ca -0.25 -1.17 -0.02 0.00 1.00 0.00 0.00 64.86 64.42 2gi0 h ILE 81 Cb 1.08 0.81 -0.16 0.00 -0.74 0.00 0.00 36.82 37.82 2gi0 h ILE 81 CO 0.98 0.42 0.24 0.00 0.00 0.00 0.00 178.15 179.80 2gi0 s ALA 82 N -5.01 -1.70 -0.02 1.87 0.00 -1.20 -5.00 121.76 110.69 2gi0 s ALA 82 Ca -0.12 0.92 -0.28 0.00 0.00 0.00 0.00 51.96 52.49 2gi0 s ALA 82 Cb 0.13 0.41 0.06 0.00 0.00 0.00 0.00 23.12 23.73 2gi0 s ALA 82 CO 0.86 -0.58 0.62 -3.38 0.00 0.00 0.00 175.76 173.28 2gi0 s HIS 83 N -2.54 -0.57 0.90 0.00 -3.43 -1.26 -1.10 115.29 107.29 2gi0 s HIS 83 Ca -0.04 0.91 -0.13 0.00 -0.80 0.00 0.00 55.06 55.00 2gi0 s HIS 83 Cb -0.01 0.38 0.17 0.00 -1.43 0.00 0.00 32.58 31.69 2gi0 s HIS 83 CO -0.03 -0.60 1.25 0.95 -2.00 0.00 0.00 174.74 174.31 2gi0 s THR 84 N -1.50 2.03 0.89 -5.38 -4.23 0.09 -4.82 115.64 102.71 2gi0 s THR 84 Ca -0.10 -0.09 -0.12 0.00 -1.18 0.00 0.00 61.69 60.20 2gi0 s THR 84 Cb -0.01 -2.94 0.12 0.00 1.34 0.00 0.00 72.50 71.01 2gi0 s THR 84 CO 0.07 0.00 1.13 -1.59 -0.54 0.00 0.00 174.62 173.68 2gi0 s LYS 85 N -5.73 1.34 0.07 3.99 -2.85 -1.26 -4.61 119.74 110.69 2gi0 s LYS 85 Ca 0.71 0.39 -0.30 0.00 -1.00 0.00 0.00 55.97 55.77 2gi0 s LYS 85 Cb -0.05 -1.85 -0.05 0.00 -2.06 0.00 0.00 37.83 33.81 2gi0 s LYS 85 CO 0.51 -2.08 1.08 -1.17 0.10 0.00 0.00 175.35 173.78 2gi0 s LEU 86 N -5.99 4.41 0.03 2.77 2.96 -1.26 -4.47 118.68 117.12 2gi0 s LEU 86 Ca 0.63 1.88 0.07 0.00 -0.22 0.00 0.00 54.13 56.50 2gi0 s LEU 86 Cb -0.15 -3.58 -0.02 0.00 0.50 0.00 0.00 46.19 42.94 2gi0 s LEU 86 CO 0.54 -0.30 -0.21 0.27 -1.32 0.00 0.00 176.35 175.33 2gi0 s ILE 87 N 0.64 1.66 0.69 6.68 -4.36 0.01 -4.90 121.20 121.62 2gi0 s ILE 87 Ca 0.53 -1.10 0.03 0.00 -0.26 0.00 0.00 60.65 59.85 2gi0 s ILE 87 Cb -0.26 -1.42 0.13 0.00 1.25 0.00 0.00 42.46 42.16 2gi0 s ILE 87 CO 0.30 0.29 0.95 -0.83 0.24 0.00 0.00 174.94 175.89 2gi0 s GLY 88 N -0.96 1.73 0.35 6.27 0.00 -1.26 -0.97 107.32 112.48 2gi0 s GLY 88 Ca 0.08 -1.97 -0.28 0.00 0.00 0.00 0.00 44.72 42.55 2gi0 s GLY 88 CO 0.01 -1.39 1.30 -1.14 0.00 0.00 0.00 173.10 171.88 2gi0 n SER 89 N -2.69 2.81 0.00 1.64 3.41 -0.66 -1.64 113.62 116.49 2gi0 n SER 89 Ca 0.17 1.20 0.00 0.00 -0.26 0.00 0.00 58.87 59.98 2gi0 n SER 89 Cb 0.61 -1.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.07 2gi0 n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gi0 n GLY 90 N 0.75 2.97 3.91 5.00 0.00 -0.20 -4.95 105.19 112.68 2gi0 n GLY 90 Ca 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 2gi0 n GLY 90 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2gi0 s GLU 91 N -0.01 3.50 0.05 1.61 2.12 -0.65 -4.93 118.70 120.38 2gi0 s GLU 91 Ca 0.00 0.16 0.03 0.00 0.36 0.00 0.00 54.97 55.51 2gi0 s GLU 91 Cb 0.00 -2.39 -0.02 0.00 0.26 0.00 0.00 34.13 31.98 2gi0 s GLU 91 CO 0.00 -0.21 -0.09 0.15 -0.54 0.00 0.00 175.26 174.57 2gi0 s LYS 92 N -4.73 0.57 -0.23 4.30 1.02 -1.26 -3.48 119.74 115.92 2gi0 s LYS 92 Ca 0.47 -0.77 -0.23 0.00 0.02 0.00 0.00 55.97 55.46 2gi0 s LYS 92 Cb -0.10 -0.37 0.06 0.00 -0.52 0.00 0.00 37.83 36.90 2gi0 s LYS 92 CO 0.44 0.07 0.65 0.34 -0.92 0.00 0.00 175.35 175.93 2gi0 s ASP 93 N -1.57 -0.67 0.09 2.83 2.15 -0.50 -5.02 116.67 113.98 2gi0 s ASP 93 Ca -0.09 1.25 0.10 0.00 0.43 0.00 0.00 52.55 54.24 2gi0 s ASP 93 Cb -0.10 1.26 -0.03 0.00 -0.30 0.00 0.00 42.92 43.75 2gi0 s ASP 93 CO 0.01 -0.25 -0.26 -0.44 -0.17 0.00 0.00 175.17 174.06 2gi0 s SER 94 N 0.22 3.11 0.00 -0.34 0.01 -1.26 -0.08 113.70 115.37 2gi0 s SER 94 Ca -0.01 -0.66 0.05 0.00 1.31 0.00 0.00 55.95 56.64 2gi0 s SER 94 Cb -0.04 -0.24 -0.01 0.00 0.21 0.00 0.00 66.02 65.94 2gi0 s SER 94 CO 0.02 0.20 -0.15 0.54 0.41 0.00 0.00 173.24 174.25 2gi0 s VAL 95 N -0.94 1.21 -0.04 3.43 0.11 -0.40 -4.91 120.40 118.84 2gi0 s VAL 95 Ca 0.12 -0.76 0.05 0.00 -2.93 0.00 0.00 61.98 58.46 2gi0 s VAL 95 Cb -0.10 -1.03 -0.02 0.00 -1.53 0.00 0.00 36.38 33.70 2gi0 s VAL 95 CO 0.04 0.26 -0.19 -0.89 -3.33 0.00 0.00 175.10 170.98 2gi0 s THR 96 N -0.49 2.60 0.09 5.04 2.01 -1.26 -0.58 115.64 123.04 2gi0 s THR 96 Ca 0.05 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.16 2gi0 s THR 96 Cb -0.06 -1.98 -0.04 0.00 0.01 0.00 0.00 72.50 70.43 2gi0 s THR 96 CO -0.00 0.58 -0.04 0.72 -0.69 0.00 0.00 174.62 175.19 2gi0 s PHE 97 N -0.56 0.77 -0.30 4.92 -0.71 -0.12 -4.96 117.98 117.02 2gi0 s PHE 97 Ca 0.08 -0.99 -0.27 0.00 -1.04 0.00 0.00 56.93 54.70 2gi0 s PHE 97 Cb -0.11 -0.48 0.01 0.00 -1.21 0.00 0.00 43.02 41.23 2gi0 s PHE 97 CO 0.01 -0.26 0.98 0.34 -1.34 0.00 0.00 175.22 174.95 2gi0 s ASP 98 N -3.01 6.87 0.60 1.98 -1.08 -1.26 -1.09 116.67 119.69 2gi0 s ASP 98 Ca 0.11 0.98 0.38 0.00 -0.52 0.00 0.00 52.55 53.51 2gi0 s ASP 98 Cb 0.06 -2.50 1.84 0.00 -1.46 0.00 0.00 42.92 40.86 2gi0 s ASP 98 CO -0.06 -0.77 2.16 0.58 0.52 0.00 0.00 175.17 177.60 2gi0 h VAL 99 N 5.65 0.02 0.00 1.11 2.07 -1.55 0.29 116.25 123.84 2gi0 h VAL 99 Ca -0.21 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.01 2gi0 h VAL 99 Cb 1.07 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.13 2gi0 h VAL 99 CO 0.98 0.00 0.00 -1.54 0.02 0.00 0.00 177.57 177.03 2gi0 n SER 100 N -3.10 0.01 0.00 0.57 3.41 -1.26 -1.88 113.62 111.37 2gi0 n SER 100 Ca -0.01 0.50 0.08 0.00 -0.26 0.00 0.00 58.87 59.18 2gi0 n SER 100 Cb 0.20 -0.51 0.40 0.00 -0.26 0.00 0.00 64.21 64.05 2gi0 n SER 100 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2gi0 n LYS 101 N -1.51 0.20 -5.25 4.33 5.02 0.10 -4.78 118.16 116.28 2gi0 n LYS 101 Ca 0.02 0.14 -0.30 0.00 -2.02 0.00 0.00 58.31 56.15 2gi0 n LYS 101 Cb 0.11 -1.50 -0.16 0.00 -0.02 0.00 0.00 35.03 33.46 2gi0 n LYS 101 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2gi0 s LEU 102 N -2.63 2.05 -0.21 -0.35 1.43 -0.78 -5.11 118.68 113.06 2gi0 s LEU 102 Ca 0.14 -0.46 -0.05 0.00 -1.03 0.00 0.00 54.13 52.73 2gi0 s LEU 102 Cb 0.11 -1.29 -0.02 0.00 0.03 0.00 0.00 46.19 45.02 2gi0 s LEU 102 CO 0.26 0.30 0.01 -0.54 0.23 0.00 0.00 176.35 176.60 2gi0 s LYS 103 N -0.52 3.58 0.23 1.70 1.02 -1.26 -5.03 119.74 119.46 2gi0 s LYS 103 Ca 0.08 -0.53 -0.30 0.00 0.02 0.00 0.00 55.97 55.23 2gi0 s LYS 103 Cb -0.10 -3.12 -0.15 0.00 -0.52 0.00 0.00 37.83 33.94 2gi0 s LYS 103 CO -0.00 -0.07 1.02 0.39 -0.92 0.00 0.00 175.35 175.76 2gi0 n GLU 104 N 4.49 1.11 0.00 1.68 4.71 -1.26 -1.69 120.64 129.68 2gi0 n GLU 104 Ca -0.17 0.39 0.00 0.00 -0.01 0.00 0.00 57.16 57.37 2gi0 n GLU 104 Cb 0.51 -1.77 0.00 0.00 -1.01 0.00 0.00 31.44 29.17 2gi0 n GLU 104 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2gi0 n GLY 105 N 1.63 2.76 3.84 0.62 0.00 -1.26 -5.03 105.19 107.75 2gi0 n GLY 105 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 2gi0 n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2gi0 s GLU 106 N -0.55 4.03 -0.23 1.61 2.56 -0.68 -5.05 118.70 120.38 2gi0 s GLU 106 Ca 0.00 0.74 -0.12 0.00 0.00 0.00 0.00 54.97 55.59 2gi0 s GLU 106 Cb 0.00 -2.39 -0.05 0.00 2.00 0.00 0.00 34.13 33.70 2gi0 s GLU 106 CO 0.00 0.12 0.23 -0.65 -0.56 0.00 0.00 175.26 174.40 2gi0 s GLN 107 N -3.04 4.09 0.07 4.30 -0.21 -1.26 -4.90 119.66 118.70 2gi0 s GLN 107 Ca 0.55 -0.14 0.08 0.00 0.02 0.00 0.00 55.36 55.88 2gi0 s GLN 107 Cb -0.10 -3.55 -0.03 0.00 1.00 0.00 0.00 33.01 30.32 2gi0 s GLN 107 CO 0.17 0.00 -0.19 0.71 -2.12 0.00 0.00 175.29 173.86 2gi0 s TYR 108 N 1.22 2.53 -0.01 0.91 2.02 -1.24 -0.99 117.35 121.79 2gi0 s TYR 108 Ca 0.11 -0.27 0.04 0.00 -0.37 0.00 0.00 57.07 56.58 2gi0 s TYR 108 Cb -0.14 -1.41 -0.01 0.00 -0.40 0.00 0.00 41.96 39.99 2gi0 s TYR 108 CO 0.06 0.29 -0.14 -1.64 -1.57 0.00 0.00 175.55 172.55 2gi0 s MET 109 N -1.67 1.18 0.20 -0.62 -1.94 -0.32 -1.36 119.30 114.78 2gi0 s MET 109 Ca 0.15 -0.51 0.08 0.00 -1.71 0.00 0.00 55.69 53.70 2gi0 s MET 109 Cb -0.10 -1.14 -0.04 0.00 2.01 0.00 0.00 34.83 35.56 2gi0 s MET 109 CO 0.07 0.31 0.00 -0.59 -0.01 0.00 0.00 175.02 174.79 2gi0 s PHE 110 N -0.32 2.81 0.07 -0.03 -0.12 0.25 -2.23 117.98 118.41 2gi0 s PHE 110 Ca 0.05 -0.16 -0.28 0.00 -0.05 0.00 0.00 56.93 56.50 2gi0 s PHE 110 Cb -0.06 -1.34 0.09 0.00 -0.63 0.00 0.00 43.02 41.09 2gi0 s PHE 110 CO -0.00 0.54 1.14 -0.59 -0.05 0.00 0.00 175.22 176.25 2gi0 s PHE 111 N -1.86 -0.07 -0.16 3.49 -0.71 -0.24 -0.70 117.98 117.72 2gi0 s PHE 111 Ca 0.28 -0.13 0.01 0.00 -1.04 0.00 0.00 56.93 56.05 2gi0 s PHE 111 Cb -0.09 0.59 0.02 0.00 -1.21 0.00 0.00 43.02 42.34 2gi0 s PHE 111 CO 0.19 -0.54 -0.17 0.00 -1.34 0.00 0.00 175.22 173.35 2gi0 n THR 113 N 4.67 0.00 -1.32 0.00 -2.24 -1.26 -2.44 114.28 111.70 2gi0 n THR 113 Ca -0.19 -0.07 -0.35 0.00 -2.27 0.00 0.00 64.05 61.17 2gi0 n THR 113 Cb 0.50 0.33 0.09 0.00 -2.10 0.00 0.00 70.33 69.15 2gi0 n THR 113 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2gi0 n PRO 114 N -1.04 0.46 -1.64 -0.78 -0.02 -1.26 -3.78 135.00 126.94 2gi0 n PRO 114 Ca 0.09 0.22 -0.54 0.00 -2.02 0.00 0.00 63.50 61.24 2gi0 n PRO 114 Cb 0.34 -2.26 -0.07 0.00 -0.02 0.00 0.00 33.50 31.49 2gi0 n PRO 114 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2gi0 n PRO 115 N -2.10 1.13 -0.58 0.52 -0.02 -1.26 -1.03 135.00 131.67 2gi0 n PRO 115 Ca 0.13 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2gi0 n PRO 115 Cb 0.50 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 2gi0 n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gi0 n GLY 116 N 3.22 1.17 0.11 -1.23 0.00 -1.26 -4.90 105.19 102.31 2gi0 n GLY 116 Ca 0.22 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.10 2gi0 n GLY 116 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2gi0 n HIS 117 N -2.00 0.00 0.08 1.61 8.25 -0.20 -4.62 115.22 118.34 2gi0 n HIS 117 Ca 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.47 2gi0 n HIS 117 Cb 0.00 -0.98 0.35 0.00 1.12 0.00 0.00 29.99 30.47 2gi0 n HIS 117 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2gi0 h SER 118 N 0.00 0.30 0.02 0.41 4.64 -1.62 0.99 113.55 118.28 2gi0 h SER 118 Ca -0.56 -0.07 -0.06 0.00 -0.47 0.00 0.00 61.79 60.63 2gi0 h SER 118 Cb 2.05 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 64.04 2gi0 h SER 118 CO -0.03 0.46 -0.17 0.00 -0.87 0.00 0.00 176.83 176.22 2gi0 h ALA 119 N 1.57 1.39 0.00 5.18 0.00 -1.88 -3.23 119.26 122.29 2gi0 h ALA 119 Ca 0.06 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 2gi0 h ALA 119 Cb 0.41 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2gi0 h ALA 119 CO 0.02 0.42 -2.12 1.28 0.00 0.00 0.00 179.25 178.85 2gi0 n LEU 120 N -4.22 0.00 -3.89 0.00 4.77 -0.97 -4.68 117.00 108.00 2gi0 n LEU 120 Ca -0.00 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.64 2gi0 n LEU 120 Cb 0.31 0.19 -0.07 0.00 -2.33 0.00 0.00 43.42 41.53 2gi0 n LEU 120 CO 0.39 0.19 0.33 0.23 -1.33 0.00 0.00 177.39 177.20 2gi0 n MET 121 N -2.43 2.74 -3.83 3.23 2.81 0.30 -4.67 117.12 115.27 2gi0 n MET 121 Ca -0.15 -4.54 -0.09 0.00 -1.81 0.00 0.00 57.70 51.10 2gi0 n MET 121 Cb 0.79 -2.37 -0.06 0.00 -0.71 0.00 0.00 33.22 30.87 2gi0 n MET 121 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 2gi0 s LYS 122 N -1.87 1.03 0.24 0.03 -2.85 -1.26 -1.62 119.74 113.44 2gi0 s LYS 122 Ca 0.31 -0.95 -0.21 0.00 -1.00 0.00 0.00 55.97 54.12 2gi0 s LYS 122 Cb 0.00 0.40 0.06 0.00 -2.06 0.00 0.00 37.83 36.23 2gi0 s LYS 122 CO -0.07 -0.37 0.93 0.20 0.10 0.00 0.00 175.35 176.14 2gi0 s GLY 123 N -2.88 0.11 0.11 0.59 0.00 0.12 -4.68 107.32 100.68 2gi0 s GLY 123 Ca 0.08 -0.37 -0.10 0.00 0.00 0.00 0.00 44.72 44.34 2gi0 s GLY 123 CO -0.08 1.01 0.43 -0.51 0.00 0.00 0.00 173.10 173.95 2gi0 s THR 124 N -2.54 5.06 -0.13 0.90 -4.23 -0.77 -0.58 115.64 113.35 2gi0 s THR 124 Ca 0.17 0.47 0.02 0.00 -1.18 0.00 0.00 61.69 61.17 2gi0 s THR 124 Cb -0.03 -3.65 -0.00 0.00 1.34 0.00 0.00 72.50 70.15 2gi0 s THR 124 CO 0.07 0.23 -0.19 -0.22 -0.54 0.00 0.00 174.62 173.97 2gi0 s LEU 125 N -2.05 2.35 -0.04 4.79 0.20 -0.46 -0.88 118.68 122.58 2gi0 s LEU 125 Ca 0.35 -0.49 0.02 0.00 0.69 0.00 0.00 54.13 54.71 2gi0 s LEU 125 Cb -0.14 -1.51 0.01 0.00 -0.43 0.00 0.00 46.19 44.13 2gi0 s LEU 125 CO 0.19 0.13 -0.08 -0.89 -0.29 0.00 0.00 176.35 175.41 2gi0 s THR 126 N 0.56 0.77 0.19 3.68 2.01 -0.42 -3.64 115.64 118.79 2gi0 s THR 126 Ca -0.11 -0.30 -0.30 0.00 0.31 0.00 0.00 61.69 61.29 2gi0 s THR 126 Cb -0.16 -0.72 -0.08 0.00 0.01 0.00 0.00 72.50 71.55 2gi0 s THR 126 CO 0.04 0.26 1.12 -0.76 -0.69 0.00 0.00 174.62 174.59 2gi0 s LEU 127 N 0.56 4.49 0.00 4.42 1.43 -1.26 -0.42 118.68 127.89 2gi0 s LEU 127 Ca -0.09 2.14 0.00 0.00 -1.03 0.00 0.00 54.13 55.15 2gi0 s LEU 127 Cb -0.12 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.49 2gi0 s LEU 127 CO 0.01 -0.24 0.21 1.17 0.23 0.00 0.00 176.35 177.73