#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gg6 s VAL 17 N 0.00 5.01 -1.18 1.39 1.01 -1.24 -3.93 120.40 121.46 1gg6 s VAL 17 Ca 0.00 1.29 0.00 0.00 0.00 0.00 0.00 61.98 63.27 1gg6 s VAL 17 Cb 0.00 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.42 1gg6 s VAL 17 CO 0.00 0.33 0.00 0.59 0.00 0.00 0.00 175.10 176.02 1gg6 n ASN 18 N 3.35 -4.21 -1.16 3.32 3.02 -1.26 -5.02 115.26 113.30 1gg6 n ASN 18 Ca -0.04 0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.67 1gg6 n ASN 18 Cb 0.51 -3.06 0.00 0.00 -0.61 0.00 0.00 39.78 36.62 1gg6 n ASN 18 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gg6 n GLY 19 N -1.28 1.21 3.28 7.41 0.00 -1.25 -5.14 105.19 109.42 1gg6 n GLY 19 Ca -0.13 -1.81 -0.10 0.00 0.00 0.00 0.00 46.02 43.98 1gg6 n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1gg6 s GLU 20 N 2.15 1.00 0.29 1.61 -1.05 -1.26 -5.14 118.70 116.30 1gg6 s GLU 20 Ca 0.00 -0.85 -0.29 0.00 -0.15 0.00 0.00 54.97 53.68 1gg6 s GLU 20 Cb 0.00 0.41 -0.10 0.00 -0.44 0.00 0.00 34.13 34.00 1gg6 s GLU 20 CO 0.00 -0.36 1.34 -2.00 0.95 0.00 0.00 175.26 175.19 1gg6 s GLU 21 N -3.84 4.34 0.52 -4.83 2.12 -1.26 -5.01 118.70 110.74 1gg6 s GLU 21 Ca 0.05 2.21 -0.05 0.00 0.36 0.00 0.00 54.97 57.54 1gg6 s GLU 21 Cb 0.03 -3.10 -0.02 0.00 0.26 0.00 0.00 34.13 31.30 1gg6 s GLU 21 CO -0.10 -0.26 0.82 0.00 -0.54 0.00 0.00 175.26 175.18 1gg6 s ALA 22 N -0.65 3.37 0.09 6.30 0.00 -1.26 -5.02 121.76 124.59 1gg6 s ALA 22 Ca 0.53 -0.56 -0.31 0.00 0.00 0.00 0.00 51.96 51.62 1gg6 s ALA 22 Cb -0.40 -2.60 -0.07 0.00 0.00 0.00 0.00 23.12 20.05 1gg6 s ALA 22 CO 0.48 -0.49 1.31 0.08 0.00 0.00 0.00 175.76 177.14 1gg6 s VAL 23 N -2.82 3.60 0.08 0.00 1.01 -1.26 -4.90 120.40 116.10 1gg6 s VAL 23 Ca 0.49 1.15 -0.35 0.00 0.00 0.00 0.00 61.98 63.27 1gg6 s VAL 23 Cb -0.10 -3.74 -0.15 0.00 0.00 0.00 0.00 36.38 32.39 1gg6 s VAL 23 CO 0.45 0.09 1.55 -2.65 0.00 0.00 0.00 175.10 174.54 1gg6 n PRO 24 N 3.93 1.75 -0.96 2.72 -0.02 -1.26 -1.86 135.00 139.30 1gg6 n PRO 24 Ca 0.10 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1gg6 n PRO 24 Cb 0.44 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1gg6 n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gg6 n GLY 25 N 3.29 0.43 0.04 -1.23 0.00 -1.26 -4.91 105.19 101.55 1gg6 n GLY 25 Ca 0.19 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.36 1gg6 n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gg6 n SER 26 N -0.23 0.14 -3.31 1.61 3.41 -0.78 -3.76 113.62 110.70 1gg6 n SER 26 Ca 0.00 -0.45 -0.26 0.00 -0.26 0.00 0.00 58.87 57.90 1gg6 n SER 26 Cb 0.12 -0.17 -0.07 0.00 -0.26 0.00 0.00 64.21 63.82 1gg6 n SER 26 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1gg6 n TRP 27 N -1.12 2.22 0.27 7.33 7.02 -1.26 -4.97 117.44 126.92 1gg6 n TRP 27 Ca 0.16 -3.94 0.18 0.00 -1.02 0.00 0.00 57.50 52.88 1gg6 n TRP 27 Cb 0.22 -0.48 0.87 0.00 -2.42 0.00 0.00 31.31 29.50 1gg6 n TRP 27 CO 0.00 0.00 0.00 -1.00 -2.02 0.00 0.00 177.69 174.67 1gg6 h PRO 28 N 4.01 0.00 0.00 -0.99 0.13 -1.76 -1.14 132.00 132.24 1gg6 h PRO 28 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1gg6 h PRO 28 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1gg6 h PRO 28 CO 0.70 0.00 -0.62 0.11 -0.23 0.00 0.00 178.00 177.96 1gg6 h TRP 29 N 0.00 0.00 -2.58 1.56 0.09 -1.80 -2.78 115.95 110.44 1gg6 h TRP 29 Ca 0.05 0.00 -0.55 0.00 0.09 0.00 0.00 58.89 58.48 1gg6 h TRP 29 Cb 0.61 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 29.84 1gg6 h TRP 29 CO 0.00 0.00 1.13 -1.14 0.09 0.00 0.00 178.44 178.52 1gg6 s GLN 30 N -3.23 4.06 0.31 0.12 2.00 -0.43 -1.16 119.66 121.33 1gg6 s GLN 30 Ca 0.05 2.15 0.10 0.00 -2.00 0.00 0.00 55.36 55.66 1gg6 s GLN 30 Cb 0.11 -4.03 -0.05 0.00 0.80 0.00 0.00 33.01 29.83 1gg6 s GLN 30 CO 0.73 -0.99 -0.08 0.14 -0.50 0.00 0.00 175.29 174.59 1gg6 s VAL 31 N 4.48 2.69 -0.12 1.34 -7.23 -0.30 -4.49 120.40 116.77 1gg6 s VAL 31 Ca 0.76 -2.14 0.01 0.00 -1.81 0.00 0.00 61.98 58.80 1gg6 s VAL 31 Cb -0.33 -2.62 -0.02 0.00 0.56 0.00 0.00 36.38 33.97 1gg6 s VAL 31 CO 0.31 -0.30 -0.14 -0.55 -0.31 0.00 0.00 175.10 174.12 1gg6 s SER 32 N -3.62 3.99 -0.27 4.85 0.15 -0.36 -1.99 113.70 116.45 1gg6 s SER 32 Ca 0.32 -0.31 -0.14 0.00 0.70 0.00 0.00 55.95 56.52 1gg6 s SER 32 Cb -0.03 -1.48 -0.04 0.00 -1.71 0.00 0.00 66.02 62.77 1gg6 s SER 32 CO 0.18 0.20 0.32 -0.76 1.20 0.00 0.00 173.24 174.38 1gg6 s LEU 33 N 0.16 4.04 0.07 3.45 1.43 0.52 -0.68 118.68 127.66 1gg6 s LEU 33 Ca -0.07 0.22 0.09 0.00 -1.03 0.00 0.00 54.13 53.33 1gg6 s LEU 33 Cb -0.15 -2.34 -0.03 0.00 0.03 0.00 0.00 46.19 43.69 1gg6 s LEU 33 CO 0.05 -0.14 -0.23 -1.10 0.23 0.00 0.00 176.35 175.15 1gg6 s GLN 34 N 1.96 1.46 0.92 1.70 -0.21 -0.66 -1.15 119.66 123.68 1gg6 s GLN 34 Ca 0.13 -1.09 -0.13 0.00 0.02 0.00 0.00 55.36 54.29 1gg6 s GLN 34 Cb -0.16 -1.67 0.21 0.00 1.00 0.00 0.00 33.01 32.39 1gg6 s GLN 34 CO 0.10 0.42 1.26 -0.40 -2.12 0.00 0.00 175.29 174.54 1gg6 n ASP 35 N 1.55 0.34 0.18 5.90 5.68 -0.66 -0.76 116.55 128.78 1gg6 n ASP 35 Ca -0.18 -1.61 0.11 0.00 -0.50 0.00 0.00 54.79 52.62 1gg6 n ASP 35 Cb 0.53 -0.94 0.61 0.00 -1.14 0.00 0.00 41.12 40.18 1gg6 n ASP 35 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1gg6 h LYS 36 N 0.00 0.00 -0.01 0.11 2.10 -1.92 0.06 116.57 116.91 1gg6 h LYS 36 Ca -0.41 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.24 1gg6 h LYS 36 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1gg6 h LYS 36 CO 0.31 0.00 -0.13 0.25 -2.00 0.00 0.00 179.45 177.88 1gg6 n THR 37 N -2.29 0.00 -0.57 0.07 -2.24 -1.26 -4.93 114.28 103.05 1gg6 n THR 37 Ca -0.01 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1gg6 n THR 37 Cb 0.07 0.68 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 1gg6 n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gg6 n GLY 38 N 1.28 0.72 3.69 3.38 0.00 0.01 -5.04 105.19 109.23 1gg6 n GLY 38 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1gg6 n GLY 38 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1gg6 s PHE 39 N -2.14 3.51 -0.09 1.61 5.36 -1.26 -4.80 117.98 120.19 1gg6 s PHE 39 Ca 0.00 1.56 -0.30 0.00 -0.96 0.00 0.00 56.93 57.23 1gg6 s PHE 39 Cb 0.00 -3.16 -0.03 0.00 -0.34 0.00 0.00 43.02 39.50 1gg6 s PHE 39 CO 0.00 -0.21 1.18 -1.58 -1.46 0.00 0.00 175.22 173.15 1gg6 s HIS 40 N 1.94 3.18 0.00 10.12 5.65 -1.26 -1.66 115.29 133.26 1gg6 s HIS 40 Ca 0.47 1.24 0.00 0.00 0.25 0.00 0.00 55.06 57.02 1gg6 s HIS 40 Cb -0.18 -3.40 0.00 0.00 -1.18 0.00 0.00 32.58 27.82 1gg6 s HIS 40 CO 0.18 -1.21 0.08 1.97 -0.65 0.00 0.00 174.74 175.10 1gg6 n PHE 41 N 5.44 0.00 -3.55 3.88 1.16 -0.30 -5.00 117.46 119.10 1gg6 n PHE 41 Ca 0.11 0.00 -0.07 0.00 -1.87 0.00 0.00 57.45 55.62 1gg6 n PHE 41 Cb 0.46 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.31 1gg6 n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1gg6 s GLY 43 N -2.52 1.77 0.12 0.00 0.00 -1.26 -0.36 107.32 105.07 1gg6 s GLY 43 Ca 0.07 -2.07 -0.26 0.00 0.00 0.00 0.00 44.72 42.46 1gg6 s GLY 43 CO -0.07 -1.69 0.91 -0.32 0.00 0.00 0.00 173.10 171.93 1gg6 s GLY 44 N -4.63 -0.30 -0.05 0.20 0.00 -0.84 -4.69 107.32 97.01 1gg6 s GLY 44 Ca 0.60 0.33 0.01 0.00 0.00 0.00 0.00 44.72 45.66 1gg6 s GLY 44 CO 0.38 0.09 -0.05 -0.56 0.00 0.00 0.00 173.10 172.95 1gg6 s SER 45 N -2.82 1.10 0.06 1.64 0.01 0.00 -1.15 113.70 112.54 1gg6 s SER 45 Ca 0.10 -0.14 -0.30 0.00 1.31 0.00 0.00 55.95 56.91 1gg6 s SER 45 Cb -0.02 -0.49 -0.05 0.00 0.21 0.00 0.00 66.02 65.67 1gg6 s SER 45 CO -0.01 -0.06 1.09 -0.76 0.41 0.00 0.00 173.24 173.91 1gg6 s LEU 46 N 1.00 4.40 0.00 2.44 1.43 -0.31 -0.27 118.68 127.36 1gg6 s LEU 46 Ca -0.10 1.88 0.12 0.00 -1.03 0.00 0.00 54.13 55.00 1gg6 s LEU 46 Cb -0.14 -3.58 -0.13 0.00 0.03 0.00 0.00 46.19 42.37 1gg6 s LEU 46 CO -0.00 -0.33 0.50 2.30 0.23 0.00 0.00 176.35 179.04 1gg6 n ILE 47 N 3.63 0.00 -3.97 -0.59 -5.35 -0.82 -1.50 119.36 110.76 1gg6 n ILE 47 Ca 0.07 -0.22 0.02 0.00 -0.27 0.00 0.00 62.75 62.34 1gg6 n ILE 47 Cb 0.48 1.00 0.01 0.00 -1.74 0.00 0.00 39.64 39.39 1gg6 n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1gg6 n ASN 48 N -1.27 -1.05 0.27 7.28 0.23 -1.24 -4.71 115.26 114.76 1gg6 n ASN 48 Ca 0.02 -1.27 0.18 0.00 -0.53 0.00 0.00 54.58 52.99 1gg6 n ASN 48 Cb 0.18 1.64 0.87 0.00 -2.08 0.00 0.00 39.78 40.39 1gg6 n ASN 48 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1gg6 h GLU 49 N 0.00 0.00 -0.00 -3.83 3.07 -1.97 -3.23 114.58 108.62 1gg6 h GLU 49 Ca -0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.68 1gg6 h GLU 49 Cb 0.99 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.90 1gg6 h GLU 49 CO 0.26 0.00 -0.05 0.09 -1.40 0.00 0.00 179.01 177.92 1gg6 n ASN 50 N -2.87 0.85 -4.06 1.42 3.02 -1.26 -0.19 115.26 112.16 1gg6 n ASN 50 Ca -0.01 -0.92 -0.20 0.00 -0.03 0.00 0.00 54.58 53.42 1gg6 n ASN 50 Cb 0.16 0.36 -0.15 0.00 -0.61 0.00 0.00 39.78 39.55 1gg6 n ASN 50 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1gg6 s TRP 51 N -0.62 1.00 -0.05 3.10 0.52 -1.22 -0.82 118.94 120.86 1gg6 s TRP 51 Ca 0.03 -0.21 0.05 0.00 0.02 0.00 0.00 56.10 55.99 1gg6 s TRP 51 Cb 0.02 -0.64 -0.01 0.00 -1.15 0.00 0.00 33.47 31.70 1gg6 s TRP 51 CO 0.06 -0.01 -0.21 0.08 0.02 0.00 0.00 176.95 176.89 1gg6 s VAL 52 N -0.33 1.71 -0.16 4.03 1.01 -0.41 -1.94 120.40 124.30 1gg6 s VAL 52 Ca 0.04 -0.88 -0.06 0.00 0.00 0.00 0.00 61.98 61.08 1gg6 s VAL 52 Cb -0.05 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.84 1gg6 s VAL 52 CO -0.00 0.48 0.05 0.68 0.00 0.00 0.00 175.10 176.31 1gg6 s VAL 53 N -0.08 4.70 0.10 2.92 -7.23 0.63 -0.56 120.40 120.87 1gg6 s VAL 53 Ca -0.03 -0.07 0.00 0.00 -1.81 0.00 0.00 61.98 60.07 1gg6 s VAL 53 Cb -0.12 -3.08 -0.00 0.00 0.56 0.00 0.00 36.38 33.73 1gg6 s VAL 53 CO 0.03 0.51 0.12 1.07 -0.31 0.00 0.00 175.10 176.52 1gg6 n THR 54 N 3.12 0.00 -3.32 5.32 5.66 -0.45 -0.82 114.28 123.79 1gg6 n THR 54 Ca -0.17 -0.57 -0.38 0.00 -3.05 0.00 0.00 64.05 59.88 1gg6 n THR 54 Cb 0.53 0.33 -0.06 0.00 -1.55 0.00 0.00 70.33 69.58 1gg6 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1gg6 s ALA 55 N -2.05 3.60 0.32 1.79 0.00 -1.26 -1.16 121.76 123.00 1gg6 s ALA 55 Ca 0.09 -0.04 0.02 0.00 0.00 0.00 0.00 51.96 52.03 1gg6 s ALA 55 Cb -0.00 -2.58 0.55 0.00 0.00 0.00 0.00 23.12 21.09 1gg6 s ALA 55 CO 0.07 0.42 1.89 0.00 0.00 0.00 0.00 175.76 178.14 1gg6 h ALA 56 N 4.27 1.36 0.00 0.00 0.00 -1.73 -2.27 119.26 120.89 1gg6 h ALA 56 Ca -0.50 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1gg6 h ALA 56 Cb 1.21 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1gg6 h ALA 56 CO 0.64 0.46 0.00 -2.39 0.00 0.00 0.00 179.25 177.96 1gg6 n HIS 57 N -4.31 0.00 0.64 0.00 1.44 -1.26 -1.90 115.22 109.83 1gg6 n HIS 57 Ca 0.03 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.84 1gg6 n HIS 57 Cb 0.20 -0.29 0.41 0.00 0.12 0.00 0.00 29.99 30.43 1gg6 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1gg6 n GLY 59 N 0.47 -0.48 3.77 0.00 0.00 -0.80 -4.92 105.19 103.23 1gg6 n GLY 59 Ca 0.04 0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1gg6 n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gg6 s VAL 60 N -3.24 2.36 0.35 1.61 1.01 -1.26 -5.05 120.40 116.18 1gg6 s VAL 60 Ca 0.65 0.34 0.04 0.00 0.00 0.00 0.00 61.98 63.01 1gg6 s VAL 60 Cb -0.34 -3.21 -0.06 0.00 0.00 0.00 0.00 36.38 32.78 1gg6 s VAL 60 CO 0.80 0.06 0.07 0.42 0.00 0.00 0.00 175.10 176.45 1gg6 s THR 61 N -1.19 1.10 -2.00 3.92 -4.23 -1.26 -4.97 115.64 107.01 1gg6 s THR 61 Ca 0.55 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.27 1gg6 s THR 61 Cb -0.42 -2.71 0.59 0.00 1.34 0.00 0.00 72.50 71.31 1gg6 s THR 61 CO 0.55 0.00 1.63 0.35 -0.54 0.00 0.00 174.62 176.61 1gg6 n THR 62 N -0.74 0.00 1.00 3.99 -2.24 -1.26 -1.85 114.28 113.18 1gg6 n THR 62 Ca -0.03 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.86 1gg6 n THR 62 Cb 0.66 -0.65 0.18 0.00 -2.10 0.00 0.00 70.33 68.42 1gg6 n THR 62 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1gg6 n SER 63 N -0.99 0.61 -4.94 3.42 3.41 -1.26 -4.56 113.62 109.32 1gg6 n SER 63 Ca 0.16 -0.41 -0.25 0.00 -0.26 0.00 0.00 58.87 58.11 1gg6 n SER 63 Cb 0.07 0.39 0.03 0.00 -0.26 0.00 0.00 64.21 64.45 1gg6 n SER 63 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1gg6 s ASP 64 N -2.99 5.48 0.09 4.04 1.01 -0.77 -3.87 116.67 119.67 1gg6 s ASP 64 Ca 0.11 0.44 0.06 0.00 0.71 0.00 0.00 52.55 53.86 1gg6 s ASP 64 Cb 0.17 -1.43 -0.03 0.00 1.01 0.00 0.00 42.92 42.64 1gg6 s ASP 64 CO 0.73 -1.06 -0.14 -0.69 0.21 0.00 0.00 175.17 174.21 1gg6 s VAL 65 N -2.88 1.23 -0.25 -1.27 1.01 0.06 -4.26 120.40 114.05 1gg6 s VAL 65 Ca 0.54 -1.50 -0.10 0.00 0.00 0.00 0.00 61.98 60.92 1gg6 s VAL 65 Cb -0.10 -1.30 -0.05 0.00 0.00 0.00 0.00 36.38 34.93 1gg6 s VAL 65 CO 0.42 -0.30 0.15 -0.69 0.00 0.00 0.00 175.10 174.68 1gg6 s VAL 66 N -1.66 5.18 -0.25 2.92 1.01 -0.28 -1.65 120.40 125.66 1gg6 s VAL 66 Ca 0.03 0.12 -0.04 0.00 0.00 0.00 0.00 61.98 62.09 1gg6 s VAL 66 Cb -0.08 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.88 1gg6 s VAL 66 CO 0.03 0.33 -0.00 -0.69 0.00 0.00 0.00 175.10 174.76 1gg6 s VAL 67 N 1.26 3.51 0.17 2.92 1.01 0.14 0.16 120.40 129.57 1gg6 s VAL 67 Ca 0.07 -0.65 0.06 0.00 0.00 0.00 0.00 61.98 61.46 1gg6 s VAL 67 Cb -0.14 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 1gg6 s VAL 67 CO 0.06 0.26 0.07 0.00 0.00 0.00 0.00 175.10 175.49 1gg6 s ALA 68 N 1.46 3.38 -0.26 5.51 0.00 -0.33 -1.22 121.76 130.31 1gg6 s ALA 68 Ca 0.04 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 50.69 1gg6 s ALA 68 Cb -0.16 -1.17 0.00 0.00 0.00 0.00 0.00 23.12 21.79 1gg6 s ALA 68 CO -0.01 0.48 0.00 0.41 0.00 0.00 0.00 175.76 176.64 1gg6 n GLY 69 N -0.26 0.58 3.89 0.00 0.00 -1.26 -1.12 105.19 107.02 1gg6 n GLY 69 Ca -0.09 -0.60 -0.32 0.00 0.00 0.00 0.00 46.02 45.01 1gg6 n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1gg6 s GLU 70 N -1.64 3.61 0.19 1.61 2.12 -1.26 -4.53 118.70 118.80 1gg6 s GLU 70 Ca 0.00 -0.09 0.00 0.00 0.36 0.00 0.00 54.97 55.24 1gg6 s GLU 70 Cb 0.00 -2.94 0.00 0.00 0.26 0.00 0.00 34.13 31.45 1gg6 s GLU 70 CO 0.00 0.53 0.00 0.34 -0.54 0.00 0.00 175.26 175.59 1gg6 n PHE 71 N 0.42 -1.31 -3.48 5.30 7.35 -1.26 -4.84 117.46 119.65 1gg6 n PHE 71 Ca -0.05 0.23 -0.43 0.00 -0.76 0.00 0.00 57.45 56.44 1gg6 n PHE 71 Cb 0.52 0.31 -0.08 0.00 0.35 0.00 0.00 39.48 40.57 1gg6 n PHE 71 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1gg6 s ASP 72 N -5.43 5.93 0.00 -2.13 -1.08 -1.26 -4.94 116.67 107.76 1gg6 s ASP 72 Ca 0.00 -1.43 0.16 0.00 -0.52 0.00 0.00 52.55 50.76 1gg6 s ASP 72 Cb 0.00 -2.10 0.75 0.00 -1.46 0.00 0.00 42.92 40.11 1gg6 s ASP 72 CO 0.00 -0.61 1.48 0.00 0.52 0.00 0.00 175.17 176.56 1gg6 n GLN 73 N 5.08 0.13 0.00 4.34 6.02 -1.26 -1.49 117.38 130.20 1gg6 n GLN 73 Ca -0.11 0.18 0.12 0.00 -0.01 0.00 0.00 57.00 57.17 1gg6 n GLN 73 Cb 0.43 -1.50 0.17 0.00 1.02 0.00 0.00 30.24 30.36 1gg6 n GLN 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1gg6 n GLY 74 N 0.09 0.70 3.89 1.08 0.00 -1.26 -4.93 105.19 104.76 1gg6 n GLY 74 Ca 0.06 -0.64 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 1gg6 n GLY 74 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gg6 s SER 75 N -2.06 6.43 0.00 1.61 0.15 -0.56 -4.99 113.70 114.28 1gg6 s SER 75 Ca 0.29 0.47 0.17 0.00 0.70 0.00 0.00 55.95 57.57 1gg6 s SER 75 Cb 0.20 -2.06 0.02 0.00 -1.71 0.00 0.00 66.02 62.47 1gg6 s SER 75 CO 0.34 0.31 0.90 -1.54 1.20 0.00 0.00 173.24 174.46 1gg6 n SER 76 N 1.39 1.80 -1.17 5.45 3.41 -1.26 -4.53 113.62 118.71 1gg6 n SER 76 Ca -0.14 -1.40 0.09 0.00 -0.26 0.00 0.00 58.87 57.15 1gg6 n SER 76 Cb 0.53 0.38 0.27 0.00 -0.26 0.00 0.00 64.21 65.14 1gg6 n SER 76 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1gg6 n SER 77 N 0.09 3.41 -4.85 4.04 3.41 -1.26 -4.92 113.62 113.54 1gg6 n SER 77 Ca 0.07 -2.11 -0.38 0.00 -0.26 0.00 0.00 58.87 56.20 1gg6 n SER 77 Cb 0.36 -0.43 -0.06 0.00 -0.26 0.00 0.00 64.21 63.82 1gg6 n SER 77 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1gg6 s GLU 78 N -1.39 3.80 -1.29 4.33 2.02 -1.26 -5.00 118.70 119.92 1gg6 s GLU 78 Ca 0.40 0.28 -0.12 0.00 0.02 0.00 0.00 54.97 55.55 1gg6 s GLU 78 Cb 0.22 -3.21 0.15 0.00 0.10 0.00 0.00 34.13 31.39 1gg6 s GLU 78 CO 0.25 0.71 1.80 1.63 0.02 0.00 0.00 175.26 179.67 1gg6 n LYS 79 N 1.87 3.43 -2.12 1.61 5.02 -1.26 -4.97 118.16 121.74 1gg6 n LYS 79 Ca -0.15 -3.48 -0.27 0.00 -2.02 0.00 0.00 58.31 52.38 1gg6 n LYS 79 Cb 0.53 -3.04 0.07 0.00 -0.02 0.00 0.00 35.03 32.57 1gg6 n LYS 79 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1gg6 s ILE 80 N 1.29 2.52 -0.24 -0.18 -0.00 -1.26 -4.89 121.20 118.45 1gg6 s ILE 80 Ca 0.42 -0.09 0.02 0.00 -0.00 0.00 0.00 60.65 61.00 1gg6 s ILE 80 Cb 0.07 -3.11 0.05 0.00 -0.00 0.00 0.00 42.46 39.47 1gg6 s ILE 80 CO -0.00 -0.13 -0.10 -1.10 -0.00 0.00 0.00 174.94 173.61 1gg6 s GLN 81 N -5.31 2.12 -0.56 0.37 -0.21 -0.27 -4.98 119.66 110.82 1gg6 s GLN 81 Ca 0.59 -1.15 -0.20 0.00 0.02 0.00 0.00 55.36 54.62 1gg6 s GLN 81 Cb -0.11 -2.73 0.07 0.00 1.00 0.00 0.00 33.01 31.24 1gg6 s GLN 81 CO 0.47 -0.53 0.75 0.21 -2.12 0.00 0.00 175.29 174.07 1gg6 s LYS 82 N 1.23 3.14 -0.17 2.91 2.20 -1.26 -1.19 119.74 126.59 1gg6 s LYS 82 Ca -0.06 -0.87 -0.07 0.00 -0.36 0.00 0.00 55.97 54.61 1gg6 s LYS 82 Cb -0.19 -4.15 -0.04 0.00 -1.51 0.00 0.00 37.83 31.94 1gg6 s LYS 82 CO -0.06 -1.43 0.07 -0.51 -0.36 0.00 0.00 175.35 173.05 1gg6 s LEU 83 N 3.10 3.89 0.48 5.43 1.43 0.12 -4.95 118.68 128.18 1gg6 s LEU 83 Ca 0.18 0.14 -0.20 0.00 -1.03 0.00 0.00 54.13 53.21 1gg6 s LEU 83 Cb -0.19 -1.98 -0.09 0.00 0.03 0.00 0.00 46.19 43.97 1gg6 s LEU 83 CO 0.12 0.21 1.02 -0.54 0.23 0.00 0.00 176.35 177.39 1gg6 s LYS 84 N 0.15 3.87 -0.27 1.70 1.02 -1.26 -1.13 119.74 123.83 1gg6 s LYS 84 Ca 0.05 1.32 -0.10 0.00 0.02 0.00 0.00 55.97 57.26 1gg6 s LYS 84 Cb -0.12 -2.11 -0.05 0.00 -0.52 0.00 0.00 37.83 35.03 1gg6 s LYS 84 CO 0.00 -0.36 0.16 0.42 -0.92 0.00 0.00 175.35 174.65 1gg6 s ILE 85 N -2.01 5.12 -0.03 2.17 1.01 -1.26 -1.32 121.20 124.87 1gg6 s ILE 85 Ca 0.66 0.10 -0.17 0.00 0.00 0.00 0.00 60.65 61.24 1gg6 s ILE 85 Cb -0.15 -3.42 -0.32 0.00 0.01 0.00 0.00 42.46 38.57 1gg6 s ILE 85 CO 0.19 0.28 0.84 0.00 0.00 0.00 0.00 174.94 176.24 1gg6 h ALA 86 N 8.24 -0.04 -2.82 9.38 0.00 -0.95 -3.44 119.26 129.65 1gg6 h ALA 86 Ca -0.36 -0.88 -0.14 0.00 0.00 0.00 0.00 54.91 53.52 1gg6 h ALA 86 Cb 1.19 0.24 -0.22 0.00 0.00 0.00 0.00 17.79 19.00 1gg6 h ALA 86 CO 0.57 0.65 -0.40 0.21 0.00 0.00 0.00 179.25 180.28 1gg6 s LYS 87 N -2.52 0.47 -0.23 0.00 2.20 -1.06 -4.98 119.74 113.63 1gg6 s LYS 87 Ca -0.14 -0.06 -0.03 0.00 -0.36 0.00 0.00 55.97 55.38 1gg6 s LYS 87 Cb 0.03 0.21 -0.00 0.00 -1.51 0.00 0.00 37.83 36.56 1gg6 s LYS 87 CO 0.86 -0.11 -0.04 0.08 -0.36 0.00 0.00 175.35 175.78 1gg6 s VAL 88 N -0.80 3.27 -0.46 4.02 1.01 -1.26 -1.33 120.40 124.85 1gg6 s VAL 88 Ca -0.09 -0.61 -0.05 0.00 0.00 0.00 0.00 61.98 61.22 1gg6 s VAL 88 Cb -0.05 -2.53 0.12 0.00 0.00 0.00 0.00 36.38 33.92 1gg6 s VAL 88 CO 0.02 0.37 0.28 -0.36 0.00 0.00 0.00 175.10 175.41 1gg6 s PHE 89 N 1.45 3.52 -0.19 5.22 0.40 0.34 -4.99 117.98 123.73 1gg6 s PHE 89 Ca 0.05 -2.24 -0.22 0.00 -0.60 0.00 0.00 56.93 53.92 1gg6 s PHE 89 Cb -0.15 -3.34 -0.02 0.00 0.51 0.00 0.00 43.02 40.02 1gg6 s PHE 89 CO -0.04 -0.97 0.69 0.21 0.70 0.00 0.00 175.22 175.81 1gg6 s LYS 90 N 1.10 4.23 -0.02 0.44 2.20 -1.26 -0.30 119.74 126.14 1gg6 s LYS 90 Ca 0.08 0.73 -0.36 0.00 -0.36 0.00 0.00 55.97 56.07 1gg6 s LYS 90 Cb -0.24 -3.58 -0.14 0.00 -1.51 0.00 0.00 37.83 32.37 1gg6 s LYS 90 CO -0.03 -0.27 1.67 -1.71 -0.36 0.00 0.00 175.35 174.65 1gg6 n ASN 91 N 5.11 2.84 0.29 1.43 2.85 -0.97 -4.81 115.26 121.99 1gg6 n ASN 91 Ca 0.00 1.05 0.18 0.00 -0.11 0.00 0.00 54.58 55.70 1gg6 n ASN 91 Cb 0.49 -1.32 0.98 0.00 1.24 0.00 0.00 39.78 41.17 1gg6 n ASN 91 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 1gg6 h SER 92 N 7.05 0.00 1.21 1.20 4.64 -1.94 0.55 113.55 126.25 1gg6 h SER 92 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1gg6 h SER 92 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1gg6 h SER 92 CO 0.90 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 177.15 1gg6 n LYS 93 N -3.54 0.22 -1.66 4.77 4.76 -1.26 -4.86 118.16 116.59 1gg6 n LYS 93 Ca -0.02 0.26 -0.47 0.00 -2.87 0.00 0.00 58.31 55.21 1gg6 n LYS 93 Cb 0.17 -1.79 -0.04 0.00 -1.84 0.00 0.00 35.03 31.52 1gg6 n LYS 93 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 1gg6 n TYR 94 N -2.18 2.20 -4.03 2.13 9.36 0.18 -4.70 117.16 120.13 1gg6 n TYR 94 Ca 0.05 0.28 -0.31 0.00 3.32 0.00 0.00 57.90 61.23 1gg6 n TYR 94 Cb 0.36 -2.53 -0.15 0.00 -0.63 0.00 0.00 39.34 36.39 1gg6 n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1gg6 s ASN 95 N 1.26 4.56 0.55 2.98 3.84 -0.43 -4.99 114.94 122.70 1gg6 s ASN 95 Ca 0.81 -1.77 0.34 0.00 0.21 0.00 0.00 52.86 52.45 1gg6 s ASN 95 Cb -0.71 -1.54 1.43 0.00 -0.55 0.00 0.00 41.25 39.88 1gg6 s ASN 95 CO 0.41 -0.29 2.01 0.77 -2.79 0.00 0.00 177.10 177.20 1gg6 h SER 96 N 7.71 0.00 1.06 -4.21 4.64 -1.93 0.42 113.55 121.25 1gg6 h SER 96 Ca -0.11 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.02 1gg6 h SER 96 Cb 1.03 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.09 1gg6 h SER 96 CO 0.49 0.02 -0.96 -0.07 -0.87 0.00 0.00 176.83 175.44 1gg6 h LEU 97 N 0.00 0.00 -0.91 5.97 3.38 -1.96 -3.26 115.31 118.52 1gg6 h LEU 97 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1gg6 h LEU 97 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1gg6 h LEU 97 CO 0.00 0.86 -0.24 0.35 0.09 0.00 0.00 178.44 179.51 1gg6 n THR 98 N -3.28 0.00 -3.86 0.22 -2.24 -1.15 -4.99 114.28 98.98 1gg6 n THR 98 Ca -0.01 -0.38 -0.28 0.00 -2.27 0.00 0.00 64.05 61.11 1gg6 n THR 98 Cb 0.90 1.17 0.03 0.00 -2.10 0.00 0.00 70.33 70.32 1gg6 n THR 98 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1gg6 n ILE 99 N -0.06 -2.67 -3.99 2.28 5.41 0.14 -4.98 119.36 115.49 1gg6 n ILE 99 Ca 0.06 -0.15 -0.30 0.00 1.00 0.00 0.00 62.75 63.36 1gg6 n ILE 99 Cb 0.28 -3.06 -0.05 0.00 -0.71 0.00 0.00 39.64 36.10 1gg6 n ILE 99 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1gg6 s ASN 100 N -3.61 5.95 -1.40 4.38 2.47 -0.53 -4.35 114.94 117.84 1gg6 s ASN 100 Ca 0.48 0.11 -0.07 0.00 0.42 0.00 0.00 52.86 53.79 1gg6 s ASN 100 Cb -0.24 -1.72 0.04 0.00 -1.45 0.00 0.00 41.25 37.88 1gg6 s ASN 100 CO 0.83 0.14 0.91 0.59 -3.72 0.00 0.00 177.10 175.85 1gg6 n ASN 101 N 0.17 -3.48 -3.73 -4.21 3.02 -1.26 -1.31 115.26 104.46 1gg6 n ASN 101 Ca -0.07 -0.75 -0.42 0.00 -0.03 0.00 0.00 54.58 53.31 1gg6 n ASN 101 Cb 0.52 -4.20 -0.04 0.00 -0.61 0.00 0.00 39.78 35.46 1gg6 n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1gg6 n ASP 102 N -2.96 3.05 -3.83 6.41 2.03 -1.26 -3.96 116.55 116.03 1gg6 n ASP 102 Ca -0.11 -2.74 -0.12 0.00 0.52 0.00 0.00 54.79 52.33 1gg6 n ASP 102 Cb 0.60 -1.34 -0.13 0.00 -0.72 0.00 0.00 41.12 39.53 1gg6 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1gg6 s ILE 103 N 4.67 0.00 0.01 5.18 2.07 -1.26 -3.34 121.20 128.52 1gg6 s ILE 103 Ca 0.54 -0.02 0.01 0.00 -1.41 0.00 0.00 60.65 59.78 1gg6 s ILE 103 Cb 0.13 -0.16 -0.01 0.00 0.13 0.00 0.00 42.46 42.55 1gg6 s ILE 103 CO 0.05 -0.01 -0.04 -0.89 -1.91 0.00 0.00 174.94 172.14 1gg6 s THR 104 N 0.03 0.29 -0.07 4.00 2.01 -0.31 -2.29 115.64 119.30 1gg6 s THR 104 Ca -0.00 -0.41 -0.00 0.00 0.31 0.00 0.00 61.69 61.58 1gg6 s THR 104 Cb -0.01 -0.30 -0.03 0.00 0.01 0.00 0.00 72.50 72.17 1gg6 s THR 104 CO 0.00 -0.09 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.06 1gg6 s LEU 105 N -0.54 3.42 -0.18 4.42 1.43 0.59 -1.34 118.68 126.48 1gg6 s LEU 105 Ca -0.03 0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 1gg6 s LEU 105 Cb -0.04 -1.80 0.01 0.00 0.03 0.00 0.00 46.19 44.39 1gg6 s LEU 105 CO -0.00 0.36 -0.18 -0.76 0.23 0.00 0.00 176.35 176.00 1gg6 s LEU 106 N -0.96 2.25 -0.23 1.79 1.43 0.27 -0.50 118.68 122.73 1gg6 s LEU 106 Ca 0.14 -0.60 -0.15 0.00 -1.03 0.00 0.00 54.13 52.49 1gg6 s LEU 106 Cb -0.11 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 1gg6 s LEU 106 CO 0.03 0.01 0.37 -0.75 0.23 0.00 0.00 176.35 176.25 1gg6 s LYS 107 N 1.22 4.11 0.42 1.70 2.20 -0.44 -1.29 119.74 127.66 1gg6 s LYS 107 Ca 0.03 0.11 -0.22 0.00 -0.36 0.00 0.00 55.97 55.52 1gg6 s LYS 107 Cb -0.14 -3.57 -0.10 0.00 -1.51 0.00 0.00 37.83 32.51 1gg6 s LYS 107 CO -0.09 -0.11 1.00 -0.51 -0.36 0.00 0.00 175.35 175.28 1gg6 s LEU 108 N 1.53 4.03 0.12 5.43 1.43 0.00 -0.38 118.68 130.84 1gg6 s LEU 108 Ca 0.17 1.88 -0.13 0.00 -1.03 0.00 0.00 54.13 55.01 1gg6 s LEU 108 Cb -0.15 -4.37 -0.05 0.00 0.03 0.00 0.00 46.19 41.65 1gg6 s LEU 108 CO 0.08 -0.47 1.47 0.28 0.23 0.00 0.00 176.35 177.94 1gg6 h SER 109 N 2.17 0.82 -3.89 2.29 0.02 -1.50 -3.41 113.55 110.05 1gg6 h SER 109 Ca -0.49 -0.43 -0.52 0.00 -0.84 0.00 0.00 61.79 59.52 1gg6 h SER 109 Cb 1.20 -0.23 -0.31 0.00 0.14 0.00 0.00 62.40 63.20 1gg6 h SER 109 CO 0.61 1.08 -0.82 -0.89 -1.14 0.00 0.00 176.83 175.68 1gg6 s THR 110 N -4.51 1.20 0.46 -2.27 2.01 -1.26 -4.99 115.64 106.28 1gg6 s THR 110 Ca -0.12 -0.60 -0.25 0.00 0.31 0.00 0.00 61.69 61.03 1gg6 s THR 110 Cb 0.10 -1.04 -0.08 0.00 0.01 0.00 0.00 72.50 71.48 1gg6 s THR 110 CO 0.84 0.35 1.41 0.00 -0.69 0.00 0.00 174.62 176.53 1gg6 n ALA 111 N 3.17 1.91 -1.72 7.40 0.00 -1.26 -4.85 120.51 125.16 1gg6 n ALA 111 Ca -0.18 0.24 -0.33 0.00 0.00 0.00 0.00 53.44 53.17 1gg6 n ALA 111 Cb 0.53 -2.37 -0.00 0.00 0.00 0.00 0.00 19.45 17.60 1gg6 n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gg6 s ALA 112 N -1.20 2.78 -0.47 0.00 0.00 0.73 -5.00 121.76 118.60 1gg6 s ALA 112 Ca 0.62 0.50 -0.16 0.00 0.00 0.00 0.00 51.96 52.91 1gg6 s ALA 112 Cb -0.45 -3.25 0.06 0.00 0.00 0.00 0.00 23.12 19.48 1gg6 s ALA 112 CO 0.57 -0.64 0.43 0.45 0.00 0.00 0.00 175.76 176.57 1gg6 s SER 113 N -2.44 6.16 0.43 0.00 0.15 -1.26 -4.82 113.70 111.92 1gg6 s SER 113 Ca 0.65 -1.19 -0.25 0.00 0.70 0.00 0.00 55.95 55.86 1gg6 s SER 113 Cb -0.17 -2.20 -0.08 0.00 -1.71 0.00 0.00 66.02 61.86 1gg6 s SER 113 CO 0.30 -0.68 1.30 -0.36 1.20 0.00 0.00 173.24 175.01 1gg6 s PHE 114 N 1.85 2.73 0.00 3.44 0.40 -1.26 -4.82 117.98 120.32 1gg6 s PHE 114 Ca 0.06 1.41 0.00 0.00 -0.60 0.00 0.00 56.93 57.80 1gg6 s PHE 114 Cb -0.23 -3.67 0.00 0.00 0.51 0.00 0.00 43.02 39.63 1gg6 s PHE 114 CO 0.08 -2.19 0.00 -1.13 0.70 0.00 0.00 175.22 172.68 1gg6 n SER 115 N -0.10 0.00 -0.15 1.36 3.41 0.77 -4.95 113.62 113.95 1gg6 n SER 115 Ca 0.05 -0.21 -0.04 0.00 -0.26 0.00 0.00 58.87 58.42 1gg6 n SER 115 Cb 0.44 0.00 0.16 0.00 -0.26 0.00 0.00 64.21 64.55 1gg6 n SER 115 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1gg6 h GLN 116 N 0.00 0.88 -0.06 4.33 4.20 -1.97 -3.06 115.11 119.43 1gg6 h GLN 116 Ca 0.00 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.52 1gg6 h GLN 116 Cb 0.00 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.65 1gg6 h GLN 116 CO 0.00 0.80 0.00 0.25 -0.67 0.00 0.00 178.83 179.21 1gg6 n THR 117 N -4.26 0.04 -3.64 -0.54 -2.24 -1.26 -4.85 114.28 97.53 1gg6 n THR 117 Ca 0.04 -0.50 -0.24 0.00 -2.27 0.00 0.00 64.05 61.08 1gg6 n THR 117 Cb 0.24 1.38 -0.17 0.00 -2.10 0.00 0.00 70.33 69.67 1gg6 n THR 117 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1gg6 s VAL 118 N -1.96 -0.05 0.34 2.28 1.01 -1.16 -4.26 120.40 116.60 1gg6 s VAL 118 Ca 0.30 0.03 -0.17 0.00 0.00 0.00 0.00 61.98 62.13 1gg6 s VAL 118 Cb 0.20 -0.45 0.06 0.00 0.00 0.00 0.00 36.38 36.19 1gg6 s VAL 118 CO 0.30 -0.10 0.84 -0.94 0.00 0.00 0.00 175.10 175.20 1gg6 s SER 119 N 2.13 -0.02 0.11 3.32 1.04 -1.05 -0.16 113.70 119.07 1gg6 s SER 119 Ca 0.03 -1.01 -0.05 0.00 0.48 0.00 0.00 55.95 55.40 1gg6 s SER 119 Cb -0.15 0.77 -0.05 0.00 0.10 0.00 0.00 66.02 66.69 1gg6 s SER 119 CO -0.07 -1.52 0.35 0.00 0.98 0.00 0.00 173.24 172.98 1gg6 s ALA 120 N -2.40 3.82 0.40 5.32 0.00 -1.26 -2.72 121.76 124.91 1gg6 s ALA 120 Ca 0.16 -0.57 -0.04 0.00 0.00 0.00 0.00 51.96 51.51 1gg6 s ALA 120 Cb -0.05 -2.10 -0.04 0.00 0.00 0.00 0.00 23.12 20.93 1gg6 s ALA 120 CO 0.10 0.68 0.67 0.54 0.00 0.00 0.00 175.76 177.74 1gg6 s VAL 121 N -1.57 4.99 0.32 0.00 0.11 -0.57 -4.90 120.40 118.78 1gg6 s VAL 121 Ca 0.38 -0.02 -0.11 0.00 -2.93 0.00 0.00 61.98 59.30 1gg6 s VAL 121 Cb -0.13 -3.83 -0.07 0.00 -1.53 0.00 0.00 36.38 30.82 1gg6 s VAL 121 CO 0.23 -0.64 0.67 0.00 -3.33 0.00 0.00 175.10 172.03 1gg6 s LEU 123 N -3.28 3.55 0.68 0.00 1.43 -1.26 -5.12 118.68 114.68 1gg6 s LEU 123 Ca 0.50 -0.04 -0.07 0.00 -1.03 0.00 0.00 54.13 53.49 1gg6 s LEU 123 Cb -0.11 -2.11 0.04 0.00 0.03 0.00 0.00 46.19 44.05 1gg6 s LEU 123 CO 0.24 0.25 1.00 -2.16 0.23 0.00 0.00 176.35 175.91 1gg6 s PRO 124 N -1.81 2.45 0.34 1.29 0.04 -1.26 -5.06 135.00 130.98 1gg6 s PRO 124 Ca 0.22 -0.10 -0.16 0.00 0.04 0.00 0.00 61.00 61.00 1gg6 s PRO 124 Cb -0.12 -2.17 -0.09 0.00 0.04 0.00 0.00 34.50 32.16 1gg6 s PRO 124 CO 0.13 -1.09 0.78 -1.12 0.04 0.00 0.00 177.00 175.74 1gg6 s SER 125 N -4.45 6.83 0.56 6.66 0.01 -1.26 -4.95 113.70 117.10 1gg6 s SER 125 Ca 0.58 1.37 0.25 0.00 1.31 0.00 0.00 55.95 59.46 1gg6 s SER 125 Cb -0.11 -2.41 1.48 0.00 0.21 0.00 0.00 66.02 65.20 1gg6 s SER 125 CO 0.46 -0.22 2.05 0.00 0.41 0.00 0.00 173.24 175.94 1gg6 h ALA 126 N 2.27 2.14 -0.08 1.44 0.00 -2.08 -1.21 119.26 121.74 1gg6 h ALA 126 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1gg6 h ALA 126 Cb 1.18 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1gg6 h ALA 126 CO 0.65 -0.42 0.00 -1.13 0.00 0.00 0.00 179.25 178.34 1gg6 n SER 127 N -4.14 1.79 -4.77 0.00 3.41 -1.26 -4.95 113.62 103.71 1gg6 n SER 127 Ca 0.05 -1.64 -0.41 0.00 -0.26 0.00 0.00 58.87 56.61 1gg6 n SER 127 Cb 0.43 -0.04 -0.02 0.00 -0.26 0.00 0.00 64.21 64.31 1gg6 n SER 127 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1gg6 s ASP 128 N -1.85 6.72 -0.19 4.04 1.01 -0.46 -5.01 116.67 120.93 1gg6 s ASP 128 Ca 0.35 2.72 -0.06 0.00 0.71 0.00 0.00 52.55 56.27 1gg6 s ASP 128 Cb 0.20 -2.65 -0.03 0.00 1.01 0.00 0.00 42.92 41.45 1gg6 s ASP 128 CO 0.31 -0.58 0.03 -0.62 0.21 0.00 0.00 175.17 174.51 1gg6 s ASP 129 N -0.37 5.18 -0.33 0.27 2.15 -1.26 -4.98 116.67 117.34 1gg6 s ASP 129 Ca 0.50 -0.08 0.04 0.00 0.43 0.00 0.00 52.55 53.44 1gg6 s ASP 129 Cb -0.41 -1.89 0.10 0.00 -0.30 0.00 0.00 42.92 40.42 1gg6 s ASP 129 CO 0.53 0.11 0.04 -0.36 -0.17 0.00 0.00 175.17 175.32 1gg6 s PHE 130 N 0.76 3.61 0.55 -5.34 0.08 -1.26 -5.10 117.98 111.27 1gg6 s PHE 130 Ca 0.02 -2.88 -0.20 0.00 0.12 0.00 0.00 56.93 53.99 1gg6 s PHE 130 Cb -0.14 -2.77 -0.05 0.00 -0.57 0.00 0.00 43.02 39.49 1gg6 s PHE 130 CO 0.02 -0.94 1.17 0.00 -0.10 0.00 0.00 175.22 175.38 1gg6 s ALA 131 N 0.96 2.69 0.34 5.36 0.00 -1.26 -4.98 121.76 124.86 1gg6 s ALA 131 Ca 0.09 0.93 -0.29 0.00 0.00 0.00 0.00 51.96 52.70 1gg6 s ALA 131 Cb -0.19 -3.41 -0.11 0.00 0.00 0.00 0.00 23.12 19.42 1gg6 s ALA 131 CO -0.09 -0.92 1.41 0.00 0.00 0.00 0.00 175.76 176.17 1gg6 s ALA 132 N -1.65 3.56 0.00 0.00 0.00 -1.26 -2.03 121.76 120.38 1gg6 s ALA 132 Ca 0.73 1.42 0.00 0.00 0.00 0.00 0.00 51.96 54.11 1gg6 s ALA 132 Cb -0.28 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.29 1gg6 s ALA 132 CO 0.31 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.64 1gg6 n GLY 133 N 0.88 2.64 3.74 0.00 0.00 -1.26 -5.05 105.19 106.13 1gg6 n GLY 133 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1gg6 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gg6 s THR 134 N -2.70 2.88 -0.19 2.61 2.01 -0.86 -4.98 115.64 114.41 1gg6 s THR 134 Ca 0.00 0.71 -0.17 0.00 0.31 0.00 0.00 61.69 62.54 1gg6 s THR 134 Cb 0.00 -3.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.02 1gg6 s THR 134 CO 0.00 0.10 0.45 -0.89 -0.69 0.00 0.00 174.62 173.59 1gg6 s THR 135 N 0.29 5.16 0.10 -0.82 2.01 -1.26 -5.05 115.64 116.07 1gg6 s THR 135 Ca 0.60 0.83 0.00 0.00 0.31 0.00 0.00 61.69 63.44 1gg6 s THR 135 Cb -0.40 -3.78 -0.00 0.00 0.01 0.00 0.00 72.50 68.33 1gg6 s THR 135 CO 0.39 0.23 0.01 0.00 -0.69 0.00 0.00 174.62 174.56 1gg6 s VAL 137 N -1.56 0.21 0.07 0.00 1.01 -1.26 -5.15 120.40 113.72 1gg6 s VAL 137 Ca 0.02 -0.35 0.07 0.00 0.00 0.00 0.00 61.98 61.72 1gg6 s VAL 137 Cb 0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 36.38 36.12 1gg6 s VAL 137 CO 0.01 -0.10 -0.20 0.28 0.00 0.00 0.00 175.10 175.09 1gg6 s THR 138 N -0.45 1.64 0.14 3.92 -1.32 -1.26 -5.15 115.64 113.16 1gg6 s THR 138 Ca -0.03 -1.33 0.03 0.00 -1.21 0.00 0.00 61.69 59.14 1gg6 s THR 138 Cb -0.04 -1.46 -0.04 0.00 -1.51 0.00 0.00 72.50 69.45 1gg6 s THR 138 CO -0.00 0.08 -0.05 0.42 -2.21 0.00 0.00 174.62 172.85 1gg6 s THR 139 N -0.96 0.85 0.00 5.08 -4.23 -1.26 -5.09 115.64 110.03 1gg6 s THR 139 Ca 0.06 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1gg6 s THR 139 Cb -0.09 -1.90 0.00 0.00 1.34 0.00 0.00 72.50 71.85 1gg6 s THR 139 CO 0.03 -0.69 0.00 0.61 -0.54 0.00 0.00 174.62 174.03 1gg6 n GLY 140 N -0.17 0.69 1.36 3.99 0.00 -1.26 -4.97 105.19 104.84 1gg6 n GLY 140 Ca -0.09 -1.25 -0.04 0.00 0.00 0.00 0.00 46.02 44.64 1gg6 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1gg6 n TRP 141 N -1.06 1.52 -1.36 1.61 8.01 -1.26 -4.67 117.44 120.24 1gg6 n TRP 141 Ca 0.00 -1.40 -0.29 0.00 -1.31 0.00 0.00 57.50 54.50 1gg6 n TRP 141 Cb 0.00 -0.54 0.18 0.00 -2.01 0.00 0.00 31.31 28.94 1gg6 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1gg6 s GLY 142 N -2.01 1.59 0.36 6.99 0.00 -1.26 -4.88 107.32 108.11 1gg6 s GLY 142 Ca 0.47 -0.66 -0.27 0.00 0.00 0.00 0.00 44.72 44.27 1gg6 s GLY 142 CO 0.05 0.02 1.10 1.04 0.00 0.00 0.00 173.10 175.31 1gg6 n LEU 143 N -4.14 2.65 -0.00 0.66 4.77 -1.26 -2.74 117.00 116.94 1gg6 n LEU 143 Ca 0.09 1.13 0.10 0.00 -0.03 0.00 0.00 56.01 57.29 1gg6 n LEU 143 Cb 0.59 -1.37 -0.12 0.00 -2.33 0.00 0.00 43.42 40.19 1gg6 n LEU 143 CO 0.53 -1.15 -0.09 0.35 -1.33 0.00 0.00 177.39 175.70 1gg6 n THR 144 N -0.02 0.00 -3.68 -5.08 -2.24 -1.26 -0.82 114.28 101.19 1gg6 n THR 144 Ca 0.08 -0.05 -0.11 0.00 -2.27 0.00 0.00 64.05 61.70 1gg6 n THR 144 Cb 0.36 0.95 -0.11 0.00 -2.10 0.00 0.00 70.33 69.42 1gg6 n THR 144 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1gg6 s ARG 145 N -2.94 0.27 0.00 -0.78 3.52 -1.26 -4.11 118.95 113.65 1gg6 s ARG 145 Ca 0.07 0.84 0.28 0.00 -0.13 0.00 0.00 55.73 56.78 1gg6 s ARG 145 Cb 0.15 0.09 1.67 0.00 -1.56 0.00 0.00 34.95 35.30 1gg6 s ARG 145 CO 0.83 -0.23 2.01 0.98 -0.81 0.00 0.00 175.30 178.08