#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g7q s GLN 2 N 0.00 0.11 -0.11 0.38 0.74 -1.26 -4.47 119.66 115.05 1g7q s GLN 2 Ca 0.00 0.43 0.01 0.00 0.05 0.00 0.00 55.36 55.85 1g7q s GLN 2 Cb 0.00 -0.65 -0.02 0.00 1.10 0.00 0.00 33.01 33.44 1g7q s GLN 2 CO 0.00 -0.45 -0.13 0.15 -0.55 0.00 0.00 175.29 174.32 1g7q s LYS 3 N 2.32 3.17 0.07 1.67 1.02 -0.06 -4.95 119.74 122.97 1g7q s LYS 3 Ca 0.04 -0.67 -0.30 0.00 0.02 0.00 0.00 55.97 55.06 1g7q s LYS 3 Cb -0.14 -2.59 -0.05 0.00 -0.52 0.00 0.00 37.83 34.54 1g7q s LYS 3 CO -0.09 0.33 1.08 0.99 -0.92 0.00 0.00 175.35 176.75 1g7q s THR 4 N 0.05 4.33 0.34 2.17 2.01 -1.26 -2.36 115.64 120.92 1g7q s THR 4 Ca -0.04 1.75 -0.28 0.00 0.31 0.00 0.00 61.69 63.42 1g7q s THR 4 Cb -0.14 -4.12 -0.10 0.00 0.01 0.00 0.00 72.50 68.14 1g7q s THR 4 CO 0.04 0.18 1.30 -2.16 -0.69 0.00 0.00 174.62 173.29 1g7q s PRO 5 N 0.68 4.33 -0.09 4.92 0.04 -1.26 -4.56 135.00 139.06 1g7q s PRO 5 Ca 0.54 2.20 -0.14 0.00 0.04 0.00 0.00 61.00 63.63 1g7q s PRO 5 Cb -0.26 -3.05 -0.05 0.00 0.04 0.00 0.00 34.50 31.18 1g7q s PRO 5 CO 0.30 -0.20 0.36 -0.65 0.04 0.00 0.00 177.00 176.84 1g7q s GLN 6 N -1.82 4.08 -0.18 4.56 -1.52 0.70 -4.89 119.66 120.59 1g7q s GLN 6 Ca 0.49 0.25 0.01 0.00 -1.95 0.00 0.00 55.36 54.17 1g7q s GLN 6 Cb -0.39 -3.34 0.02 0.00 -0.22 0.00 0.00 33.01 29.08 1g7q s GLN 6 CO 0.52 0.43 -0.19 0.42 -0.25 0.00 0.00 175.29 176.22 1g7q s ILE 7 N -0.17 2.18 -0.11 1.08 1.01 -1.26 -0.58 121.20 123.35 1g7q s ILE 7 Ca 0.21 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 59.98 1g7q s ILE 7 Cb -0.15 -1.92 0.01 0.00 0.01 0.00 0.00 42.46 40.42 1g7q s ILE 7 CO 0.08 0.53 -0.18 -1.10 0.00 0.00 0.00 174.94 174.27 1g7q s GLN 8 N 1.23 2.51 -0.13 2.79 -0.21 -0.51 -4.99 119.66 120.34 1g7q s GLN 8 Ca 0.03 -0.68 0.01 0.00 0.02 0.00 0.00 55.36 54.75 1g7q s GLN 8 Cb -0.13 -2.04 -0.01 0.00 1.00 0.00 0.00 33.01 31.83 1g7q s GLN 8 CO -0.10 0.01 -0.17 0.08 -2.12 0.00 0.00 175.29 172.98 1g7q s VAL 9 N 0.78 2.63 0.03 1.09 1.01 -1.26 -0.65 120.40 124.03 1g7q s VAL 9 Ca -0.10 -0.80 -0.27 0.00 0.00 0.00 0.00 61.98 60.80 1g7q s VAL 9 Cb -0.16 -2.08 0.09 0.00 0.00 0.00 0.00 36.38 34.23 1g7q s VAL 9 CO 0.01 0.53 0.76 -0.72 0.00 0.00 0.00 175.10 175.68 1g7q s TYR 10 N 0.51 -0.48 0.27 5.22 1.13 -0.37 -4.66 117.35 118.97 1g7q s TYR 10 Ca -0.11 0.48 0.04 0.00 -1.41 0.00 0.00 57.07 56.07 1g7q s TYR 10 Cb -0.16 0.51 -0.03 0.00 -1.10 0.00 0.00 41.96 41.18 1g7q s TYR 10 CO 0.04 -0.65 0.41 -1.54 -2.51 0.00 0.00 175.55 171.31 1g7q s SER 11 N -2.17 6.31 0.07 -0.18 1.04 -1.26 0.21 113.70 117.72 1g7q s SER 11 Ca -0.00 0.17 -0.17 0.00 0.48 0.00 0.00 55.95 56.42 1g7q s SER 11 Cb -0.01 -1.90 -0.11 0.00 0.10 0.00 0.00 66.02 64.10 1g7q s SER 11 CO -0.06 -0.13 1.39 -0.09 0.98 0.00 0.00 173.24 175.34 1g7q h ARG 12 N 1.06 0.54 -6.43 4.02 9.65 -1.46 -3.45 114.38 118.29 1g7q h ARG 12 Ca -0.51 -0.28 -0.62 0.00 -1.10 0.00 0.00 59.98 57.47 1g7q h ARG 12 Cb 1.23 0.01 -0.14 0.00 -1.39 0.00 0.00 29.97 29.67 1g7q h ARG 12 CO 0.61 0.86 -0.73 -1.01 2.80 0.00 0.00 179.97 182.49 1g7q s HIS 13 N -4.37 2.57 0.24 2.20 3.76 -1.26 -5.04 115.29 113.40 1g7q s HIS 13 Ca -0.13 -0.25 -0.31 0.00 -0.15 0.00 0.00 55.06 54.22 1g7q s HIS 13 Cb 0.07 -1.24 -0.13 0.00 1.11 0.00 0.00 32.58 32.39 1g7q s HIS 13 CO 0.79 0.53 1.50 -2.30 -0.85 0.00 0.00 174.74 174.41 1g7q n PRO 14 N -0.04 2.28 -1.77 8.40 -0.02 -1.26 -4.83 135.00 137.75 1g7q n PRO 14 Ca -0.10 0.81 -0.42 0.00 -2.02 0.00 0.00 63.50 61.77 1g7q n PRO 14 Cb 0.56 -2.53 -0.03 0.00 -0.02 0.00 0.00 33.50 31.48 1g7q n PRO 14 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1g7q s PRO 15 N -0.17 4.15 -0.15 0.52 0.04 -1.26 -5.00 135.00 133.13 1g7q s PRO 15 Ca 0.69 2.55 -0.03 0.00 0.04 0.00 0.00 61.00 64.25 1g7q s PRO 15 Cb -0.60 -3.16 0.05 0.00 0.04 0.00 0.00 34.50 30.83 1g7q s PRO 15 CO 0.47 -0.73 0.04 -2.00 0.04 0.00 0.00 177.00 174.81 1g7q s GLU 16 N 1.38 0.51 0.12 4.56 2.12 -1.26 -5.11 118.70 121.01 1g7q s GLU 16 Ca 0.75 -0.19 -0.35 0.00 0.36 0.00 0.00 54.97 55.54 1g7q s GLU 16 Cb -0.48 -1.69 -0.16 0.00 0.26 0.00 0.00 34.13 32.07 1g7q s GLU 16 CO 0.32 -0.54 1.41 0.09 -0.54 0.00 0.00 175.26 176.00 1g7q n ASN 17 N 5.13 2.15 0.00 -1.70 3.02 -1.26 -1.40 115.26 121.20 1g7q n ASN 17 Ca -0.08 1.11 0.00 0.00 -0.03 0.00 0.00 54.58 55.58 1g7q n ASN 17 Cb 0.48 -1.28 0.00 0.00 -0.61 0.00 0.00 39.78 38.37 1g7q n ASN 17 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1g7q n GLY 18 N 2.78 2.11 3.65 7.41 0.00 -0.11 -5.00 105.19 116.03 1g7q n GLY 18 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 1g7q n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g7q s LYS 19 N -0.49 4.05 0.32 1.61 -0.14 -0.49 -4.96 119.74 119.64 1g7q s LYS 19 Ca 0.00 -0.29 -0.27 0.00 -1.36 0.00 0.00 55.97 54.06 1g7q s LYS 19 Cb 0.00 -3.46 -0.13 0.00 -1.68 0.00 0.00 37.83 32.55 1g7q s LYS 19 CO 0.00 0.11 0.91 -2.30 -0.76 0.00 0.00 175.35 173.31 1g7q n PRO 20 N 4.11 1.15 -2.23 -1.68 -0.02 -1.26 -4.25 135.00 130.82 1g7q n PRO 20 Ca -0.15 0.41 -0.04 0.00 -2.02 0.00 0.00 63.50 61.69 1g7q n PRO 20 Cb 0.52 -1.77 -0.01 0.00 -0.02 0.00 0.00 33.50 32.23 1g7q n PRO 20 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1g7q n ASN 21 N 1.17 -0.51 -3.92 2.55 2.85 0.15 -4.97 115.26 112.59 1g7q n ASN 21 Ca 0.10 -1.58 -0.20 0.00 -0.11 0.00 0.00 54.58 52.79 1g7q n ASN 21 Cb 0.34 0.91 -0.16 0.00 1.24 0.00 0.00 39.78 42.11 1g7q n ASN 21 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1g7q s ILE 22 N -2.59 0.64 -0.16 -1.44 1.01 -1.26 -1.29 121.20 116.10 1g7q s ILE 22 Ca 0.08 -0.19 -0.06 0.00 0.00 0.00 0.00 60.65 60.48 1g7q s ILE 22 Cb -0.01 -0.63 -0.04 0.00 0.01 0.00 0.00 42.46 41.79 1g7q s ILE 22 CO 0.06 0.24 0.03 -0.22 0.00 0.00 0.00 174.94 175.05 1g7q s LEU 23 N 0.79 3.67 0.04 2.97 2.96 0.63 -1.01 118.68 128.73 1g7q s LEU 23 Ca -0.12 0.06 0.08 0.00 -0.22 0.00 0.00 54.13 53.94 1g7q s LEU 23 Cb -0.14 -1.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 1g7q s LEU 23 CO 0.01 0.22 -0.23 0.20 -1.32 0.00 0.00 176.35 175.23 1g7q s ASN 24 N 0.09 3.46 -0.28 3.68 0.01 0.13 -1.40 114.94 120.62 1g7q s ASN 24 Ca 0.03 -0.52 -0.01 0.00 -0.71 0.00 0.00 52.86 51.65 1g7q s ASN 24 Cb -0.13 -0.43 0.09 0.00 0.41 0.00 0.00 41.25 41.19 1g7q s ASN 24 CO 0.01 0.26 0.08 0.00 -1.51 0.00 0.00 177.10 175.94 1g7q s TYR 26 N 1.66 3.22 -0.26 0.00 5.04 0.18 -0.92 117.35 126.27 1g7q s TYR 26 Ca 0.07 0.07 -0.07 0.00 -2.44 0.00 0.00 57.07 54.70 1g7q s TYR 26 Cb -0.17 -2.56 -0.02 0.00 0.35 0.00 0.00 41.96 39.56 1g7q s TYR 26 CO -0.21 -0.32 0.07 0.08 -1.34 0.00 0.00 175.55 173.83 1g7q s VAL 27 N 1.93 4.19 0.30 3.14 1.01 -0.44 -1.43 120.40 129.10 1g7q s VAL 27 Ca 0.11 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.79 1g7q s VAL 27 Cb -0.16 -3.01 -0.05 0.00 0.00 0.00 0.00 36.38 33.15 1g7q s VAL 27 CO 0.11 0.27 0.10 0.42 0.00 0.00 0.00 175.10 176.00 1g7q s THR 28 N 1.58 0.69 -1.55 3.92 -4.23 0.25 -1.37 115.64 114.94 1g7q s THR 28 Ca 0.05 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.42 1g7q s THR 28 Cb -0.16 -2.63 0.09 0.00 1.34 0.00 0.00 72.50 71.14 1g7q s THR 28 CO 0.03 0.00 0.97 0.00 -0.54 0.00 0.00 174.62 175.08 1g7q n GLN 29 N -0.58 -5.35 -4.27 3.99 6.02 -0.26 -0.21 117.38 116.70 1g7q n GLN 29 Ca -0.01 0.58 -0.23 0.00 -0.01 0.00 0.00 57.00 57.33 1g7q n GLN 29 Cb 0.66 -5.47 -0.07 0.00 1.02 0.00 0.00 30.24 26.38 1g7q n GLN 29 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 177.06 175.46 1g7q s PHE 30 N -3.29 2.65 -0.29 1.08 -0.71 -1.08 -4.28 117.98 112.06 1g7q s PHE 30 Ca 0.67 -0.30 -0.22 0.00 -1.04 0.00 0.00 56.93 56.05 1g7q s PHE 30 Cb -0.34 -1.33 0.15 0.00 -1.21 0.00 0.00 43.02 40.29 1g7q s PHE 30 CO 0.83 0.54 1.13 -1.58 -1.34 0.00 0.00 175.22 174.80 1g7q s HIS 31 N -2.39 -0.38 1.09 3.49 2.46 -0.99 -0.17 115.29 118.40 1g7q s HIS 31 Ca 0.33 0.84 -0.13 0.00 0.47 0.00 0.00 55.06 56.58 1g7q s HIS 31 Cb -0.04 0.35 0.24 0.00 -0.13 0.00 0.00 32.58 33.00 1g7q s HIS 31 CO 0.20 -0.18 1.06 -1.25 -2.47 0.00 0.00 174.74 172.10 1g7q s PRO 32 N 0.57 -0.34 0.45 2.88 0.04 -1.26 -0.88 135.00 136.45 1g7q s PRO 32 Ca -0.00 0.61 0.15 0.00 0.04 0.00 0.00 61.00 61.80 1g7q s PRO 32 Cb -0.04 -1.64 1.02 0.00 0.04 0.00 0.00 34.50 33.88 1g7q s PRO 32 CO -0.11 -3.28 1.99 -1.00 0.04 0.00 0.00 177.00 174.64 1g7q h PRO 33 N -2.29 0.00 -6.51 0.56 0.13 -1.99 -3.44 132.00 118.46 1g7q h PRO 33 Ca -0.59 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.02 1g7q h PRO 33 Cb 1.34 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.51 1g7q h PRO 33 CO 0.55 0.19 1.10 -1.58 -0.23 0.00 0.00 178.00 178.02 1g7q s HIS 34 N -4.57 2.21 0.04 1.56 2.46 -1.26 -4.96 115.29 110.77 1g7q s HIS 34 Ca -0.04 0.03 -0.25 0.00 0.47 0.00 0.00 55.06 55.28 1g7q s HIS 34 Cb 0.15 -4.15 0.06 0.00 -0.13 0.00 0.00 32.58 28.51 1g7q s HIS 34 CO 0.69 -4.73 0.57 -1.50 -2.47 0.00 0.00 174.74 167.30 1g7q s ILE 35 N 2.65 0.02 -0.13 0.89 2.07 -1.26 -4.63 121.20 120.81 1g7q s ILE 35 Ca 0.80 -0.14 0.02 0.00 -1.41 0.00 0.00 60.65 59.92 1g7q s ILE 35 Cb -0.46 -0.98 0.01 0.00 0.13 0.00 0.00 42.46 41.17 1g7q s ILE 35 CO 0.36 -0.07 -0.18 -0.70 -1.91 0.00 0.00 174.94 172.44 1g7q s GLU 36 N -2.37 2.55 -0.11 3.50 2.12 -0.61 -5.00 118.70 118.78 1g7q s GLU 36 Ca -0.06 -0.68 0.01 0.00 0.36 0.00 0.00 54.97 54.61 1g7q s GLU 36 Cb -0.01 -2.15 0.02 0.00 0.26 0.00 0.00 34.13 32.26 1g7q s GLU 36 CO -0.01 -0.08 -0.13 0.42 -0.54 0.00 0.00 175.26 174.92 1g7q s ILE 37 N 1.02 1.34 -0.04 -3.70 1.01 -1.26 -0.98 121.20 118.60 1g7q s ILE 37 Ca -0.04 -0.53 0.03 0.00 0.00 0.00 0.00 60.65 60.11 1g7q s ILE 37 Cb -0.15 -1.26 0.00 0.00 0.01 0.00 0.00 42.46 41.07 1g7q s ILE 37 CO -0.04 0.41 -0.12 -1.10 0.00 0.00 0.00 174.94 174.10 1g7q s GLN 38 N 1.21 1.33 -0.14 2.79 -0.21 -0.12 -4.99 119.66 119.53 1g7q s GLN 38 Ca -0.03 -0.41 -0.08 0.00 0.02 0.00 0.00 55.36 54.86 1g7q s GLN 38 Cb -0.14 -1.18 -0.04 0.00 1.00 0.00 0.00 33.01 32.64 1g7q s GLN 38 CO -0.04 0.14 0.14 -1.64 -2.12 0.00 0.00 175.29 171.77 1g7q s MET 39 N 0.24 3.63 0.02 2.91 -1.94 -1.26 -0.01 119.30 122.88 1g7q s MET 39 Ca -0.05 -0.14 0.08 0.00 -1.71 0.00 0.00 55.69 53.86 1g7q s MET 39 Cb -0.11 -3.24 -0.02 0.00 2.01 0.00 0.00 34.83 33.46 1g7q s MET 39 CO 0.01 0.66 -0.23 -0.51 -0.01 0.00 0.00 175.02 174.95 1g7q s LEU 40 N -0.70 2.11 -0.19 -0.03 1.43 0.86 -0.70 118.68 121.47 1g7q s LEU 40 Ca 0.14 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1g7q s LEU 40 Cb -0.12 -1.13 0.03 0.00 0.03 0.00 0.00 46.19 45.00 1g7q s LEU 40 CO 0.03 0.23 -0.16 -0.75 0.23 0.00 0.00 176.35 175.93 1g7q s LYS 41 N -0.91 2.57 -1.57 1.70 2.20 0.53 -1.41 119.74 122.84 1g7q s LYS 41 Ca 0.09 -0.86 -0.15 0.00 -0.36 0.00 0.00 55.97 54.69 1g7q s LYS 41 Cb -0.09 -2.51 0.10 0.00 -1.51 0.00 0.00 37.83 33.83 1g7q s LYS 41 CO 0.01 -0.31 0.95 0.09 -0.36 0.00 0.00 175.35 175.73 1g7q n ASN 42 N 4.63 -4.56 0.00 1.43 3.02 0.56 -1.13 115.26 119.21 1g7q n ASN 42 Ca -0.18 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.54 1g7q n ASN 42 Cb 0.48 -3.66 0.00 0.00 -0.61 0.00 0.00 39.78 36.00 1g7q n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1g7q n GLY 43 N -1.63 0.88 3.42 7.41 0.00 -1.26 -5.02 105.19 108.98 1g7q n GLY 43 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1g7q n GLY 43 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1g7q s LYS 44 N -0.01 2.72 0.30 1.61 2.20 -0.29 -5.05 119.74 121.22 1g7q s LYS 44 Ca 0.00 -0.73 -0.30 0.00 -0.36 0.00 0.00 55.97 54.58 1g7q s LYS 44 Cb 0.00 -2.40 -0.12 0.00 -1.51 0.00 0.00 37.83 33.80 1g7q s LYS 44 CO 0.00 0.49 1.49 1.17 -0.36 0.00 0.00 175.35 178.13 1g7q n LYS 45 N 2.70 2.45 -3.14 4.03 3.00 -1.26 -0.35 118.16 125.59 1g7q n LYS 45 Ca -0.17 0.87 -0.39 0.00 -0.00 0.00 0.00 58.31 58.61 1g7q n LYS 45 Cb 0.52 -2.58 -0.05 0.00 0.00 0.00 0.00 35.03 32.92 1g7q n LYS 45 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1g7q s ILE 46 N -0.37 5.08 0.01 3.15 1.01 0.12 -4.82 121.20 125.39 1g7q s ILE 46 Ca 0.62 1.25 -0.21 0.00 0.00 0.00 0.00 60.65 62.30 1g7q s ILE 46 Cb -0.54 -3.96 -0.18 0.00 0.01 0.00 0.00 42.46 37.79 1g7q s ILE 46 CO 0.53 0.24 1.23 1.55 0.00 0.00 0.00 174.94 178.49 1g7q h PRO 47 N 6.93 0.30 0.00 2.79 0.13 -1.93 -3.37 132.00 136.85 1g7q h PRO 47 Ca -0.38 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 64.53 1g7q h PRO 47 Cb 1.18 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1g7q h PRO 47 CO 0.76 0.82 0.00 0.36 -0.23 0.00 0.00 178.00 179.71 1g7q n LYS 48 N -4.51 0.47 -1.56 0.86 -0.00 -1.26 -4.94 118.16 107.22 1g7q n LYS 48 Ca -0.08 0.05 -0.61 0.00 -0.00 0.00 0.00 58.31 57.67 1g7q n LYS 48 Cb 0.43 -1.50 -0.09 0.00 -0.00 0.00 0.00 35.03 33.88 1g7q n LYS 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1g7q n VAL 49 N -1.13 0.00 -3.85 0.58 0.31 -1.26 -4.95 118.33 108.03 1g7q n VAL 49 Ca 0.13 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 64.10 1g7q n VAL 49 Cb 0.11 -0.27 -0.07 0.00 -0.91 0.00 0.00 33.84 32.69 1g7q n VAL 49 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1g7q s GLU 50 N 1.64 3.74 -0.16 5.55 2.02 -0.26 -4.92 118.70 126.32 1g7q s GLU 50 Ca 0.94 -0.19 -0.06 0.00 0.02 0.00 0.00 54.97 55.68 1g7q s GLU 50 Cb -1.33 -3.26 -0.04 0.00 0.10 0.00 0.00 34.13 29.60 1g7q s GLU 50 CO 0.68 0.56 0.06 -1.64 0.02 0.00 0.00 175.26 174.94 1g7q s MET 51 N -0.40 3.73 0.38 1.61 -1.94 -1.26 -0.95 119.30 120.47 1g7q s MET 51 Ca 0.11 -0.33 -0.12 0.00 -1.71 0.00 0.00 55.69 53.65 1g7q s MET 51 Cb -0.12 -3.13 0.05 0.00 2.01 0.00 0.00 34.83 33.64 1g7q s MET 51 CO 0.01 0.42 0.71 -1.13 -0.01 0.00 0.00 175.02 175.02 1g7q n SER 52 N 3.07 -2.05 -3.90 3.03 3.41 0.40 -4.99 113.62 112.59 1g7q n SER 52 Ca -0.17 -2.64 -0.28 0.00 -0.26 0.00 0.00 58.87 55.52 1g7q n SER 52 Cb 0.53 3.47 0.01 0.00 -0.26 0.00 0.00 64.21 67.97 1g7q n SER 52 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1g7q n ASP 53 N -1.54 -2.98 -4.71 4.04 9.92 -1.26 -0.40 116.55 119.62 1g7q n ASP 53 Ca -0.07 -0.85 -0.42 0.00 -0.53 0.00 0.00 54.79 52.92 1g7q n ASP 53 Cb 0.58 -3.67 -0.03 0.00 -0.64 0.00 0.00 41.12 37.36 1g7q n ASP 53 CO 0.00 0.00 0.00 -0.32 0.13 0.00 0.00 177.20 177.01 1g7q s MET 54 N -6.48 4.54 0.27 -1.24 1.75 -1.26 -4.14 119.30 112.74 1g7q s MET 54 Ca 0.40 1.41 -0.09 0.00 -1.25 0.00 0.00 55.69 56.16 1g7q s MET 54 Cb -0.20 -3.47 0.04 0.00 2.84 0.00 0.00 34.83 34.03 1g7q s MET 54 CO 0.85 -0.08 0.51 -1.13 -0.65 0.00 0.00 175.02 174.52 1g7q n SER 55 N 4.02 -1.49 -3.93 1.11 3.41 -0.53 -5.01 113.62 111.20 1g7q n SER 55 Ca 0.06 -2.13 -0.10 0.00 -0.26 0.00 0.00 58.87 56.45 1g7q n SER 55 Cb 0.51 2.51 -0.10 0.00 -0.26 0.00 0.00 64.21 66.87 1g7q n SER 55 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1g7q s PHE 56 N -4.21 0.18 0.68 7.33 -0.71 -1.26 -0.88 117.98 119.11 1g7q s PHE 56 Ca 0.12 -0.41 -0.08 0.00 -1.04 0.00 0.00 56.93 55.51 1g7q s PHE 56 Cb -0.03 -0.13 0.15 0.00 -1.21 0.00 0.00 43.02 41.80 1g7q s PHE 56 CO 0.09 -0.30 0.92 -1.13 -1.34 0.00 0.00 175.22 173.47 1g7q n SER 57 N 1.17 0.38 0.27 1.98 3.41 -0.54 -4.87 113.62 115.42 1g7q n SER 57 Ca -0.21 -1.53 0.11 0.00 -0.26 0.00 0.00 58.87 56.98 1g7q n SER 57 Cb 0.57 -0.68 0.75 0.00 -0.26 0.00 0.00 64.21 64.59 1g7q n SER 57 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1g7q h LYS 58 N 0.00 0.00 -0.60 4.33 2.10 -2.02 0.63 116.57 121.01 1g7q h LYS 58 Ca -0.30 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.35 1g7q h LYS 58 Cb 0.90 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.23 1g7q h LYS 58 CO 0.24 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.29 1g7q n ASP 59 N -4.27 3.33 0.00 7.07 5.75 -1.26 -4.93 116.55 122.24 1g7q n ASP 59 Ca -0.03 -2.27 0.00 0.00 -0.01 0.00 0.00 54.79 52.48 1g7q n ASP 59 Cb 0.11 -0.46 0.00 0.00 -1.03 0.00 0.00 41.12 39.73 1g7q n ASP 59 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1g7q n TRP 60 N 0.73 0.00 -2.16 2.11 7.02 0.21 -5.00 117.44 120.35 1g7q n TRP 60 Ca 0.18 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.30 1g7q n TRP 60 Cb 0.62 -0.68 0.01 0.00 -2.42 0.00 0.00 31.31 28.84 1g7q n TRP 60 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 1g7q s SER 61 N -2.54 5.61 0.33 -0.99 1.04 -1.26 -4.65 113.70 111.24 1g7q s SER 61 Ca 0.00 2.30 -0.12 0.00 0.48 0.00 0.00 55.95 58.60 1g7q s SER 61 Cb 0.00 -2.59 -0.08 0.00 0.10 0.00 0.00 66.02 63.45 1g7q s SER 61 CO 0.00 -1.30 0.70 -0.36 0.98 0.00 0.00 173.24 173.27 1g7q s PHE 62 N -1.65 3.41 -0.01 5.02 0.40 0.76 -1.46 117.98 124.45 1g7q s PHE 62 Ca 0.73 1.08 0.01 0.00 -0.60 0.00 0.00 56.93 58.15 1g7q s PHE 62 Cb -0.28 -2.44 0.00 0.00 0.51 0.00 0.00 43.02 40.81 1g7q s PHE 62 CO 0.31 0.07 -0.04 0.71 0.70 0.00 0.00 175.22 176.97 1g7q s TYR 63 N -2.07 0.44 -0.10 0.36 1.51 -0.06 -1.10 117.35 116.33 1g7q s TYR 63 Ca 0.52 -0.08 -0.24 0.00 -1.01 0.00 0.00 57.07 56.26 1g7q s TYR 63 Cb -0.10 -0.31 0.05 0.00 -0.11 0.00 0.00 41.96 41.49 1g7q s TYR 63 CO 0.22 -0.03 0.56 -1.50 -1.11 0.00 0.00 175.55 173.70 1g7q s ILE 64 N 0.03 0.01 -0.10 2.71 2.07 -0.47 -1.46 121.20 124.00 1g7q s ILE 64 Ca 0.00 -0.11 0.01 0.00 -1.41 0.00 0.00 60.65 59.14 1g7q s ILE 64 Cb -0.03 -0.85 -0.02 0.00 0.13 0.00 0.00 42.46 41.69 1g7q s ILE 64 CO -0.00 -0.06 -0.11 -0.22 -1.91 0.00 0.00 174.94 172.64 1g7q s LEU 65 N -0.69 2.88 -0.13 8.50 2.96 0.47 -1.32 118.68 131.35 1g7q s LEU 65 Ca -0.08 -0.21 -0.00 0.00 -0.22 0.00 0.00 54.13 53.63 1g7q s LEU 65 Cb -0.03 -1.63 -0.02 0.00 0.50 0.00 0.00 46.19 45.02 1g7q s LEU 65 CO 0.05 0.25 -0.13 0.00 -1.32 0.00 0.00 176.35 175.21 1g7q s ALA 66 N -0.17 2.63 0.03 5.97 0.00 -0.10 -0.45 121.76 129.67 1g7q s ALA 66 Ca 0.01 -0.89 -0.11 0.00 0.00 0.00 0.00 51.96 50.97 1g7q s ALA 66 Cb -0.13 -1.21 0.01 0.00 0.00 0.00 0.00 23.12 21.78 1g7q s ALA 66 CO 0.03 0.26 0.23 -3.38 0.00 0.00 0.00 175.76 172.90 1g7q s HIS 67 N 0.30 -0.01 -0.03 0.00 -3.43 -0.13 -0.31 115.29 111.69 1g7q s HIS 67 Ca -0.10 -0.14 -0.17 0.00 -0.80 0.00 0.00 55.06 53.84 1g7q s HIS 67 Cb -0.16 0.01 0.03 0.00 -1.43 0.00 0.00 32.58 31.04 1g7q s HIS 67 CO 0.05 -0.43 0.37 -0.08 -2.00 0.00 0.00 174.74 172.66 1g7q s THR 68 N -2.31 0.04 0.33 -5.38 -1.32 -0.50 -1.10 115.64 105.41 1g7q s THR 68 Ca -0.07 -0.36 -0.26 0.00 -1.21 0.00 0.00 61.69 59.78 1g7q s THR 68 Cb -0.02 -0.67 -0.10 0.00 -1.51 0.00 0.00 72.50 70.21 1g7q s THR 68 CO -0.02 -0.20 0.97 -1.61 -2.21 0.00 0.00 174.62 171.55 1g7q s GLU 69 N -1.18 4.53 0.06 7.08 2.02 -1.26 -0.27 118.70 129.68 1g7q s GLU 69 Ca -0.12 1.39 -0.27 0.00 0.02 0.00 0.00 54.97 56.00 1g7q s GLU 69 Cb -0.04 -2.80 0.07 0.00 0.10 0.00 0.00 34.13 31.46 1g7q s GLU 69 CO 0.05 0.22 0.66 -0.59 0.02 0.00 0.00 175.26 175.62 1g7q s PHE 70 N -1.58 -0.57 -0.31 1.61 -0.71 -0.41 -4.86 117.98 111.15 1g7q s PHE 70 Ca 0.51 0.64 0.01 0.00 -1.04 0.00 0.00 56.93 57.05 1g7q s PHE 70 Cb -0.20 0.50 0.07 0.00 -1.21 0.00 0.00 43.02 42.18 1g7q s PHE 70 CO 0.26 -0.73 -0.00 0.99 -1.34 0.00 0.00 175.22 174.40 1g7q s THR 71 N -2.65 2.54 0.52 -4.49 2.01 -1.26 0.35 115.64 112.65 1g7q s THR 71 Ca -0.03 -1.82 -0.23 0.00 0.31 0.00 0.00 61.69 59.92 1g7q s THR 71 Cb -0.01 -2.62 -0.06 0.00 0.01 0.00 0.00 72.50 69.83 1g7q s THR 71 CO -0.04 -0.28 1.36 -2.16 -0.69 0.00 0.00 174.62 172.81 1g7q s PRO 72 N 1.09 3.31 0.23 4.92 0.04 -1.26 -4.75 135.00 138.58 1g7q s PRO 72 Ca -0.01 2.25 0.07 0.00 0.04 0.00 0.00 61.00 63.35 1g7q s PRO 72 Cb -0.20 -2.37 -0.05 0.00 0.04 0.00 0.00 34.50 31.92 1g7q s PRO 72 CO -0.05 -1.05 -0.11 0.99 0.04 0.00 0.00 177.00 176.82 1g7q s THR 73 N -1.29 1.68 0.35 1.26 2.01 -1.26 -0.93 115.64 117.45 1g7q s THR 73 Ca 0.68 -2.18 0.09 0.00 0.31 0.00 0.00 61.69 60.60 1g7q s THR 73 Cb -0.40 -2.18 0.10 0.00 0.01 0.00 0.00 72.50 70.02 1g7q s THR 73 CO 0.49 -0.50 1.82 -0.08 -0.69 0.00 0.00 174.62 175.66 1g7q h GLU 74 N 2.47 0.17 0.00 4.92 4.57 -1.97 -3.28 114.58 121.45 1g7q h GLU 74 Ca -0.39 -0.06 -0.09 0.00 -1.18 0.00 0.00 59.36 57.65 1g7q h GLU 74 Cb 1.22 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.79 1g7q h GLU 74 CO 0.64 0.46 -1.85 0.25 -1.18 0.00 0.00 179.01 177.32 1g7q n THR 75 N -4.14 0.48 -2.15 0.32 -2.24 -1.26 -4.96 114.28 100.33 1g7q n THR 75 Ca -0.01 -0.59 -0.42 0.00 -2.27 0.00 0.00 64.05 60.76 1g7q n THR 75 Cb 0.38 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.36 1g7q n THR 75 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1g7q s ASP 76 N -4.96 6.81 -0.01 3.42 1.01 -1.24 -5.02 116.67 116.68 1g7q s ASP 76 Ca -0.07 2.45 0.03 0.00 0.71 0.00 0.00 52.55 55.67 1g7q s ASP 76 Cb 0.11 -2.61 -0.03 0.00 1.01 0.00 0.00 42.92 41.40 1g7q s ASP 76 CO 0.87 -0.60 -0.06 0.42 0.21 0.00 0.00 175.17 176.01 1g7q s THR 77 N 0.33 3.74 0.07 -1.27 -4.23 -1.26 -4.74 115.64 108.28 1g7q s THR 77 Ca 0.59 -0.70 0.07 0.00 -1.18 0.00 0.00 61.69 60.47 1g7q s THR 77 Cb -0.38 -2.62 -0.03 0.00 1.34 0.00 0.00 72.50 70.81 1g7q s THR 77 CO 0.37 0.43 -0.18 -0.31 -0.54 0.00 0.00 174.62 174.39 1g7q s TYR 78 N -0.98 1.53 0.24 3.99 1.51 -1.26 -0.32 117.35 122.06 1g7q s TYR 78 Ca 0.17 -0.41 -0.15 0.00 -1.01 0.00 0.00 57.07 55.66 1g7q s TYR 78 Cb -0.11 -0.86 0.01 0.00 -0.11 0.00 0.00 41.96 40.88 1g7q s TYR 78 CO 0.07 0.12 0.52 0.00 -1.11 0.00 0.00 175.55 175.14 1g7q s ALA 79 N -1.09 -0.52 -0.09 3.71 0.00 -0.50 -0.91 121.76 122.36 1g7q s ALA 79 Ca 0.03 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.33 1g7q s ALA 79 Cb -0.09 0.98 0.02 0.00 0.00 0.00 0.00 23.12 24.03 1g7q s ALA 79 CO 0.03 -0.87 -0.10 0.00 0.00 0.00 0.00 175.76 174.82 1g7q s ARG 81 N 1.27 3.54 -0.06 0.00 3.52 0.99 -0.81 118.95 127.41 1g7q s ARG 81 Ca -0.03 -0.59 0.04 0.00 -0.13 0.00 0.00 55.73 55.02 1g7q s ARG 81 Cb -0.14 -2.83 0.00 0.00 -1.56 0.00 0.00 34.95 30.42 1g7q s ARG 81 CO -0.04 0.18 -0.17 0.08 -0.81 0.00 0.00 175.30 174.54 1g7q s VAL 82 N 0.49 1.47 -0.14 7.11 1.01 0.76 -0.95 120.40 130.15 1g7q s VAL 82 Ca -0.05 -0.71 -0.00 0.00 0.00 0.00 0.00 61.98 61.22 1g7q s VAL 82 Cb -0.15 -1.28 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 1g7q s VAL 82 CO 0.03 0.43 -0.14 -0.54 0.00 0.00 0.00 175.10 174.88 1g7q s LYS 83 N 0.28 3.32 -0.04 2.72 1.02 -0.15 -0.44 119.74 126.45 1g7q s LYS 83 Ca -0.10 -0.71 -0.20 0.00 0.02 0.00 0.00 55.97 54.98 1g7q s LYS 83 Cb -0.14 -2.63 0.04 0.00 -0.52 0.00 0.00 37.83 34.57 1g7q s LYS 83 CO 0.04 0.13 0.43 -1.58 -0.92 0.00 0.00 175.35 173.45 1g7q s HIS 84 N 0.55 -0.35 0.62 3.18 2.46 -1.26 -1.57 115.29 118.92 1g7q s HIS 84 Ca -0.09 0.60 0.35 0.00 0.47 0.00 0.00 55.06 56.39 1g7q s HIS 84 Cb -0.16 0.20 1.98 0.00 -0.13 0.00 0.00 32.58 34.47 1g7q s HIS 84 CO 0.04 -0.44 2.24 -0.44 -2.47 0.00 0.00 174.74 173.66 1g7q h ASP 85 N 3.73 0.00 0.89 9.88 3.32 -1.94 -0.86 116.42 131.44 1g7q h ASP 85 Ca -0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.76 1g7q h ASP 85 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1g7q h ASP 85 CO 0.38 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.36 1g7q n SER 86 N -3.51 0.41 -4.21 6.45 3.41 -1.26 -4.66 113.62 110.25 1g7q n SER 86 Ca -0.02 0.57 -0.31 0.00 -0.26 0.00 0.00 58.87 58.85 1g7q n SER 86 Cb 0.16 -0.67 -0.17 0.00 -0.26 0.00 0.00 64.21 63.27 1g7q n SER 86 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1g7q s MET 87 N -3.13 2.95 0.38 4.33 -1.94 -0.33 -4.90 119.30 116.66 1g7q s MET 87 Ca 0.08 -0.85 0.08 0.00 -1.71 0.00 0.00 55.69 53.30 1g7q s MET 87 Cb 0.12 -2.23 0.77 0.00 2.01 0.00 0.00 34.83 35.49 1g7q s MET 87 CO 0.43 0.17 1.93 0.00 -0.01 0.00 0.00 175.02 177.54 1g7q h ALA 88 N 6.73 1.52 -2.87 3.03 0.00 -1.83 -3.42 119.26 122.42 1g7q h ALA 88 Ca -0.20 -0.18 -0.40 0.00 0.00 0.00 0.00 54.91 54.13 1g7q h ALA 88 Cb 1.24 -0.11 -0.18 0.00 0.00 0.00 0.00 17.79 18.74 1g7q h ALA 88 CO 0.47 0.35 -0.75 -2.00 0.00 0.00 0.00 179.25 177.31 1g7q s GLU 89 N -4.88 1.00 0.78 0.00 2.12 -1.26 -5.09 118.70 111.36 1g7q s GLU 89 Ca -0.06 -1.23 -0.14 0.00 0.36 0.00 0.00 54.97 53.90 1g7q s GLU 89 Cb 0.16 -0.85 0.07 0.00 0.26 0.00 0.00 34.13 33.76 1g7q s GLU 89 CO 0.74 0.16 1.23 -2.14 -0.54 0.00 0.00 175.26 174.71 1g7q s PRO 90 N -2.69 1.79 -0.10 4.30 0.02 -1.26 -4.86 135.00 132.20 1g7q s PRO 90 Ca 0.08 1.84 0.04 0.00 0.02 0.00 0.00 61.00 62.98 1g7q s PRO 90 Cb -0.05 -1.78 0.00 0.00 0.02 0.00 0.00 34.50 32.69 1g7q s PRO 90 CO 0.03 -2.12 -0.23 0.21 -0.33 0.00 0.00 177.00 174.56 1g7q s LYS 91 N -3.98 2.88 -0.12 5.54 2.20 0.41 -4.93 119.74 121.75 1g7q s LYS 91 Ca 0.75 -0.82 -0.01 0.00 -0.36 0.00 0.00 55.97 55.54 1g7q s LYS 91 Cb -0.31 -2.19 -0.02 0.00 -1.51 0.00 0.00 37.83 33.80 1g7q s LYS 91 CO 0.49 0.16 -0.11 0.99 -0.36 0.00 0.00 175.35 176.52 1g7q s THR 92 N 0.39 3.29 -0.14 3.43 2.01 -1.26 -0.17 115.64 123.19 1g7q s THR 92 Ca -0.18 -0.58 0.02 0.00 0.31 0.00 0.00 61.69 61.26 1g7q s THR 92 Cb -0.18 -2.39 0.01 0.00 0.01 0.00 0.00 72.50 69.95 1g7q s THR 92 CO 0.08 0.53 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.63 1g7q s VAL 93 N 0.17 2.12 0.17 3.82 1.01 0.01 -4.95 120.40 122.75 1g7q s VAL 93 Ca -0.06 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 60.85 1g7q s VAL 93 Cb -0.15 -1.84 -0.07 0.00 0.00 0.00 0.00 36.38 34.32 1g7q s VAL 93 CO 0.04 0.55 0.51 -0.31 0.00 0.00 0.00 175.10 175.89 1g7q s TYR 94 N 0.77 3.51 -0.00 5.22 2.02 -1.26 -0.66 117.35 126.95 1g7q s TYR 94 Ca -0.08 0.90 -0.30 0.00 -0.37 0.00 0.00 57.07 57.21 1g7q s TYR 94 Cb -0.16 -2.26 -0.05 0.00 -0.40 0.00 0.00 41.96 39.09 1g7q s TYR 94 CO -0.01 0.37 1.30 -0.46 -1.57 0.00 0.00 175.55 175.18 1g7q s TRP 95 N -1.63 3.09 -0.56 2.71 -0.00 -0.09 -4.88 118.94 117.58 1g7q s TRP 95 Ca 0.42 1.04 -0.09 0.00 -0.00 0.00 0.00 56.10 57.47 1g7q s TRP 95 Cb -0.13 -3.54 0.14 0.00 -0.00 0.00 0.00 33.47 29.94 1g7q s TRP 95 CO 0.20 -1.87 0.43 0.34 -0.00 0.00 0.00 176.95 176.05 1g7q s ASP 96 N 1.56 5.77 0.64 5.86 -1.08 -1.26 -4.79 116.67 123.37 1g7q s ASP 96 Ca 0.60 -2.24 0.38 0.00 -0.52 0.00 0.00 52.55 50.77 1g7q s ASP 96 Cb -0.29 -2.01 2.13 0.00 -1.46 0.00 0.00 42.92 41.29 1g7q s ASP 96 CO 0.26 -0.61 2.27 0.03 0.52 0.00 0.00 175.17 177.64 1g7q h ARG 97 N 8.04 0.00 -0.27 4.34 3.08 -1.97 -2.50 114.38 125.10 1g7q h ARG 97 Ca -0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1g7q h ARG 97 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.09 1g7q h ARG 97 CO 0.81 0.00 0.00 -0.25 -1.07 0.00 0.00 179.97 179.46 1g7q n ASP 98 N -3.31 3.30 0.00 7.04 8.00 -1.26 -4.83 116.55 125.49 1g7q n ASP 98 Ca -0.02 -1.98 0.00 0.00 0.71 0.00 0.00 54.79 53.49 1g7q n ASP 98 Cb 0.14 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.07 1g7q n ASP 98 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61