#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 0.48 -0.94 0.00 4.57 -2.03 -2.79 114.58 113.87 2gi0 h GLU 2 Ca 0.00 -0.03 -0.55 0.00 -1.18 0.00 0.00 59.36 57.60 2gi0 h GLU 2 Cb 0.00 -0.11 -0.29 0.00 -0.16 0.00 0.00 28.75 28.19 2gi0 h GLU 2 CO 0.00 0.33 0.64 0.00 -1.18 0.00 0.00 179.01 178.80 2gi0 s SER 4 N -1.64 0.29 -0.04 0.00 1.04 -1.05 -1.33 113.70 110.96 2gi0 s SER 4 Ca 0.59 -1.00 -0.11 0.00 0.48 0.00 0.00 55.95 55.90 2gi0 s SER 4 Cb 0.48 0.30 0.02 0.00 0.10 0.00 0.00 66.02 66.92 2gi0 s SER 4 CO 0.06 -0.72 0.26 0.54 0.98 0.00 0.00 173.24 174.35 2gi0 s VAL 5 N -3.97 0.04 -0.15 5.02 0.11 -0.10 -4.71 120.40 116.64 2gi0 s VAL 5 Ca 0.15 -0.34 -0.07 0.00 -2.93 0.00 0.00 61.98 58.79 2gi0 s VAL 5 Cb 0.06 -0.48 -0.04 0.00 -1.53 0.00 0.00 36.38 34.39 2gi0 s VAL 5 CO -0.04 -0.19 0.09 -1.81 -3.33 0.00 0.00 175.10 169.82 2gi0 s ASP 6 N -0.77 5.95 -0.01 3.54 1.01 -1.26 -0.63 116.67 124.49 2gi0 s ASP 6 Ca -0.09 0.26 0.03 0.00 0.71 0.00 0.00 52.55 53.47 2gi0 s ASP 6 Cb -0.05 -1.94 -0.01 0.00 1.01 0.00 0.00 42.92 41.93 2gi0 s ASP 6 CO 0.02 0.29 -0.11 -0.63 0.21 0.00 0.00 175.17 174.95 2gi0 s ILE 7 N -0.34 0.88 -0.01 0.77 -1.09 -0.01 -4.94 121.20 116.47 2gi0 s ILE 7 Ca 0.10 -0.47 0.07 0.00 -2.23 0.00 0.00 60.65 58.12 2gi0 s ILE 7 Cb -0.12 -0.74 -0.03 0.00 -1.58 0.00 0.00 42.46 40.00 2gi0 s ILE 7 CO 0.01 0.25 -0.22 -1.10 -1.23 0.00 0.00 174.94 172.66 2gi0 s GLN 8 N -0.22 2.15 -0.14 2.79 -0.21 -1.26 -1.69 119.66 121.08 2gi0 s GLN 8 Ca 0.03 -0.91 0.02 0.00 0.02 0.00 0.00 55.36 54.52 2gi0 s GLN 8 Cb -0.05 -2.14 0.01 0.00 1.00 0.00 0.00 33.01 31.82 2gi0 s GLN 8 CO -0.00 0.57 -0.20 0.20 -2.12 0.00 0.00 175.29 173.73 2gi0 s GLY 9 N -0.90 1.40 0.43 3.09 0.00 -0.40 -1.78 107.32 109.15 2gi0 s GLY 9 Ca 0.12 -1.07 0.05 0.00 0.00 0.00 0.00 44.72 43.82 2gi0 s GLY 9 CO 0.01 -0.02 0.45 1.16 0.00 0.00 0.00 173.10 174.70 2gi0 n ASN 10 N 4.05 1.99 0.11 1.64 0.23 -0.87 -3.60 115.26 118.81 2gi0 n ASN 10 Ca -0.20 -2.31 0.11 0.00 -0.53 0.00 0.00 54.58 51.66 2gi0 n ASN 10 Cb 0.52 -0.17 0.47 0.00 -2.08 0.00 0.00 39.78 38.52 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 -2.16 0.56 -1.55 0.53 8.00 -1.24 -2.66 116.55 118.03 2gi0 n ASP 11 Ca 0.05 0.65 0.08 0.00 0.71 0.00 0.00 54.79 56.28 2gi0 n ASP 11 Cb 0.46 -0.76 0.34 0.00 -0.02 0.00 0.00 41.12 41.13 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 -2.13 3.76 -3.29 -1.24 3.00 -1.26 -4.94 117.38 111.28 2gi0 n GLN 12 Ca 0.02 -2.64 -0.17 0.00 -0.01 0.00 0.00 57.00 54.20 2gi0 n GLN 12 Cb 0.19 -1.94 0.07 0.00 0.00 0.00 0.00 30.24 28.56 2gi0 n GLN 12 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 2gi0 n MET 13 N 0.88 -6.02 -4.98 -1.09 2.81 -1.09 -5.02 117.12 102.61 2gi0 n MET 13 Ca 0.24 0.70 -0.29 0.00 -1.81 0.00 0.00 57.70 56.53 2gi0 n MET 13 Cb 0.90 -5.30 -0.17 0.00 -0.71 0.00 0.00 33.22 27.94 2gi0 n MET 13 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2gi0 s GLN 14 N -5.57 2.48 0.37 0.03 -0.21 -1.26 -4.50 119.66 111.00 2gi0 s GLN 14 Ca 0.22 -0.70 -0.16 0.00 0.02 0.00 0.00 55.36 54.74 2gi0 s GLN 14 Cb -0.10 -1.93 -0.09 0.00 1.00 0.00 0.00 33.01 31.88 2gi0 s GLN 14 CO 0.61 0.14 0.82 -0.06 -2.12 0.00 0.00 175.29 174.67 2gi0 s PHE 15 N 0.40 3.37 -2.05 0.91 0.08 -1.26 -2.05 117.98 117.38 2gi0 s PHE 15 Ca -0.16 1.33 0.11 0.00 0.12 0.00 0.00 56.93 58.33 2gi0 s PHE 15 Cb -0.17 -2.63 0.43 0.00 -0.57 0.00 0.00 43.02 40.08 2gi0 s PHE 15 CO 0.06 -0.02 1.31 0.27 -0.10 0.00 0.00 175.22 176.75 2gi0 n ASN 16 N -0.62 1.05 -3.76 1.36 6.94 -0.74 -4.78 115.26 114.71 2gi0 n ASN 16 Ca 0.05 -1.86 -0.12 0.00 -0.02 0.00 0.00 54.58 52.63 2gi0 n ASN 16 Cb 0.54 -0.11 -0.08 0.00 -2.36 0.00 0.00 39.78 37.77 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 -1.78 0.07 -0.15 5.53 -1.32 -1.26 -5.00 115.64 111.74 2gi0 s THR 17 Ca 0.19 -0.62 0.08 0.00 -1.21 0.00 0.00 61.69 60.13 2gi0 s THR 17 Cb 0.10 -0.84 0.15 0.00 -1.51 0.00 0.00 72.50 70.40 2gi0 s THR 17 CO 0.14 -0.34 1.10 -0.46 -2.21 0.00 0.00 174.62 172.85 2gi0 n ASN 18 N 0.79 2.32 -3.66 8.08 2.04 -1.26 -4.84 115.26 118.73 2gi0 n ASN 18 Ca -0.19 -2.38 -0.07 0.00 -0.44 0.00 0.00 54.58 51.50 2gi0 n ASN 18 Cb 0.58 -0.18 -0.08 0.00 -2.53 0.00 0.00 39.78 37.57 2gi0 n ASN 18 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2gi0 s ALA 19 N -1.65 -1.42 -0.12 -2.53 0.00 -1.26 -1.49 121.76 113.29 2gi0 s ALA 19 Ca 0.14 1.78 0.00 0.00 0.00 0.00 0.00 51.96 53.89 2gi0 s ALA 19 Cb 0.11 -1.41 -0.02 0.00 0.00 0.00 0.00 23.12 21.81 2gi0 s ALA 19 CO 0.03 -0.73 -0.13 0.42 0.00 0.00 0.00 175.76 175.35 2gi0 s ILE 20 N 2.50 3.03 -0.16 0.00 1.01 0.34 -4.96 121.20 122.97 2gi0 s ILE 20 Ca -0.04 -0.68 -0.04 0.00 0.00 0.00 0.00 60.65 59.89 2gi0 s ILE 20 Cb -0.11 -2.26 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 2gi0 s ILE 20 CO -0.15 0.53 -0.02 -0.89 0.00 0.00 0.00 174.94 174.41 2gi0 s THR 21 N 0.22 4.06 -0.15 2.92 2.01 -1.26 -1.34 115.64 122.10 2gi0 s THR 21 Ca -0.09 -0.30 0.01 0.00 0.31 0.00 0.00 61.69 61.62 2gi0 s THR 21 Cb -0.15 -2.78 0.00 0.00 0.01 0.00 0.00 72.50 69.58 2gi0 s THR 21 CO 0.05 0.49 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.61 2gi0 s VAL 22 N 0.29 2.47 0.07 3.82 1.01 0.30 -4.96 120.40 123.41 2gi0 s VAL 22 Ca -0.02 -0.84 -0.31 0.00 0.00 0.00 0.00 61.98 60.82 2gi0 s VAL 22 Cb -0.14 -2.03 -0.09 0.00 0.00 0.00 0.00 36.38 34.12 2gi0 s VAL 22 CO 0.02 0.52 1.83 -0.62 0.00 0.00 0.00 175.10 176.86 2gi0 s ASP 23 N 0.84 6.48 0.21 3.32 -1.08 -1.26 -1.02 116.67 124.16 2gi0 s ASP 23 Ca -0.05 2.65 0.19 0.00 -0.52 0.00 0.00 52.55 54.82 2gi0 s ASP 23 Cb -0.15 -2.55 0.89 0.00 -1.46 0.00 0.00 42.92 39.64 2gi0 s ASP 23 CO -0.01 -1.00 1.59 2.29 0.52 0.00 0.00 175.17 178.56 2gi0 n LYS 24 N 6.37 0.13 0.02 4.34 2.85 0.66 -1.40 118.16 131.13 2gi0 n LYS 24 Ca 0.18 0.47 0.12 0.00 -1.05 0.00 0.00 58.31 58.04 2gi0 n LYS 24 Cb 0.40 -1.81 0.31 0.00 -0.65 0.00 0.00 35.03 33.28 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 -2.07 0.45 -4.74 -5.58 3.41 -1.26 -4.91 113.62 98.93 2gi0 n SER 25 Ca 0.01 0.02 -0.42 0.00 -0.26 0.00 0.00 58.87 58.22 2gi0 n SER 25 Cb 0.14 0.04 -0.02 0.00 -0.26 0.00 0.00 64.21 64.11 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 5.34 0.65 -4.97 0.00 6.56 -1.90 -3.41 116.57 118.83 2gi0 h LYS 27 Ca -0.46 -0.59 -0.33 0.00 -1.06 0.00 0.00 60.65 58.22 2gi0 h LYS 27 Cb 1.22 0.14 -0.15 0.00 -0.57 0.00 0.00 32.23 32.87 2gi0 h LYS 27 CO 0.83 1.20 -0.68 -0.65 -2.06 0.00 0.00 179.45 178.09 2gi0 s GLN 28 N -3.56 1.16 0.00 3.15 -0.21 -1.26 -1.61 119.66 117.33 2gi0 s GLN 28 Ca -0.09 -1.54 0.00 0.00 0.02 0.00 0.00 55.36 53.75 2gi0 s GLN 28 Cb 0.09 -0.49 -0.01 0.00 1.00 0.00 0.00 33.01 33.60 2gi0 s GLN 28 CO 0.89 -0.05 -0.02 0.12 -2.12 0.00 0.00 175.29 174.11 2gi0 s PHE 29 N -3.47 0.17 -0.05 0.91 5.36 0.04 -4.81 117.98 116.13 2gi0 s PHE 29 Ca 0.22 -0.13 0.05 0.00 -0.96 0.00 0.00 56.93 56.12 2gi0 s PHE 29 Cb 0.05 -0.11 -0.01 0.00 -0.34 0.00 0.00 43.02 42.61 2gi0 s PHE 29 CO 0.04 -0.04 -0.21 0.99 -1.46 0.00 0.00 175.22 174.55 2gi0 s THR 30 N -0.33 1.70 -0.16 0.12 2.01 -0.44 -1.30 115.64 117.24 2gi0 s THR 30 Ca -0.03 -0.87 -0.01 0.00 0.31 0.00 0.00 61.69 61.09 2gi0 s THR 30 Cb -0.03 -1.45 -0.01 0.00 0.01 0.00 0.00 72.50 71.03 2gi0 s THR 30 CO -0.00 0.48 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.60 2gi0 s VAL 31 N -0.07 2.99 -0.43 3.82 1.01 0.01 -0.93 120.40 126.81 2gi0 s VAL 31 Ca -0.03 -0.66 -0.10 0.00 0.00 0.00 0.00 61.98 61.20 2gi0 s VAL 31 Cb -0.12 -2.29 0.08 0.00 0.00 0.00 0.00 36.38 34.05 2gi0 s VAL 31 CO 0.03 0.50 0.28 0.20 0.00 0.00 0.00 175.10 176.10 2gi0 s ASN 32 N 0.82 5.69 -0.07 3.32 0.01 0.20 -1.74 114.94 123.16 2gi0 s ASN 32 Ca -0.04 -1.51 -0.13 0.00 -0.71 0.00 0.00 52.86 50.47 2gi0 s ASN 32 Cb -0.15 -2.01 -0.05 0.00 0.41 0.00 0.00 41.25 39.45 2gi0 s ASN 32 CO 0.01 -0.56 0.31 -0.22 -1.51 0.00 0.00 177.10 175.13 2gi0 s LEU 33 N 1.44 4.39 0.22 0.60 2.96 0.85 -0.83 118.68 128.31 2gi0 s LEU 33 Ca 0.03 0.72 0.00 0.00 -0.22 0.00 0.00 54.13 54.66 2gi0 s LEU 33 Cb -0.23 -2.40 -0.04 0.00 0.50 0.00 0.00 46.19 44.02 2gi0 s LEU 33 CO 0.02 0.28 0.14 -0.94 -1.32 0.00 0.00 176.35 174.54 2gi0 s SER 34 N -0.64 0.49 -0.38 3.68 1.04 -0.68 -1.26 113.70 115.95 2gi0 s SER 34 Ca 0.20 -1.43 0.02 0.00 0.48 0.00 0.00 55.95 55.22 2gi0 s SER 34 Cb -0.14 0.37 0.15 0.00 0.10 0.00 0.00 66.02 66.49 2gi0 s SER 34 CO 0.08 -0.85 0.28 -2.28 0.98 0.00 0.00 173.24 171.46 2gi0 s HIS 35 N -4.02 0.77 0.90 5.02 2.46 -1.19 -1.28 115.29 117.96 2gi0 s HIS 35 Ca 0.39 -1.84 -0.10 0.00 0.47 0.00 0.00 55.06 53.97 2gi0 s HIS 35 Cb 0.07 -0.86 0.14 0.00 -0.13 0.00 0.00 32.58 31.80 2gi0 s HIS 35 CO 0.14 -0.84 1.15 -2.14 -2.47 0.00 0.00 174.74 170.58 2gi0 s PRO 36 N 0.69 1.06 0.00 2.88 0.02 -1.24 -1.16 135.00 137.26 2gi0 s PRO 36 Ca 0.24 1.58 0.00 0.00 0.02 0.00 0.00 61.00 62.84 2gi0 s PRO 36 Cb -0.12 -1.73 0.00 0.00 0.02 0.00 0.00 34.50 32.67 2gi0 s PRO 36 CO -0.08 -2.61 0.00 0.41 -0.33 0.00 0.00 177.00 174.40 2gi0 n GLY 37 N 0.25 -1.09 0.00 0.52 0.00 -1.26 -3.60 105.19 100.01 2gi0 n GLY 37 Ca 0.12 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.99 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 0.83 -4.76 1.61 4.13 -1.26 -4.47 115.26 111.33 2gi0 n ASN 38 Ca 0.00 -1.33 -0.39 0.00 1.68 0.00 0.00 54.58 54.53 2gi0 n ASN 38 Cb 0.00 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.18 2gi0 n ASN 38 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2gi0 s LEU 39 N -0.33 4.58 0.72 3.41 1.43 -1.26 -4.85 118.68 122.38 2gi0 s LEU 39 Ca 0.00 1.82 -0.12 0.00 -1.03 0.00 0.00 54.13 54.81 2gi0 s LEU 39 Cb 0.00 -3.56 0.03 0.00 0.03 0.00 0.00 46.19 42.68 2gi0 s LEU 39 CO 0.00 0.14 1.11 -2.16 0.23 0.00 0.00 176.35 175.67 2gi0 s PRO 40 N -1.31 2.71 0.38 1.29 0.04 -1.26 -1.73 135.00 135.11 2gi0 s PRO 40 Ca 0.41 0.44 0.05 0.00 0.04 0.00 0.00 61.00 61.93 2gi0 s PRO 40 Cb -0.24 -2.01 0.75 0.00 0.04 0.00 0.00 34.50 33.05 2gi0 s PRO 40 CO 0.29 -1.14 2.02 -0.22 0.04 0.00 0.00 177.00 177.99 2gi0 h LYS 41 N -0.73 0.69 0.00 4.56 3.64 -1.88 -0.52 116.57 122.33 2gi0 h LYS 41 Ca -0.45 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2gi0 h LYS 41 Cb 1.26 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 2gi0 h LYS 41 CO 0.64 0.46 0.00 0.27 -2.27 0.00 0.00 179.45 178.54 2gi0 n ASN 42 N -4.46 0.00 -0.04 4.20 6.94 -1.26 -1.41 115.26 119.23 2gi0 n ASN 42 Ca 0.06 -0.03 -0.05 0.00 -0.02 0.00 0.00 54.58 54.54 2gi0 n ASN 42 Cb 0.10 -0.27 -0.03 0.00 -2.36 0.00 0.00 39.78 37.21 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 -1.27 0.41 -2.68 3.53 0.31 -0.34 -4.89 118.33 113.41 2gi0 n VAL 43 Ca 0.10 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 2gi0 n VAL 43 Cb 0.15 -0.77 0.05 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 -2.72 1.13 -2.00 5.55 0.00 -0.41 -5.01 117.12 113.65 2gi0 n MET 44 Ca -0.13 -2.67 -0.39 0.00 -0.00 0.00 0.00 57.70 54.52 2gi0 n MET 44 Cb 0.64 -0.80 0.01 0.00 0.00 0.00 0.00 33.22 33.06 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 -2.82 2.89 0.08 -5.12 0.00 -0.50 -4.78 107.32 97.07 2gi0 s GLY 45 Ca 0.25 1.23 0.08 0.00 0.00 0.00 0.00 44.72 46.27 2gi0 s GLY 45 CO -0.08 1.78 -0.20 0.30 0.00 0.00 0.00 173.10 174.89 2gi0 s HIS 46 N -1.32 1.76 0.46 1.90 3.76 -0.04 -4.82 115.29 116.99 2gi0 s HIS 46 Ca 0.62 -0.41 0.03 0.00 -0.15 0.00 0.00 55.06 55.15 2gi0 s HIS 46 Cb -0.37 -0.99 -0.02 0.00 1.11 0.00 0.00 32.58 32.31 2gi0 s HIS 46 CO 0.47 0.17 0.05 0.54 -0.85 0.00 0.00 174.74 175.12 2gi0 s ASN 47 N -1.69 3.54 -0.14 1.40 2.20 -1.26 -0.61 114.94 118.38 2gi0 s ASN 47 Ca 0.06 -1.64 0.01 0.00 -0.94 0.00 0.00 52.86 50.35 2gi0 s ASN 47 Cb -0.10 0.44 0.02 0.00 -2.00 0.00 0.00 41.25 39.61 2gi0 s ASN 47 CO 0.03 -0.85 -0.15 0.86 -2.94 0.00 0.00 177.10 174.05 2gi0 s TRP 48 N -3.01 2.16 -0.03 1.54 -0.00 -1.26 -4.34 118.94 114.00 2gi0 s TRP 48 Ca 0.15 -1.16 0.04 0.00 -0.00 0.00 0.00 56.10 55.13 2gi0 s TRP 48 Cb 0.03 -1.57 -0.00 0.00 -0.00 0.00 0.00 33.47 31.92 2gi0 s TRP 48 CO 0.09 -0.62 -0.15 0.08 -0.00 0.00 0.00 176.95 176.35 2gi0 s VAL 49 N 1.30 1.20 -0.11 5.86 1.01 -0.15 -1.23 120.40 128.29 2gi0 s VAL 49 Ca 0.01 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.40 2gi0 s VAL 49 Cb -0.14 -1.03 -0.01 0.00 0.00 0.00 0.00 36.38 35.20 2gi0 s VAL 49 CO -0.08 0.35 -0.17 -0.22 0.00 0.00 0.00 175.10 174.98 2gi0 s LEU 50 N -0.02 2.48 0.29 3.92 2.96 -0.37 -0.99 118.68 126.94 2gi0 s LEU 50 Ca -0.01 -0.40 -0.09 0.00 -0.22 0.00 0.00 54.13 53.40 2gi0 s LEU 50 Cb -0.09 -1.53 0.00 0.00 0.50 0.00 0.00 46.19 45.07 2gi0 s LEU 50 CO 0.01 0.18 0.49 -0.94 -1.32 0.00 0.00 176.35 174.78 2gi0 s SER 51 N 0.22 0.25 0.79 3.68 1.04 -0.72 -0.58 113.70 118.38 2gi0 s SER 51 Ca -0.11 -1.15 -0.14 0.00 0.48 0.00 0.00 55.95 55.04 2gi0 s SER 51 Cb -0.16 0.63 0.07 0.00 0.10 0.00 0.00 66.02 66.66 2gi0 s SER 51 CO 0.06 -1.23 1.21 0.42 0.98 0.00 0.00 173.24 174.68 2gi0 s THR 52 N -3.56 2.06 0.23 2.02 -4.23 -1.26 -1.04 115.64 109.87 2gi0 s THR 52 Ca 0.25 0.03 -0.06 0.00 -1.18 0.00 0.00 61.69 60.72 2gi0 s THR 52 Cb -0.01 -2.48 0.20 0.00 1.34 0.00 0.00 72.50 71.55 2gi0 s THR 52 CO 0.13 -0.02 1.72 0.00 -0.54 0.00 0.00 174.62 175.91 2gi0 h ALA 53 N -0.77 0.92 -0.30 3.99 0.00 -1.58 -2.44 119.26 119.06 2gi0 h ALA 53 Ca -0.47 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 2gi0 h ALA 53 Cb 1.30 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.21 2gi0 h ALA 53 CO 0.47 -0.26 -0.08 0.00 0.00 0.00 0.00 179.25 179.38 2gi0 h ALA 54 N 1.53 1.29 0.00 0.00 0.00 -1.91 -2.65 119.26 117.52 2gi0 h ALA 54 Ca 0.38 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2gi0 h ALA 54 Cb 0.57 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2gi0 h ALA 54 CO -0.41 0.47 -0.33 -0.25 0.00 0.00 0.00 179.25 178.73 2gi0 n ASP 55 N -4.23 0.68 -0.13 0.00 8.00 -0.97 -4.29 116.55 115.60 2gi0 n ASP 55 Ca 0.01 0.30 -0.04 0.00 0.71 0.00 0.00 54.79 55.77 2gi0 n ASP 55 Cb 0.30 -0.25 0.04 0.00 -0.02 0.00 0.00 41.12 41.18 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 0.22 -0.41 -1.24 4.05 -1.07 -1.71 114.93 114.77 2gi0 h MET 56 Ca 0.00 -0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.45 2gi0 h MET 56 Cb 0.71 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 31.42 2gi0 h MET 56 CO 0.00 0.15 0.18 0.37 0.23 0.00 0.00 176.91 177.84 2gi0 h GLN 57 N 0.23 0.36 -0.32 0.39 4.15 -1.78 0.66 115.11 118.80 2gi0 h GLN 57 Ca 0.21 -0.02 -0.10 0.00 0.77 0.00 0.00 58.65 59.51 2gi0 h GLN 57 Cb 0.26 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 2gi0 h GLN 57 CO -0.27 0.24 -0.18 0.78 -1.93 0.00 0.00 178.83 177.47 2gi0 h GLY 58 N 0.37 0.75 0.65 2.39 0.00 -1.75 0.27 103.07 105.75 2gi0 h GLY 58 Ca 0.18 -0.69 0.06 0.00 0.00 0.00 0.00 47.33 46.88 2gi0 h GLY 58 CO -0.15 0.63 0.29 -2.08 0.00 0.00 0.00 176.54 175.22 2gi0 h VAL 59 N 0.46 0.92 0.23 4.60 2.07 -0.94 -1.66 116.25 121.92 2gi0 h VAL 59 Ca 0.07 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 2gi0 h VAL 59 Cb 0.72 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2gi0 h VAL 59 CO 0.05 0.10 -0.11 0.58 0.02 0.00 0.00 177.57 178.21 2gi0 h VAL 60 N 0.54 0.83 -0.25 2.57 2.07 -0.70 0.10 116.25 121.41 2gi0 h VAL 60 Ca 0.26 -0.29 0.06 0.00 0.82 0.00 0.00 66.70 67.55 2gi0 h VAL 60 Cb 0.20 1.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.90 2gi0 h VAL 60 CO -0.19 0.07 -0.22 0.74 0.02 0.00 0.00 177.57 177.99 2gi0 h THR 61 N -0.45 0.43 -0.01 2.57 2.02 -0.76 0.14 112.91 116.85 2gi0 h THR 61 Ca -0.03 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 66.98 2gi0 h THR 61 Cb 0.34 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 2gi0 h THR 61 CO 0.05 0.00 -0.75 0.44 0.37 0.00 0.00 175.52 175.63 2gi0 h ASP 62 N -0.22 0.13 0.21 4.18 3.32 -1.33 -2.96 116.42 119.75 2gi0 h ASP 62 Ca 0.14 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 2gi0 h ASP 62 Cb 0.43 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.94 2gi0 h ASP 62 CO -0.37 0.83 -0.10 1.23 -1.72 0.00 0.00 179.24 179.11 2gi0 h GLY 63 N 1.95 -0.29 0.34 2.75 0.00 -0.42 -2.94 103.07 104.45 2gi0 h GLY 63 Ca -0.02 0.11 0.18 0.00 0.00 0.00 0.00 47.33 47.60 2gi0 h GLY 63 CO 0.11 -0.11 0.59 -0.33 0.00 0.00 0.00 176.54 176.80 2gi0 h MET 64 N -0.66 0.53 0.00 4.80 2.86 -0.78 -1.27 114.93 120.40 2gi0 h MET 64 Ca -0.03 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2gi0 h MET 64 Cb 0.47 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.01 2gi0 h MET 64 CO 0.05 0.35 0.00 0.00 1.06 0.00 0.00 176.91 178.36 2gi0 h ALA 65 N 1.61 1.00 0.00 6.32 0.00 -1.46 -3.35 119.26 123.38 2gi0 h ALA 65 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2gi0 h ALA 65 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2gi0 h ALA 65 CO -0.22 0.00 -0.18 0.43 0.00 0.00 0.00 179.25 179.28 2gi0 n SER 66 N -2.86 0.46 0.00 0.00 7.64 -0.48 -5.03 113.62 113.35 2gi0 n SER 66 Ca 0.02 0.34 0.00 0.00 1.01 0.00 0.00 58.87 60.24 2gi0 n SER 66 Cb 0.33 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 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 1.41 -2.29 0.33 0.23 0.00 -1.26 -4.13 105.19 99.49 2gi0 n GLY 67 Ca 0.06 -1.48 0.08 0.00 0.00 0.00 0.00 46.02 44.68 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 0.00 0.70 -0.81 0.99 5.85 -1.94 -1.13 115.31 118.97 2gi0 h LEU 68 Ca 0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2gi0 h LEU 68 Cb 0.00 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 40.98 2gi0 h LEU 68 CO 0.00 0.32 0.00 0.44 -0.34 0.00 0.00 178.44 178.86 2gi0 h ASP 69 N 0.77 0.00 -0.40 1.25 3.32 -2.03 -1.48 116.42 117.86 2gi0 h ASP 69 Ca 0.49 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.48 2gi0 h ASP 69 Cb 0.63 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.14 2gi0 h ASP 69 CO -0.33 0.00 0.04 0.29 -1.72 0.00 0.00 179.24 177.52 2gi0 n LYS 70 N -2.37 3.19 -1.97 3.56 5.02 -0.76 -4.96 118.16 119.87 2gi0 n LYS 70 Ca 0.02 -2.98 -0.14 0.00 -2.02 0.00 0.00 58.31 53.20 2gi0 n LYS 70 Cb 0.24 -1.96 -0.03 0.00 -0.02 0.00 0.00 35.03 33.26 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 -0.38 -3.94 -3.58 4.39 9.92 -0.56 -1.82 116.55 120.58 2gi0 n ASP 71 Ca 0.27 0.24 -0.26 0.00 -0.53 0.00 0.00 54.79 54.51 2gi0 n ASP 71 Cb 1.04 -3.47 0.04 0.00 -0.64 0.00 0.00 41.12 38.08 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 -2.78 -2.34 -4.55 1.24 4.01 -0.50 -4.79 117.16 107.45 2gi0 n TYR 72 Ca -0.15 0.81 -0.22 0.00 -0.16 0.00 0.00 57.90 58.18 2gi0 n TYR 72 Cb 0.55 -4.25 -0.15 0.00 -0.31 0.00 0.00 39.34 35.18 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 -7.08 1.92 0.09 7.72 1.43 -0.75 -3.90 118.68 118.10 2gi0 s LEU 73 Ca 0.54 -0.23 -0.31 0.00 -1.03 0.00 0.00 54.13 53.10 2gi0 s LEU 73 Cb -0.26 -0.67 -0.09 0.00 0.03 0.00 0.00 46.19 45.20 2gi0 s LEU 73 CO 0.67 0.12 1.76 -0.75 0.23 0.00 0.00 176.35 178.38 2gi0 s LYS 74 N -0.05 4.16 0.20 1.70 2.20 -1.26 -4.84 119.74 121.85 2gi0 s LYS 74 Ca 0.00 2.47 -0.32 0.00 -0.36 0.00 0.00 55.97 57.76 2gi0 s LYS 74 Cb -0.07 -3.66 -0.14 0.00 -1.51 0.00 0.00 37.83 32.45 2gi0 s LYS 74 CO 0.00 -0.81 1.48 -2.30 -0.36 0.00 0.00 175.35 173.37 2gi0 n PRO 75 N 5.85 2.08 -1.56 4.03 -0.02 -1.26 -2.14 135.00 141.97 2gi0 n PRO 75 Ca 0.17 0.75 -0.11 0.00 -2.02 0.00 0.00 63.50 62.29 2gi0 n PRO 75 Cb 0.39 -2.45 -0.03 0.00 -0.02 0.00 0.00 33.50 31.39 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 2.70 -4.08 -4.60 2.55 8.00 -1.26 -4.93 116.55 114.94 2gi0 n ASP 76 Ca 0.14 0.19 -0.43 0.00 0.71 0.00 0.00 54.79 55.40 2gi0 n ASP 76 Cb 0.30 -2.75 -0.03 0.00 -0.02 0.00 0.00 41.12 38.63 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 -2.78 5.87 0.24 -2.24 -1.08 -0.91 -4.85 116.67 110.90 2gi0 s ASP 77 Ca 0.00 1.28 0.22 0.00 -0.52 0.00 0.00 52.55 53.53 2gi0 s ASP 77 Cb 0.00 -2.53 0.95 0.00 -1.46 0.00 0.00 42.92 39.88 2gi0 s ASP 77 CO 0.00 -1.73 1.66 -1.54 0.52 0.00 0.00 175.17 174.08 2gi0 n SER 78 N 10.38 0.57 0.20 -0.34 3.41 -1.26 -2.16 113.62 124.42 2gi0 n SER 78 Ca 0.23 0.66 0.13 0.00 -0.26 0.00 0.00 58.87 59.62 2gi0 n SER 78 Cb 0.47 -0.77 0.26 0.00 -0.26 0.00 0.00 64.21 63.91 2gi0 n SER 78 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2gi0 h ARG 79 N 0.00 0.00 -6.18 4.33 3.08 -1.97 -3.42 114.38 110.22 2gi0 h ARG 79 Ca 0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.46 2gi0 h ARG 79 Cb 0.29 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.24 2gi0 h ARG 79 CO 0.00 0.00 0.74 0.08 -1.07 0.00 0.00 179.97 179.72 2gi0 s VAL 80 N -3.22 4.24 0.19 2.04 1.01 -0.92 -4.49 120.40 119.25 2gi0 s VAL 80 Ca 0.07 0.58 -0.08 0.00 0.00 0.00 0.00 61.98 62.55 2gi0 s VAL 80 Cb 0.07 -4.61 0.09 0.00 0.00 0.00 0.00 36.38 31.93 2gi0 s VAL 80 CO 0.64 -1.19 1.68 0.40 0.00 0.00 0.00 175.10 176.63 2gi0 h ILE 81 N 6.08 1.26 -2.19 2.22 2.04 -1.10 -3.46 117.51 122.37 2gi0 h ILE 81 Ca -0.25 -1.07 0.01 0.00 1.00 0.00 0.00 64.86 64.54 2gi0 h ILE 81 Cb 1.07 0.67 -0.18 0.00 -0.74 0.00 0.00 36.82 37.64 2gi0 h ILE 81 CO 1.13 0.40 0.32 0.00 0.00 0.00 0.00 178.15 179.99 2gi0 s ALA 82 N -5.16 -1.77 -0.11 1.87 0.00 -1.23 -4.98 121.76 110.37 2gi0 s ALA 82 Ca -0.12 1.13 -0.25 0.00 0.00 0.00 0.00 51.96 52.73 2gi0 s ALA 82 Cb 0.14 0.13 0.06 0.00 0.00 0.00 0.00 23.12 23.45 2gi0 s ALA 82 CO 0.85 -0.50 0.60 -3.38 0.00 0.00 0.00 175.76 173.33 2gi0 s HIS 83 N -2.08 -0.59 0.99 0.00 -3.43 -1.26 -1.24 115.29 107.68 2gi0 s HIS 83 Ca -0.04 1.17 -0.16 0.00 -0.80 0.00 0.00 55.06 55.24 2gi0 s HIS 83 Cb -0.00 0.30 0.20 0.00 -1.43 0.00 0.00 32.58 31.64 2gi0 s HIS 83 CO -0.00 -0.47 1.23 0.95 -2.00 0.00 0.00 174.74 174.45 2gi0 s THR 84 N -0.68 1.91 0.91 -5.38 -4.23 -0.37 -4.83 115.64 102.98 2gi0 s THR 84 Ca -0.08 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.30 2gi0 s THR 84 Cb -0.02 -2.85 0.15 0.00 1.34 0.00 0.00 72.50 71.11 2gi0 s THR 84 CO 0.06 0.00 1.20 -1.59 -0.54 0.00 0.00 174.62 173.75 2gi0 s LYS 85 N -5.66 1.10 0.02 3.99 -2.85 -1.26 -4.63 119.74 110.44 2gi0 s LYS 85 Ca 0.70 0.01 -0.29 0.00 -1.00 0.00 0.00 55.97 55.40 2gi0 s LYS 85 Cb -0.08 -1.86 -0.04 0.00 -2.06 0.00 0.00 37.83 33.80 2gi0 s LYS 85 CO 0.53 -2.17 0.95 -1.17 0.10 0.00 0.00 175.35 173.59 2gi0 s LEU 86 N -5.92 4.39 0.06 2.77 2.96 -1.26 -4.46 118.68 117.22 2gi0 s LEU 86 Ca 0.66 1.64 0.08 0.00 -0.22 0.00 0.00 54.13 56.30 2gi0 s LEU 86 Cb -0.10 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 43.03 2gi0 s LEU 86 CO 0.52 -0.20 -0.21 0.27 -1.32 0.00 0.00 176.35 175.40 2gi0 s ILE 87 N 0.76 1.73 0.70 6.68 -4.36 0.22 -4.90 121.20 122.03 2gi0 s ILE 87 Ca 0.49 -1.30 0.03 0.00 -0.26 0.00 0.00 60.65 59.62 2gi0 s ILE 87 Cb -0.21 -1.52 0.13 0.00 1.25 0.00 0.00 42.46 42.11 2gi0 s ILE 87 CO 0.27 0.17 0.96 -0.83 0.24 0.00 0.00 174.94 175.75 2gi0 s GLY 88 N -1.35 1.73 0.31 6.27 0.00 -1.26 -0.86 107.32 112.17 2gi0 s GLY 88 Ca 0.08 -1.98 -0.28 0.00 0.00 0.00 0.00 44.72 42.54 2gi0 s GLY 88 CO 0.02 -1.39 1.16 1.44 0.00 0.00 0.00 173.10 174.33 2gi0 n SER 89 N -2.70 2.07 0.00 1.64 7.64 -0.71 -1.89 113.62 119.67 2gi0 n SER 89 Ca 0.17 1.19 0.00 0.00 1.01 0.00 0.00 58.87 61.24 2gi0 n SER 89 Cb 0.61 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.42 2gi0 n SER 89 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gi0 n GLY 90 N 1.03 1.75 3.98 0.23 0.00 -0.31 -4.96 105.19 106.92 2gi0 n GLY 90 Ca 0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.90 2gi0 n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gi0 s GLU 91 N -0.08 3.02 0.01 1.61 2.02 -0.79 -4.95 118.70 119.53 2gi0 s GLU 91 Ca 0.00 -0.93 -0.01 0.00 0.02 0.00 0.00 54.97 54.06 2gi0 s GLU 91 Cb 0.00 -2.73 -0.01 0.00 0.10 0.00 0.00 34.13 31.49 2gi0 s GLU 91 CO 0.00 -0.12 -0.00 0.15 0.02 0.00 0.00 175.26 175.31 2gi0 s LYS 92 N -4.32 0.18 -0.06 1.61 1.02 -1.26 -3.17 119.74 113.73 2gi0 s LYS 92 Ca 0.48 -0.30 -0.17 0.00 0.02 0.00 0.00 55.97 56.00 2gi0 s LYS 92 Cb -0.10 0.06 0.04 0.00 -0.52 0.00 0.00 37.83 37.31 2gi0 s LYS 92 CO 0.33 -0.03 0.40 0.34 -0.92 0.00 0.00 175.35 175.47 2gi0 s ASP 93 N -0.75 -0.34 0.07 2.83 2.15 -0.39 -5.01 116.67 115.24 2gi0 s ASP 93 Ca -0.08 0.40 0.08 0.00 0.43 0.00 0.00 52.55 53.38 2gi0 s ASP 93 Cb -0.05 0.50 -0.03 0.00 -0.30 0.00 0.00 42.92 43.04 2gi0 s ASP 93 CO -0.00 -0.39 -0.23 -0.44 -0.17 0.00 0.00 175.17 173.94 2gi0 s SER 94 N -0.87 2.72 -0.03 -0.34 0.01 -1.26 -0.11 113.70 113.81 2gi0 s SER 94 Ca -0.09 -0.60 0.05 0.00 1.31 0.00 0.00 55.95 56.62 2gi0 s SER 94 Cb -0.04 -0.21 -0.01 0.00 0.21 0.00 0.00 66.02 65.98 2gi0 s SER 94 CO 0.04 0.16 -0.20 0.54 0.41 0.00 0.00 173.24 174.19 2gi0 s VAL 95 N -0.91 1.61 -0.06 3.43 0.11 -0.71 -4.90 120.40 118.97 2gi0 s VAL 95 Ca 0.09 -0.84 0.04 0.00 -2.93 0.00 0.00 61.98 58.33 2gi0 s VAL 95 Cb -0.09 -1.36 -0.02 0.00 -1.53 0.00 0.00 36.38 33.37 2gi0 s VAL 95 CO 0.03 0.46 -0.16 -0.89 -3.33 0.00 0.00 175.10 171.20 2gi0 s THR 96 N -0.23 2.88 0.10 5.04 2.01 -1.26 -0.81 115.64 123.38 2gi0 s THR 96 Ca 0.01 -0.78 -0.01 0.00 0.31 0.00 0.00 61.69 61.23 2gi0 s THR 96 Cb -0.10 -2.12 -0.04 0.00 0.01 0.00 0.00 72.50 70.24 2gi0 s THR 96 CO 0.01 0.58 0.01 0.72 -0.69 0.00 0.00 174.62 175.25 2gi0 s PHE 97 N -0.55 0.77 -0.38 4.92 -0.71 -0.42 -4.97 117.98 116.64 2gi0 s PHE 97 Ca 0.08 -1.12 -0.24 0.00 -1.04 0.00 0.00 56.93 54.60 2gi0 s PHE 97 Cb -0.11 -0.47 0.01 0.00 -1.21 0.00 0.00 43.02 41.24 2gi0 s PHE 97 CO 0.01 -0.40 0.86 0.34 -1.34 0.00 0.00 175.22 174.69 2gi0 s ASP 98 N -3.01 6.59 0.46 1.98 -1.08 -1.26 -0.78 116.67 119.56 2gi0 s ASP 98 Ca 0.16 0.39 0.31 0.00 -0.52 0.00 0.00 52.55 52.89 2gi0 s ASP 98 Cb 0.07 -2.43 1.60 0.00 -1.46 0.00 0.00 42.92 40.71 2gi0 s ASP 98 CO -0.03 -0.83 1.95 0.58 0.52 0.00 0.00 175.17 177.36 2gi0 h VAL 99 N 5.84 0.00 0.00 1.11 2.07 -1.54 0.43 116.25 124.16 2gi0 h VAL 99 Ca -0.24 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.18 2gi0 h VAL 99 Cb 1.08 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.71 2gi0 h VAL 99 CO 0.96 0.00 0.00 -1.54 0.02 0.00 0.00 177.57 177.01 2gi0 n SER 100 N -2.64 0.63 0.00 0.57 3.41 -1.26 -1.97 113.62 112.36 2gi0 n SER 100 Ca -0.01 0.67 0.05 0.00 -0.26 0.00 0.00 58.87 59.32 2gi0 n SER 100 Cb 0.11 -0.80 0.26 0.00 -0.26 0.00 0.00 64.21 63.52 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 -2.21 0.21 -4.71 4.33 5.02 0.15 -4.81 118.16 116.14 2gi0 n LYS 101 Ca 0.02 0.11 -0.23 0.00 -2.02 0.00 0.00 58.31 56.18 2gi0 n LYS 101 Cb 0.20 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.55 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 -2.31 2.01 -0.20 -0.35 1.43 -0.83 -5.12 118.68 113.31 2gi0 s LEU 102 Ca 0.11 -0.28 -0.07 0.00 -1.03 0.00 0.00 54.13 52.87 2gi0 s LEU 102 Cb 0.06 -0.78 -0.04 0.00 0.03 0.00 0.00 46.19 45.46 2gi0 s LEU 102 CO 0.13 0.18 0.05 -0.54 0.23 0.00 0.00 176.35 176.40 2gi0 s LYS 103 N -0.31 3.83 0.25 1.70 1.02 -1.26 -5.04 119.74 119.94 2gi0 s LYS 103 Ca 0.05 -0.41 -0.31 0.00 0.02 0.00 0.00 55.97 55.32 2gi0 s LYS 103 Cb -0.06 -3.22 -0.13 0.00 -0.52 0.00 0.00 37.83 33.90 2gi0 s LYS 103 CO -0.00 0.11 1.44 0.39 -0.92 0.00 0.00 175.35 176.36 2gi0 n GLU 104 N 4.01 2.16 0.00 1.68 4.71 -1.26 -1.70 120.64 130.23 2gi0 n GLU 104 Ca -0.16 0.77 0.00 0.00 -0.01 0.00 0.00 57.16 57.75 2gi0 n GLU 104 Cb 0.52 -2.44 0.00 0.00 -1.01 0.00 0.00 31.44 28.51 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 2.10 3.21 3.82 0.62 0.00 -1.26 -5.04 105.19 108.63 2gi0 n GLY 105 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.49 3.95 -0.36 1.61 2.56 -0.69 -5.05 118.70 120.23 2gi0 s GLU 106 Ca 0.00 1.14 -0.12 0.00 0.00 0.00 0.00 54.97 55.99 2gi0 s GLU 106 Cb 0.00 -2.13 0.01 0.00 2.00 0.00 0.00 34.13 34.01 2gi0 s GLU 106 CO 0.00 -0.28 0.22 -0.65 -0.56 0.00 0.00 175.26 173.99 2gi0 s GLN 107 N -3.54 3.11 0.10 4.30 1.11 -1.26 -4.82 119.66 118.66 2gi0 s GLN 107 Ca 0.63 -0.89 0.06 0.00 0.01 0.00 0.00 55.36 55.16 2gi0 s GLN 107 Cb -0.12 -3.76 -0.04 0.00 -1.01 0.00 0.00 33.01 28.08 2gi0 s GLN 107 CO 0.22 -0.59 -0.06 0.71 0.01 0.00 0.00 175.29 175.58 2gi0 s TYR 108 N 1.63 2.84 -0.05 0.91 2.02 -1.19 -1.57 117.35 121.95 2gi0 s TYR 108 Ca 0.04 -0.10 0.04 0.00 -0.37 0.00 0.00 57.07 56.68 2gi0 s TYR 108 Cb -0.18 -1.48 -0.00 0.00 -0.40 0.00 0.00 41.96 39.90 2gi0 s TYR 108 CO 0.08 0.45 -0.17 -1.64 -1.57 0.00 0.00 175.55 172.69 2gi0 s MET 109 N -2.23 1.84 0.12 -0.62 -1.94 -0.20 -1.33 119.30 114.94 2gi0 s MET 109 Ca 0.23 -0.61 0.05 0.00 -1.71 0.00 0.00 55.69 53.64 2gi0 s MET 109 Cb -0.11 -1.58 -0.04 0.00 2.01 0.00 0.00 34.83 35.11 2gi0 s MET 109 CO 0.15 0.23 0.06 -0.59 -0.01 0.00 0.00 175.02 174.87 2gi0 s PHE 110 N 0.07 3.06 0.17 -0.03 -0.12 -0.34 -1.76 117.98 119.03 2gi0 s PHE 110 Ca -0.05 -0.02 -0.24 0.00 -0.05 0.00 0.00 56.93 56.57 2gi0 s PHE 110 Cb -0.12 -1.52 0.06 0.00 -0.63 0.00 0.00 43.02 40.81 2gi0 s PHE 110 CO 0.02 0.51 0.97 -0.59 -0.05 0.00 0.00 175.22 176.08 2gi0 s PHE 111 N -1.53 -0.09 -0.17 3.49 -0.71 -0.16 -1.06 117.98 117.75 2gi0 s PHE 111 Ca 0.28 -0.24 0.00 0.00 -1.04 0.00 0.00 56.93 55.94 2gi0 s PHE 111 Cb -0.11 0.65 0.01 0.00 -1.21 0.00 0.00 43.02 42.36 2gi0 s PHE 111 CO 0.21 -0.87 -0.17 0.00 -1.34 0.00 0.00 175.22 173.06 2gi0 n THR 113 N 4.40 0.00 -1.28 0.00 -2.24 -1.26 -2.55 114.28 111.35 2gi0 n THR 113 Ca -0.20 -0.05 -0.35 0.00 -2.27 0.00 0.00 64.05 61.18 2gi0 n THR 113 Cb 0.51 0.22 0.11 0.00 -2.10 0.00 0.00 70.33 69.06 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 -1.15 0.42 -1.62 -0.78 -0.02 -1.26 -3.62 135.00 126.98 2gi0 n PRO 114 Ca 0.09 0.21 -0.56 0.00 -2.02 0.00 0.00 63.50 61.22 2gi0 n PRO 114 Cb 0.33 -2.37 -0.07 0.00 -0.02 0.00 0.00 33.50 31.37 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 -2.58 0.84 -0.27 0.52 -0.02 -1.26 -0.71 135.00 131.51 2gi0 n PRO 115 Ca 0.14 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2gi0 n PRO 115 Cb 0.50 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 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 2.85 2.10 0.10 -1.23 0.00 -1.26 -4.89 105.19 102.86 2gi0 n GLY 116 Ca 0.22 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.12 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 0.62 -0.10 1.61 8.25 0.11 -4.63 115.22 119.08 2gi0 n HIS 117 Ca 0.00 0.19 -0.01 0.00 -0.26 0.00 0.00 57.72 57.65 2gi0 n HIS 117 Cb 0.00 -1.10 0.25 0.00 1.12 0.00 0.00 29.99 30.26 2gi0 n HIS 117 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2gi0 h SER 118 N 0.01 0.69 1.43 0.41 0.02 -1.64 0.02 113.55 114.49 2gi0 h SER 118 Ca -0.42 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.43 2gi0 h SER 118 Cb 2.08 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 64.44 2gi0 h SER 118 CO 0.05 0.64 0.00 0.00 -1.14 0.00 0.00 176.83 176.38 2gi0 h ALA 119 N 1.46 1.00 0.00 3.77 0.00 -1.88 -3.12 119.26 120.50 2gi0 h ALA 119 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2gi0 h ALA 119 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2gi0 h ALA 119 CO -0.01 0.00 -1.12 1.28 0.00 0.00 0.00 179.25 179.40 2gi0 n LEU 120 N -3.01 0.67 -3.39 0.00 4.77 -0.61 -4.75 117.00 110.67 2gi0 n LEU 120 Ca 0.02 -0.38 -0.27 0.00 -0.03 0.00 0.00 56.01 55.35 2gi0 n LEU 120 Cb 0.40 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.39 2gi0 n LEU 120 CO 0.30 0.17 -0.32 -0.04 -1.33 0.00 0.00 177.39 176.17 2gi0 s MET 121 N -2.89 0.89 0.18 3.23 -1.94 -0.10 -4.60 119.30 114.06 2gi0 s MET 121 Ca 0.04 -2.07 -0.17 0.00 -1.71 0.00 0.00 55.69 51.78 2gi0 s MET 121 Cb 0.14 -1.40 0.03 0.00 2.01 0.00 0.00 34.83 35.61 2gi0 s MET 121 CO 0.77 -1.38 0.49 -1.59 -0.01 0.00 0.00 175.02 173.30 2gi0 s LYS 122 N 0.11 1.32 0.09 2.03 -2.85 -1.26 -1.40 119.74 117.78 2gi0 s LYS 122 Ca 0.32 -0.87 -0.23 0.00 -1.00 0.00 0.00 55.97 54.19 2gi0 s LYS 122 Cb 0.03 0.50 0.08 0.00 -2.06 0.00 0.00 37.83 36.38 2gi0 s LYS 122 CO -0.19 -0.55 1.07 0.41 0.10 0.00 0.00 175.35 176.19 2gi0 n GLY 123 N -0.32 0.47 3.92 0.59 0.00 -0.22 -4.65 105.19 104.98 2gi0 n GLY 123 Ca -0.11 -1.09 -0.28 0.00 0.00 0.00 0.00 46.02 44.54 2gi0 n GLY 123 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gi0 s THR 124 N -2.06 5.27 -0.10 2.61 -4.23 -0.55 -1.20 115.64 115.38 2gi0 s THR 124 Ca 0.24 -0.60 0.01 0.00 -1.18 0.00 0.00 61.69 60.16 2gi0 s THR 124 Cb -0.02 -3.65 0.02 0.00 1.34 0.00 0.00 72.50 70.19 2gi0 s THR 124 CO 0.03 0.00 -0.11 -0.22 -0.54 0.00 0.00 174.62 173.78 2gi0 s LEU 125 N -2.92 1.49 -0.00 4.79 0.20 -0.44 -0.50 118.68 121.30 2gi0 s LEU 125 Ca 0.34 -0.34 0.02 0.00 0.69 0.00 0.00 54.13 54.85 2gi0 s LEU 125 Cb -0.12 -0.90 -0.01 0.00 -0.43 0.00 0.00 46.19 44.73 2gi0 s LEU 125 CO 0.28 -0.03 -0.08 0.28 -0.29 0.00 0.00 176.35 176.51 2gi0 s THR 126 N 1.16 0.62 0.21 3.68 -1.32 -0.45 -3.14 115.64 116.40 2gi0 s THR 126 Ca -0.05 -0.36 -0.26 0.00 -1.21 0.00 0.00 61.69 59.81 2gi0 s THR 126 Cb -0.14 -0.53 -0.09 0.00 -1.51 0.00 0.00 72.50 70.24 2gi0 s THR 126 CO -0.03 0.16 0.84 -0.76 -2.21 0.00 0.00 174.62 172.62 2gi0 s LEU 127 N -0.23 4.57 0.00 9.08 1.43 -1.26 -0.54 118.68 131.73 2gi0 s LEU 127 Ca 0.03 1.74 0.00 0.00 -1.03 0.00 0.00 54.13 54.87 2gi0 s LEU 127 Cb -0.03 -3.49 0.00 0.00 0.03 0.00 0.00 46.19 42.70 2gi0 s LEU 127 CO -0.00 0.15 0.14 0.29 0.23 0.00 0.00 176.35 177.16