#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i9b n ASP 12 N 0.00 -5.28 -4.51 0.00 2.03 -1.26 -4.93 116.55 102.60 2i9b n ASP 12 Ca 0.00 -0.99 -0.43 0.00 0.52 0.00 0.00 54.79 53.89 2i9b n ASP 12 Cb 0.00 -3.04 -0.07 0.00 -0.72 0.00 0.00 41.12 37.28 2i9b n ASP 12 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2i9b s LEU 14 N 2.59 1.50 -1.58 0.00 1.43 0.11 -4.26 118.68 118.47 2i9b s LEU 14 Ca 0.19 0.65 -0.13 0.00 -1.03 0.00 0.00 54.13 53.81 2i9b s LEU 14 Cb -0.15 -2.60 0.10 0.00 0.03 0.00 0.00 46.19 43.57 2i9b s LEU 14 CO 0.17 -3.42 0.79 0.59 0.23 0.00 0.00 176.35 174.71 2i9b n ASN 15 N -4.29 -3.25 0.00 2.29 5.03 -1.26 -1.92 115.26 111.86 2i9b n ASN 15 Ca 0.12 -0.92 0.00 0.00 0.87 0.00 0.00 54.58 54.65 2i9b n ASN 15 Cb 0.59 -3.26 0.00 0.00 -1.02 0.00 0.00 39.78 36.09 2i9b n ASN 15 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2i9b n GLY 16 N -1.60 2.85 3.55 7.41 0.00 -1.26 -4.75 105.19 111.39 2i9b n GLY 16 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2i9b n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i9b n GLY 17 N -1.59 -0.71 3.49 -0.02 0.00 -0.81 -4.93 105.19 100.64 2i9b n GLY 17 Ca 0.00 0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 2i9b n GLY 17 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2i9b s THR 18 N -1.38 2.24 -0.29 2.61 -4.23 -0.79 -4.59 115.64 109.20 2i9b s THR 18 Ca 0.65 -2.27 -0.18 0.00 -1.18 0.00 0.00 61.69 58.70 2i9b s THR 18 Cb -0.56 -2.47 -0.02 0.00 1.34 0.00 0.00 72.50 70.80 2i9b s THR 18 CO 0.56 -0.31 0.52 0.00 -0.54 0.00 0.00 174.62 174.86 2i9b s VAL 20 N 2.36 5.25 0.27 0.00 1.01 -0.89 -4.96 120.40 123.44 2i9b s VAL 20 Ca 0.21 -0.87 -0.09 0.00 0.00 0.00 0.00 61.98 61.22 2i9b s VAL 20 Cb -0.15 -3.78 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 2i9b s VAL 20 CO 0.11 -0.22 0.45 -0.94 0.00 0.00 0.00 175.10 174.49 2i9b s SER 21 N -3.63 0.16 -0.21 3.32 1.04 -1.26 -2.39 113.70 110.73 2i9b s SER 21 Ca 0.34 -1.12 -0.04 0.00 0.48 0.00 0.00 55.95 55.62 2i9b s SER 21 Cb -0.10 0.59 0.10 0.00 0.10 0.00 0.00 66.02 66.71 2i9b s SER 21 CO 0.29 -1.16 0.26 0.21 0.98 0.00 0.00 173.24 173.81 2i9b s ASN 22 N -3.09 1.14 0.35 7.02 3.84 -1.25 -5.03 114.94 117.93 2i9b s ASN 22 Ca 0.26 -0.14 0.16 0.00 0.21 0.00 0.00 52.86 53.36 2i9b s ASN 22 Cb 0.00 0.54 1.20 0.00 -0.55 0.00 0.00 41.25 42.44 2i9b s ASN 22 CO 0.12 -0.32 1.59 0.07 -2.79 0.00 0.00 177.10 175.77 2i9b h LYS 23 N 8.28 0.05 -0.18 0.43 2.10 -1.98 0.39 116.57 125.66 2i9b h LYS 23 Ca -0.18 -0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.29 2i9b h LYS 23 Cb 1.15 -0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.47 2i9b h LYS 23 CO 0.28 0.03 -0.64 1.88 -2.00 0.00 0.00 179.45 179.00 2i9b h TYR 24 N 0.05 0.85 -0.93 0.07 0.05 -2.02 -3.37 116.97 111.67 2i9b h TYR 24 Ca 0.78 -0.33 -0.73 0.00 0.05 0.00 0.00 58.73 58.50 2i9b h TYR 24 Cb 1.97 -0.15 -0.09 0.00 1.01 0.00 0.00 36.73 39.47 2i9b h TYR 24 CO -0.10 1.12 2.70 1.19 -1.05 0.00 0.00 178.16 182.02 2i9b n PHE 25 N -3.94 2.57 -1.18 4.88 3.01 0.14 -4.75 117.46 118.19 2i9b n PHE 25 Ca -0.05 -2.88 -0.07 0.00 1.01 0.00 0.00 57.45 55.47 2i9b n PHE 25 Cb 0.67 -1.97 -0.03 0.00 -0.01 0.00 0.00 39.48 38.14 2i9b n PHE 25 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2i9b n SER 26 N 2.10 -1.85 -0.62 4.37 2.88 -1.26 -2.14 113.62 117.10 2i9b n SER 26 Ca 0.66 0.17 -0.05 0.00 -1.33 0.00 0.00 58.87 58.32 2i9b n SER 26 Cb 0.24 -1.95 0.00 0.00 -0.75 0.00 0.00 64.21 61.75 2i9b n SER 26 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2i9b n ASN 27 N 0.25 -2.23 -4.85 -3.46 2.85 -1.24 -5.03 115.26 101.55 2i9b n ASN 27 Ca -0.07 -0.02 -0.31 0.00 -0.11 0.00 0.00 54.58 54.07 2i9b n ASN 27 Cb 0.23 -1.50 0.03 0.00 1.24 0.00 0.00 39.78 39.78 2i9b n ASN 27 CO 0.00 0.00 0.00 -0.51 -2.11 0.00 0.00 177.26 174.64 2i9b s ILE 28 N -2.35 4.15 0.03 -1.44 2.07 -0.91 -4.88 121.20 117.88 2i9b s ILE 28 Ca 0.02 0.70 0.05 0.00 -1.41 0.00 0.00 60.65 60.00 2i9b s ILE 28 Cb -0.01 -3.61 -0.02 0.00 0.13 0.00 0.00 42.46 38.96 2i9b s ILE 28 CO 0.02 -0.91 -0.14 -1.00 -1.91 0.00 0.00 174.94 171.00 2i9b s HIS 29 N -3.18 1.25 0.00 3.50 3.76 -1.26 -3.82 115.29 115.54 2i9b s HIS 29 Ca 0.57 -0.33 -0.00 0.00 -0.15 0.00 0.00 55.06 55.15 2i9b s HIS 29 Cb -0.12 -0.75 0.00 0.00 1.11 0.00 0.00 32.58 32.82 2i9b s HIS 29 CO 0.54 0.03 0.01 -2.67 -0.85 0.00 0.00 174.74 171.79 2i9b n TRP 30 N 2.04 -0.73 -4.63 1.40 2.14 -1.00 -5.03 117.44 111.63 2i9b n TRP 30 Ca -0.17 -0.02 -0.27 0.00 2.07 0.00 0.00 57.50 59.10 2i9b n TRP 30 Cb 0.55 0.01 -0.14 0.00 -0.81 0.00 0.00 31.31 30.92 2i9b n TRP 30 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2i9b s ASN 32 N -1.40 5.77 0.06 0.00 0.02 0.19 -4.91 114.94 114.68 2i9b s ASN 32 Ca 0.09 -1.88 -0.25 0.00 -1.02 0.00 0.00 52.86 49.81 2i9b s ASN 32 Cb -0.09 -2.04 -0.06 0.00 0.02 0.00 0.00 41.25 39.08 2i9b s ASN 32 CO 0.03 -0.71 0.75 0.00 0.02 0.00 0.00 177.10 177.19 2i9b n PRO 34 N 2.56 1.40 -0.21 0.00 -0.04 -1.26 -4.76 135.00 132.69 2i9b n PRO 34 Ca -0.03 0.52 0.21 0.00 -0.04 0.00 0.00 63.50 64.15 2i9b n PRO 34 Cb 0.50 -2.39 0.38 0.00 -0.04 0.00 0.00 33.50 31.95 2i9b n PRO 34 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2i9b n LYS 35 N -0.90 -0.04 0.17 0.54 0.00 -1.26 0.28 118.16 116.95 2i9b n LYS 35 Ca 0.11 0.88 0.02 0.00 0.00 0.00 0.00 58.31 59.32 2i9b n LYS 35 Cb 0.45 -1.58 0.32 0.00 0.00 0.00 0.00 35.03 34.21 2i9b n LYS 35 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 2i9b h LYS 36 N 0.00 0.00 -6.19 1.64 1.79 -1.88 -3.46 116.57 108.47 2i9b h LYS 36 Ca 0.54 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 58.47 2i9b h LYS 36 Cb 1.45 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 32.02 2i9b h LYS 36 CO -0.48 0.43 -0.60 -0.06 -1.08 0.00 0.00 179.45 177.65 2i9b s PHE 37 N -4.05 2.80 0.36 -1.35 0.40 0.14 -2.51 117.98 113.76 2i9b s PHE 37 Ca -0.02 -0.21 -0.06 0.00 -0.60 0.00 0.00 56.93 56.03 2i9b s PHE 37 Cb 0.14 -1.30 0.02 0.00 0.51 0.00 0.00 43.02 42.39 2i9b s PHE 37 CO 0.73 0.56 0.57 0.20 0.70 0.00 0.00 175.22 177.98 2i9b s GLY 38 N -3.74 1.16 0.00 4.36 0.00 -0.14 -4.51 107.32 104.45 2i9b s GLY 38 Ca 0.33 -1.29 0.00 0.00 0.00 0.00 0.00 44.72 43.75 2i9b s GLY 38 CO 0.21 -0.79 0.00 0.61 0.00 0.00 0.00 173.10 173.13 2i9b n GLY 39 N -0.56 1.97 0.38 0.20 0.00 -1.26 -0.31 105.19 105.60 2i9b n GLY 39 Ca -0.02 -1.93 0.19 0.00 0.00 0.00 0.00 46.02 44.26 2i9b n GLY 39 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2i9b h GLN 40 N 0.00 0.00 0.00 1.61 4.15 -1.98 -1.31 115.11 117.58 2i9b h GLN 40 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2i9b h GLN 40 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 2i9b h GLN 40 CO 0.00 0.00 -0.02 0.72 -1.93 0.00 0.00 178.83 177.60 2i9b n HIS 41 N -3.38 0.00 -1.13 3.99 8.25 -1.26 -4.47 115.22 117.22 2i9b n HIS 41 Ca 0.05 -0.38 -0.04 0.00 -0.26 0.00 0.00 57.72 57.08 2i9b n HIS 41 Cb 0.62 -0.05 -0.02 0.00 1.12 0.00 0.00 29.99 31.67 2i9b n HIS 41 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2i9b n GLU 43 N -2.26 1.10 -4.00 0.00 -0.00 -0.93 -4.15 120.64 110.40 2i9b n GLU 43 Ca -0.04 -0.10 -0.33 0.00 -0.00 0.00 0.00 57.16 56.68 2i9b n GLU 43 Cb 0.22 -1.29 -0.14 0.00 -0.00 0.00 0.00 31.44 30.23 2i9b n GLU 43 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2i9b s ILE 44 N -1.49 2.51 -1.11 3.84 -1.09 0.57 -4.87 121.20 119.57 2i9b s ILE 44 Ca 0.02 -1.64 -0.25 0.00 -2.23 0.00 0.00 60.65 56.54 2i9b s ILE 44 Cb 0.01 -2.51 -0.17 0.00 -1.58 0.00 0.00 42.46 38.21 2i9b s ILE 44 CO 0.01 -0.14 2.02 -0.67 -1.23 0.00 0.00 174.94 174.92 2i9b n ASP 45 N 4.48 2.18 -2.80 3.58 -0.08 0.80 -0.97 116.55 123.74 2i9b n ASP 45 Ca -0.11 -2.59 -0.15 0.00 -1.51 0.00 0.00 54.79 50.42 2i9b n ASP 45 Cb 0.42 -1.70 -0.04 0.00 2.34 0.00 0.00 41.12 42.14 2i9b n ASP 45 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 2i9b n LYS 46 N 8.18 1.60 0.20 -0.67 4.81 -1.05 -3.49 118.16 127.74 2i9b n LYS 46 Ca 0.43 -1.05 0.00 0.00 -0.87 0.00 0.00 58.31 56.82 2i9b n LYS 46 Cb 0.47 -2.16 0.00 0.00 0.02 0.00 0.00 35.03 33.35 2i9b n LYS 46 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2i9b n SER 47 N 3.66 -3.62 -4.52 3.14 2.88 -1.25 -4.64 113.62 109.27 2i9b n SER 47 Ca 0.34 0.82 -0.35 0.00 -1.33 0.00 0.00 58.87 58.36 2i9b n SER 47 Cb 0.26 3.43 0.10 0.00 -0.75 0.00 0.00 64.21 67.25 2i9b n SER 47 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2i9b n LYS 48 N -3.35 0.12 0.00 -1.46 4.81 -1.23 -4.98 118.16 112.07 2i9b n LYS 48 Ca 0.00 0.09 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 2i9b n LYS 48 Cb 0.00 -2.01 0.00 0.00 0.02 0.00 0.00 35.03 33.04 2i9b n LYS 48 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2i9b n THR 49 N -2.96 0.23 -3.56 3.15 -2.24 -1.26 -4.74 114.28 102.90 2i9b n THR 49 Ca 0.10 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 2i9b n THR 49 Cb 0.51 1.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.88 2i9b n THR 49 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2i9b s TYR 51 N -4.98 0.22 0.04 0.00 -0.85 -0.90 -4.92 117.35 105.96 2i9b s TYR 51 Ca 0.00 -0.48 0.00 0.00 -0.52 0.00 0.00 57.07 56.07 2i9b s TYR 51 Cb 0.00 -0.16 -0.04 0.00 0.38 0.00 0.00 41.96 42.14 2i9b s TYR 51 CO 0.00 -0.28 0.14 -1.21 -1.52 0.00 0.00 175.55 172.68 2i9b s GLU 52 N -2.01 3.21 3.95 -3.49 0.41 -1.26 -1.63 118.70 117.88 2i9b s GLU 52 Ca -0.10 -0.49 0.00 0.00 -0.41 0.00 0.00 54.97 53.97 2i9b s GLU 52 Cb -0.05 -2.93 0.00 0.00 -1.78 0.00 0.00 34.13 29.37 2i9b s GLU 52 CO -0.02 0.62 0.00 0.41 -0.49 0.00 0.00 175.26 175.78 2i9b n GLY 53 N 0.67 3.16 0.01 -1.39 0.00 -1.26 -0.72 105.19 105.66 2i9b n GLY 53 Ca -0.09 0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.16 2i9b n GLY 53 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2i9b n ASN 54 N 4.22 0.53 -1.44 1.61 2.04 -1.26 -4.91 115.26 116.06 2i9b n ASN 54 Ca 0.00 -0.19 -0.09 0.00 -0.44 0.00 0.00 54.58 53.87 2i9b n ASN 54 Cb 0.00 0.26 0.02 0.00 -2.53 0.00 0.00 39.78 37.53 2i9b n ASN 54 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2i9b n GLY 55 N 1.47 0.27 0.00 4.83 0.00 0.10 -3.85 105.19 108.02 2i9b n GLY 55 Ca 0.05 -0.40 0.11 0.00 0.00 0.00 0.00 46.02 45.78 2i9b n GLY 55 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2i9b n HIS 56 N -3.64 0.00 0.01 1.61 1.44 -1.26 -2.07 115.22 111.32 2i9b n HIS 56 Ca -0.03 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.70 2i9b n HIS 56 Cb 0.54 -0.47 -0.10 0.00 0.12 0.00 0.00 29.99 30.08 2i9b n HIS 56 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 2i9b n PHE 57 N -1.47 0.61 -1.55 -1.40 3.72 -1.26 -4.81 117.46 111.30 2i9b n PHE 57 Ca 0.06 0.20 -0.53 0.00 -0.05 0.00 0.00 57.45 57.13 2i9b n PHE 57 Cb 0.25 -0.93 -0.07 0.00 -0.94 0.00 0.00 39.48 37.79 2i9b n PHE 57 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 2i9b n TYR 58 N -2.70 1.81 -2.74 1.38 9.36 -0.88 -4.88 117.16 118.51 2i9b n TYR 58 Ca -0.11 0.37 -0.19 0.00 3.32 0.00 0.00 57.90 61.29 2i9b n TYR 58 Cb 0.80 -2.51 -0.00 0.00 -0.63 0.00 0.00 39.34 37.00 2i9b n TYR 58 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2i9b n ARG 59 N 7.02 2.14 -4.08 2.98 1.74 -1.26 -4.76 116.66 120.44 2i9b n ARG 59 Ca 0.35 -3.91 -0.26 0.00 -0.77 0.00 0.00 57.85 53.26 2i9b n ARG 59 Cb 0.18 -1.79 -0.04 0.00 -1.02 0.00 0.00 32.46 29.80 2i9b n ARG 59 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2i9b s GLY 60 N -3.18 2.45 -0.07 -0.13 0.00 -1.26 -0.14 107.32 104.98 2i9b s GLY 60 Ca 0.39 -1.46 0.03 0.00 0.00 0.00 0.00 44.72 43.68 2i9b s GLY 60 CO -0.08 -1.95 0.89 0.28 0.00 0.00 0.00 173.10 172.24 2i9b n LYS 61 N -1.49 1.74 -2.58 2.90 5.02 -1.26 -4.34 118.16 118.14 2i9b n LYS 61 Ca -0.04 -0.71 -0.37 0.00 -2.02 0.00 0.00 58.31 55.17 2i9b n LYS 61 Cb 0.65 -1.58 -0.05 0.00 -0.02 0.00 0.00 35.03 34.03 2i9b n LYS 61 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2i9b s ALA 62 N -1.24 3.17 0.00 7.82 0.00 -1.26 -4.92 121.76 125.33 2i9b s ALA 62 Ca 0.13 0.70 0.00 0.00 0.00 0.00 0.00 51.96 52.78 2i9b s ALA 62 Cb 0.10 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.96 2i9b s ALA 62 CO 0.03 -0.12 0.55 -1.13 0.00 0.00 0.00 175.76 175.10 2i9b n SER 63 N 0.30 0.00 -4.43 0.00 3.41 -1.26 -0.83 113.62 110.81 2i9b n SER 63 Ca 0.03 -1.28 -0.32 0.00 -0.26 0.00 0.00 58.87 57.04 2i9b n SER 63 Cb 0.49 -0.06 -0.14 0.00 -0.26 0.00 0.00 64.21 64.24 2i9b n SER 63 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2i9b s THR 64 N 0.00 2.75 0.56 6.66 -1.32 -1.26 -0.96 115.64 122.06 2i9b s THR 64 Ca 0.00 -0.89 -0.04 0.00 -1.21 0.00 0.00 61.69 59.55 2i9b s THR 64 Cb 0.00 -2.06 0.12 0.00 -1.51 0.00 0.00 72.50 69.05 2i9b s THR 64 CO 0.00 0.56 0.76 -0.90 -2.21 0.00 0.00 174.62 172.83 2i9b n ASP 65 N 2.24 0.64 -1.73 8.08 3.85 -1.13 0.06 116.55 128.57 2i9b n ASP 65 Ca -0.17 -1.63 -0.00 0.00 -0.71 0.00 0.00 54.79 52.28 2i9b n ASP 65 Cb 0.52 -0.53 -0.00 0.00 -1.35 0.00 0.00 41.12 39.76 2i9b n ASP 65 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 2i9b n THR 66 N -2.68 1.19 0.00 2.12 -2.24 -1.14 -1.31 114.28 110.22 2i9b n THR 66 Ca 0.11 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2i9b n THR 66 Cb 0.40 -1.31 0.00 0.00 -2.10 0.00 0.00 70.33 67.32 2i9b n THR 66 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2i9b n MET 67 N 1.75 1.48 -0.06 -0.78 2.81 -1.26 -5.03 117.12 116.03 2i9b n MET 67 Ca 0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 2i9b n MET 67 Cb 0.30 -0.23 0.00 0.00 -0.71 0.00 0.00 33.22 32.58 2i9b n MET 67 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2i9b n GLY 68 N -0.02 0.97 3.63 3.03 0.00 -0.43 -5.07 105.19 107.31 2i9b n GLY 68 Ca 0.00 -0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2i9b n GLY 68 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i9b s ARG 69 N -0.90 4.13 0.53 1.61 0.52 -1.26 -4.79 118.95 118.79 2i9b s ARG 69 Ca 0.00 0.64 -0.22 0.00 -0.52 0.00 0.00 55.73 55.63 2i9b s ARG 69 Cb 0.00 -3.64 -0.06 0.00 0.52 0.00 0.00 34.95 31.77 2i9b s ARG 69 CO 0.00 -0.43 1.27 -0.35 0.02 0.00 0.00 175.30 175.82 2i9b n PRO 70 N 5.74 1.59 -1.72 3.54 -0.04 -1.26 -2.82 135.00 140.03 2i9b n PRO 70 Ca 0.01 0.58 -0.30 0.00 -0.04 0.00 0.00 63.50 63.75 2i9b n PRO 70 Cb 0.49 -2.46 0.07 0.00 -0.04 0.00 0.00 33.50 31.56 2i9b n PRO 70 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2i9b s LEU 72 N -5.60 4.51 0.33 0.00 1.43 -0.47 -4.85 118.68 114.03 2i9b s LEU 72 Ca 0.60 1.44 -0.29 0.00 -1.03 0.00 0.00 54.13 54.85 2i9b s LEU 72 Cb -0.13 -3.14 -0.12 0.00 0.03 0.00 0.00 46.19 42.83 2i9b s LEU 72 CO 0.53 0.14 1.42 -2.65 0.23 0.00 0.00 176.35 176.02 2i9b n PRO 73 N 2.21 2.38 0.04 1.29 -0.02 -1.26 -4.59 135.00 135.05 2i9b n PRO 73 Ca -0.06 0.84 0.06 0.00 -2.02 0.00 0.00 63.50 62.32 2i9b n PRO 73 Cb 0.50 -2.51 0.26 0.00 -0.02 0.00 0.00 33.50 31.73 2i9b n PRO 73 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2i9b n TRP 74 N 0.90 0.22 0.66 6.00 7.02 0.60 -1.78 117.44 131.06 2i9b n TRP 74 Ca 0.05 0.10 0.07 0.00 -1.02 0.00 0.00 57.50 56.71 2i9b n TRP 74 Cb 0.36 -0.66 -0.01 0.00 -2.42 0.00 0.00 31.31 28.58 2i9b n TRP 74 CO 0.00 0.00 0.00 0.27 -2.02 0.00 0.00 177.69 175.94 2i9b n ASN 75 N -1.71 1.42 -4.76 -0.99 0.23 -1.26 0.87 115.26 109.06 2i9b n ASN 75 Ca 0.01 -1.21 -0.39 0.00 -0.53 0.00 0.00 54.58 52.46 2i9b n ASN 75 Cb 0.09 0.54 0.01 0.00 -2.08 0.00 0.00 39.78 38.35 2i9b n ASN 75 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2i9b s SER 76 N -1.87 5.92 0.24 0.53 1.04 -0.74 -4.78 113.70 114.04 2i9b s SER 76 Ca 0.11 2.67 0.02 0.00 0.48 0.00 0.00 55.95 59.23 2i9b s SER 76 Cb 0.12 -2.63 0.59 0.00 0.10 0.00 0.00 66.02 64.19 2i9b s SER 76 CO 0.40 -1.12 1.19 0.00 0.98 0.00 0.00 173.24 174.70 2i9b n ALA 77 N -0.35 0.39 0.09 5.32 0.00 -1.26 -1.17 120.51 123.52 2i9b n ALA 77 Ca 0.06 0.82 -0.13 0.00 0.00 0.00 0.00 53.44 54.19 2i9b n ALA 77 Cb 0.44 -0.60 -0.09 0.00 0.00 0.00 0.00 19.45 19.20 2i9b n ALA 77 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2i9b h THR 78 N 0.00 1.51 -0.60 0.00 2.02 -1.94 -3.09 112.91 110.81 2i9b h THR 78 Ca 0.46 -2.91 -0.04 0.00 0.77 0.00 0.00 66.41 64.69 2i9b h THR 78 Cb 0.96 2.75 -0.03 0.00 -1.74 0.00 0.00 68.15 70.09 2i9b h THR 78 CO -0.71 0.85 0.21 0.58 0.37 0.00 0.00 175.52 176.81 2i9b h VAL 79 N 0.10 1.22 0.00 3.16 2.07 -1.43 -0.54 116.25 120.83 2i9b h VAL 79 Ca -0.09 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.70 2i9b h VAL 79 Cb 1.79 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 2i9b h VAL 79 CO 0.17 0.28 0.00 0.18 0.02 0.00 0.00 177.57 178.23 2i9b n LEU 80 N -4.30 0.00 -0.08 2.57 4.77 -0.84 -0.14 117.00 118.98 2i9b n LEU 80 Ca 0.05 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.08 2i9b n LEU 80 Cb 0.19 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.24 2i9b n LEU 80 CO 0.39 0.00 0.06 0.00 -1.33 0.00 0.00 177.39 176.51 2i9b n GLN 81 N -0.96 3.09 -2.68 3.23 1.13 -0.22 -4.98 117.38 115.99 2i9b n GLN 81 Ca 0.06 -0.21 -0.21 0.00 -1.94 0.00 0.00 57.00 54.69 2i9b n GLN 81 Cb 0.03 -1.03 0.05 0.00 0.11 0.00 0.00 30.24 29.40 2i9b n GLN 81 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2i9b s GLN 82 N -1.79 2.39 0.23 -1.09 -1.52 0.80 -5.02 119.66 113.65 2i9b s GLN 82 Ca 0.06 -0.93 -0.02 0.00 -1.95 0.00 0.00 55.36 52.51 2i9b s GLN 82 Cb 0.08 -2.49 0.23 0.00 -0.22 0.00 0.00 33.01 30.61 2i9b s GLN 82 CO 0.37 -0.83 1.62 1.79 -0.25 0.00 0.00 175.29 177.99 2i9b h THR 83 N 0.01 1.28 -3.63 -0.19 1.35 -1.94 -3.41 112.91 106.39 2i9b h THR 83 Ca -0.40 -1.44 -0.69 0.00 -0.55 0.00 0.00 66.41 63.33 2i9b h THR 83 Cb 1.29 1.40 -0.24 0.00 -1.73 0.00 0.00 68.15 68.87 2i9b h THR 83 CO 0.49 0.46 -0.56 -0.31 -0.25 0.00 0.00 175.52 175.35 2i9b s TYR 84 N -4.41 3.20 0.11 4.73 2.02 -1.26 -5.00 117.35 116.73 2i9b s TYR 84 Ca -0.08 -0.80 -0.02 0.00 -0.37 0.00 0.00 57.07 55.80 2i9b s TYR 84 Cb 0.13 -2.36 -0.03 0.00 -0.40 0.00 0.00 41.96 39.29 2i9b s TYR 84 CO 0.82 -0.55 0.06 -3.38 -1.57 0.00 0.00 175.55 170.94 2i9b s HIS 85 N 1.57 0.67 -1.29 2.71 -3.43 -1.26 -4.80 115.29 109.45 2i9b s HIS 85 Ca 0.03 -1.10 0.16 0.00 -0.80 0.00 0.00 55.06 53.35 2i9b s HIS 85 Cb -0.18 -0.38 0.75 0.00 -1.43 0.00 0.00 32.58 31.34 2i9b s HIS 85 CO 0.06 -0.50 1.47 0.00 -2.00 0.00 0.00 174.74 173.76 2i9b n ALA 86 N -0.05 1.82 1.05 -1.38 0.00 0.25 -2.47 120.51 119.74 2i9b n ALA 86 Ca -0.09 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.40 2i9b n ALA 86 Cb 0.63 -1.26 0.23 0.00 0.00 0.00 0.00 19.45 19.05 2i9b n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2i9b n HIS 87 N -1.36 0.00 -1.65 0.00 8.25 -1.26 -4.81 115.22 114.39 2i9b n HIS 87 Ca 0.06 0.00 -0.46 0.00 -0.26 0.00 0.00 57.72 57.06 2i9b n HIS 87 Cb 0.14 -0.19 -0.03 0.00 1.12 0.00 0.00 29.99 31.03 2i9b n HIS 87 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2i9b n ARG 88 N -1.29 1.82 -0.37 -0.41 1.74 -1.03 -4.84 116.66 112.28 2i9b n ARG 88 Ca 0.07 0.65 0.30 0.00 -0.77 0.00 0.00 57.85 58.09 2i9b n ARG 88 Cb 0.34 -2.27 0.59 0.00 -1.02 0.00 0.00 32.46 30.10 2i9b n ARG 88 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2i9b h SER 89 N 4.09 0.31 -0.02 0.55 0.87 -1.92 0.34 113.55 117.76 2i9b h SER 89 Ca -0.45 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 2i9b h SER 89 Cb 1.29 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.30 2i9b h SER 89 CO 0.75 -0.01 -0.26 -0.90 -0.53 0.00 0.00 176.83 175.87 2i9b n ASP 90 N -4.57 2.38 -0.57 6.23 3.85 -1.26 -4.73 116.55 117.88 2i9b n ASP 90 Ca 0.30 -1.69 0.43 0.00 -0.71 0.00 0.00 54.79 53.12 2i9b n ASP 90 Cb 1.13 0.28 0.68 0.00 -1.35 0.00 0.00 41.12 41.85 2i9b n ASP 90 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2i9b n ALA 91 N 0.53 1.54 -0.04 2.12 0.00 0.11 -0.38 120.51 124.39 2i9b n ALA 91 Ca 0.11 0.58 -0.15 0.00 0.00 0.00 0.00 53.44 53.98 2i9b n ALA 91 Cb 0.50 -0.95 -0.08 0.00 0.00 0.00 0.00 19.45 18.92 2i9b n ALA 91 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2i9b h LEU 92 N 0.00 0.48 -0.88 0.00 5.85 -1.82 0.74 115.31 119.68 2i9b h LEU 92 Ca 0.79 -0.61 -0.05 0.00 0.84 0.00 0.00 57.88 58.85 2i9b h LEU 92 Cb 3.08 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 43.96 2i9b h LEU 92 CO -0.07 1.00 -0.26 0.06 -0.34 0.00 0.00 178.44 178.84 2i9b h GLN 93 N -0.01 0.00 -0.03 1.25 3.07 -1.07 -1.64 115.11 116.66 2i9b h GLN 93 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.73 2i9b h GLN 93 Cb 0.96 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.52 2i9b h GLN 93 CO 0.07 0.26 0.00 1.28 0.09 0.00 0.00 178.83 180.53 2i9b n LEU 94 N -3.35 0.86 -1.34 0.06 4.77 -1.02 -4.92 117.00 112.06 2i9b n LEU 94 Ca 0.01 -0.31 -0.16 0.00 -0.03 0.00 0.00 56.01 55.52 2i9b n LEU 94 Cb 0.48 -0.02 -0.05 0.00 -2.33 0.00 0.00 43.42 41.50 2i9b n LEU 94 CO 0.34 0.15 -0.16 0.61 -1.33 0.00 0.00 177.39 177.01 2i9b n GLY 95 N 1.07 1.13 3.87 -0.72 0.00 -0.62 -4.75 105.19 105.16 2i9b n GLY 95 Ca 0.20 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 2i9b n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i9b s LEU 96 N -3.79 4.24 0.00 0.99 1.43 0.25 -4.98 118.68 116.82 2i9b s LEU 96 Ca 0.00 0.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.00 2i9b s LEU 96 Cb 0.00 -3.44 0.00 0.00 0.03 0.00 0.00 46.19 42.78 2i9b s LEU 96 CO 0.00 0.02 0.00 0.61 0.23 0.00 0.00 176.35 177.21 2i9b n GLY 97 N 0.25 0.91 3.46 -3.19 0.00 -1.26 -4.15 105.19 101.22 2i9b n GLY 97 Ca -0.02 -0.82 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 2i9b n GLY 97 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2i9b n LYS 98 N 0.00 1.83 -3.85 1.61 5.02 -1.26 -3.91 118.16 117.60 2i9b n LYS 98 Ca 0.00 -2.46 0.02 0.00 -2.02 0.00 0.00 58.31 53.85 2i9b n LYS 98 Cb 0.00 -3.52 0.01 0.00 -0.02 0.00 0.00 35.03 31.50 2i9b n LYS 98 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 2i9b n HIS 99 N 11.97 -0.39 -2.40 2.13 1.44 -1.26 -5.02 115.22 121.69 2i9b n HIS 99 Ca 0.47 -0.68 -0.14 0.00 -2.01 0.00 0.00 57.72 55.36 2i9b n HIS 99 Cb 0.45 0.31 0.03 0.00 0.12 0.00 0.00 29.99 30.90 2i9b n HIS 99 CO 0.00 0.00 0.00 0.27 -2.81 0.00 0.00 176.34 173.80 2i9b n ASN 100 N -1.03 3.42 -4.82 4.39 6.94 -1.26 -0.29 115.26 122.61 2i9b n ASN 100 Ca 0.04 -3.01 -0.35 0.00 -0.02 0.00 0.00 54.58 51.24 2i9b n ASN 100 Cb 0.54 -0.41 -0.06 0.00 -2.36 0.00 0.00 39.78 37.49 2i9b n ASN 100 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 2i9b s TYR 101 N -3.66 3.53 0.19 -2.53 2.02 -1.26 -4.46 117.35 111.18 2i9b s TYR 101 Ca 0.40 1.39 -0.31 0.00 -0.37 0.00 0.00 57.07 58.18 2i9b s TYR 101 Cb 0.38 -2.64 -0.10 0.00 -0.40 0.00 0.00 41.96 39.20 2i9b s TYR 101 CO -0.01 0.20 1.51 0.00 -1.57 0.00 0.00 175.55 175.69 2i9b s ARG 103 N 0.61 1.39 -0.43 0.00 1.81 -0.54 -4.67 118.95 117.12 2i9b s ARG 103 Ca 0.66 -1.76 0.06 0.00 -1.72 0.00 0.00 55.73 52.97 2i9b s ARG 103 Cb -0.42 0.16 0.20 0.00 -0.45 0.00 0.00 34.95 34.44 2i9b s ARG 103 CO 0.35 -0.44 0.52 -1.71 -0.68 0.00 0.00 175.30 173.34 2i9b n ASN 104 N -0.63 -1.05 -0.65 0.23 4.05 -1.26 -1.01 115.26 114.94 2i9b n ASN 104 Ca 0.03 -2.66 0.13 0.00 0.45 0.00 0.00 54.58 52.53 2i9b n ASN 104 Cb 0.65 0.06 0.38 0.00 1.23 0.00 0.00 39.78 42.10 2i9b n ASN 104 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 2i9b n PRO 105 N 2.31 1.89 0.00 1.20 -0.04 -1.26 -4.35 135.00 134.75 2i9b n PRO 105 Ca 0.23 -1.30 0.05 0.00 -0.04 0.00 0.00 63.50 62.44 2i9b n PRO 105 Cb 0.52 -1.46 0.04 0.00 -0.04 0.00 0.00 33.50 32.56 2i9b n PRO 105 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2i9b n ASP 106 N 0.57 1.77 -0.83 3.54 3.85 -1.26 -5.01 116.55 119.18 2i9b n ASP 106 Ca 0.17 -1.39 0.00 0.00 -0.71 0.00 0.00 54.79 52.87 2i9b n ASP 106 Cb 0.43 0.06 0.00 0.00 -1.35 0.00 0.00 41.12 40.26 2i9b n ASP 106 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 2i9b n ASN 107 N 0.47 -1.85 -4.25 -1.12 5.15 -1.26 -5.10 115.26 107.30 2i9b n ASN 107 Ca 0.06 0.00 -0.22 0.00 -0.60 0.00 0.00 54.58 53.81 2i9b n ASN 107 Cb 0.25 -0.46 0.12 0.00 -0.53 0.00 0.00 39.78 39.16 2i9b n ASN 107 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2i9b n ARG 108 N -0.83 -0.26 0.00 1.20 1.74 -1.26 -5.02 116.66 112.24 2i9b n ARG 108 Ca 0.00 -2.40 0.11 0.00 -0.77 0.00 0.00 57.85 54.79 2i9b n ARG 108 Cb 0.46 -0.73 -0.01 0.00 -1.02 0.00 0.00 32.46 31.17 2i9b n ARG 108 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2i9b n ARG 109 N -2.87 0.95 -3.91 5.56 1.85 -1.26 -4.91 116.66 112.08 2i9b n ARG 109 Ca 0.15 -0.78 -0.11 0.00 -1.00 0.00 0.00 57.85 56.12 2i9b n ARG 109 Cb 0.54 -1.48 -0.11 0.00 -1.05 0.00 0.00 32.46 30.36 2i9b n ARG 109 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 2i9b s ARG 110 N -2.58 0.32 0.17 2.89 0.52 -1.26 -4.35 118.95 114.65 2i9b s ARG 110 Ca 0.17 -0.36 -0.33 0.00 -0.52 0.00 0.00 55.73 54.69 2i9b s ARG 110 Cb 0.18 0.13 -0.13 0.00 0.52 0.00 0.00 34.95 35.65 2i9b s ARG 110 CO 0.63 -0.06 1.68 -2.30 0.02 0.00 0.00 175.30 175.27 2i9b n PRO 111 N 1.90 2.50 -1.90 3.54 -0.02 -1.25 -4.87 135.00 134.90 2i9b n PRO 111 Ca -0.21 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2i9b n PRO 111 Cb 0.56 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 2i9b n PRO 111 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 2i9b n TRP 112 N 4.04 0.00 -3.61 6.00 4.27 -0.18 -0.89 117.44 127.07 2i9b n TRP 112 Ca 0.17 0.00 -0.04 0.00 -3.89 0.00 0.00 57.50 53.74 2i9b n TRP 112 Cb 0.32 0.00 -0.02 0.00 -1.36 0.00 0.00 31.31 30.25 2i9b n TRP 112 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2i9b s TYR 114 N -2.16 3.44 -0.12 0.00 2.02 -1.26 -0.68 117.35 118.59 2i9b s TYR 114 Ca 0.09 1.48 0.00 0.00 -0.37 0.00 0.00 57.07 58.28 2i9b s TYR 114 Cb -0.01 -3.17 -0.01 0.00 -0.40 0.00 0.00 41.96 38.36 2i9b s TYR 114 CO -0.04 -0.31 -0.14 0.08 -1.57 0.00 0.00 175.55 173.57 2i9b s VAL 115 N 2.41 2.99 -0.88 0.71 1.01 0.10 -1.37 120.40 125.36 2i9b s VAL 115 Ca 0.45 -0.69 -0.26 0.00 0.00 0.00 0.00 61.98 61.48 2i9b s VAL 115 Cb -0.17 -2.24 -0.12 0.00 0.00 0.00 0.00 36.38 33.84 2i9b s VAL 115 CO 0.13 0.53 2.22 -1.58 0.00 0.00 0.00 175.10 176.40 2i9b s GLN 116 N 0.28 1.84 -0.16 2.72 2.00 -1.26 -1.92 119.66 123.15 2i9b s GLN 116 Ca -0.10 0.06 0.01 0.00 -2.00 0.00 0.00 55.36 53.34 2i9b s GLN 116 Cb -0.16 -4.91 0.02 0.00 0.80 0.00 0.00 33.01 28.76 2i9b s GLN 116 CO 0.06 -4.30 -0.20 0.08 -0.50 0.00 0.00 175.29 170.43 2i9b s VAL 117 N 13.68 2.02 0.00 1.34 1.01 -1.26 -4.82 120.40 132.38 2i9b s VAL 117 Ca 0.84 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.89 2i9b s VAL 117 Cb -0.09 -1.82 0.00 0.00 0.00 0.00 0.00 36.38 34.47 2i9b s VAL 117 CO 0.07 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.32 2i9b n GLY 118 N 4.44 1.89 0.00 4.51 0.00 -1.26 -3.18 105.19 111.59 2i9b n GLY 118 Ca -0.20 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.60 2i9b n GLY 118 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2i9b n LEU 119 N 0.00 0.00 -4.53 0.99 0.00 -1.26 -5.10 117.00 107.10 2i9b n LEU 119 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 56.01 55.61 2i9b n LEU 119 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 43.42 43.32 2i9b n LEU 119 CO 0.00 0.00 -0.10 -0.54 0.00 0.00 0.00 177.39 176.75 2i9b s LYS 120 N 0.00 3.52 0.12 1.96 1.02 -1.19 -5.05 119.74 120.12 2i9b s LYS 120 Ca 0.00 -0.60 -0.33 0.00 0.02 0.00 0.00 55.97 55.06 2i9b s LYS 120 Cb 0.00 -3.80 -0.13 0.00 -0.52 0.00 0.00 37.83 33.38 2i9b s LYS 120 CO 0.00 -0.45 1.71 -0.35 -0.92 0.00 0.00 175.35 175.34 2i9b n PRO 121 N 5.15 2.40 -4.33 -1.68 -0.04 -1.26 -4.11 135.00 131.13 2i9b n PRO 121 Ca -0.12 0.87 -0.24 0.00 -0.04 0.00 0.00 63.50 63.97 2i9b n PRO 121 Cb 0.50 -2.69 -0.08 0.00 -0.04 0.00 0.00 33.50 31.18 2i9b n PRO 121 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2i9b s LEU 122 N 1.87 3.02 0.05 1.53 1.43 -0.81 -4.83 118.68 120.94 2i9b s LEU 122 Ca 0.81 -0.72 -0.30 0.00 -1.03 0.00 0.00 54.13 52.89 2i9b s LEU 122 Cb -0.61 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.00 2i9b s LEU 122 CO 0.39 0.03 1.00 0.54 0.23 0.00 0.00 176.35 178.54 2i9b s VAL 123 N -2.25 4.64 0.00 -1.59 0.11 -1.26 0.00 120.40 120.05 2i9b s VAL 123 Ca 0.30 1.99 -0.00 0.00 -2.93 0.00 0.00 61.98 61.34 2i9b s VAL 123 Cb -0.07 -4.28 -0.00 0.00 -1.53 0.00 0.00 36.38 30.51 2i9b s VAL 123 CO 0.18 0.21 -0.00 -1.10 -3.33 0.00 0.00 175.10 171.06 2i9b s GLN 124 N 0.63 0.03 0.88 1.54 -1.52 0.15 -4.92 119.66 116.45 2i9b s GLN 124 Ca 0.51 -0.06 -0.10 0.00 -1.95 0.00 0.00 55.36 53.76 2i9b s GLN 124 Cb -0.23 0.01 0.12 0.00 -0.22 0.00 0.00 33.01 32.69 2i9b s GLN 124 CO 0.29 -0.00 1.12 -1.21 -0.25 0.00 0.00 175.29 175.23 2i9b s GLU 125 N -0.13 1.33 0.40 2.91 2.02 -1.26 -1.28 118.70 122.69 2i9b s GLU 125 Ca -0.01 1.34 0.08 0.00 0.02 0.00 0.00 54.97 56.40 2i9b s GLU 125 Cb -0.01 -1.78 0.00 0.00 0.10 0.00 0.00 34.13 32.44 2i9b s GLU 125 CO -0.00 -2.34 0.51 0.00 0.02 0.00 0.00 175.26 173.45 2i9b h MET 127 N 0.77 -0.65 -6.32 0.00 4.05 -0.56 -3.41 114.93 108.81 2i9b h MET 127 Ca -0.42 0.04 -0.57 0.00 -0.28 0.00 0.00 59.70 58.48 2i9b h MET 127 Cb 1.27 0.15 0.20 0.00 -0.80 0.00 0.00 31.60 32.42 2i9b h MET 127 CO 0.49 -0.43 -0.99 1.33 0.23 0.00 0.00 176.91 177.54 2i9b n VAL 128 N -4.00 0.70 -4.64 -5.77 0.24 -1.26 -4.98 118.33 98.63 2i9b n VAL 128 Ca -0.08 -0.44 -0.30 0.00 -2.04 0.00 0.00 64.34 61.48 2i9b n VAL 128 Cb 0.26 -0.34 -0.07 0.00 -1.47 0.00 0.00 33.84 32.22 2i9b n VAL 128 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2i9b s HIS 129 N -2.00 1.78 0.23 6.34 2.46 -1.26 -4.96 115.29 117.89 2i9b s HIS 129 Ca 0.56 -1.19 -0.30 0.00 0.47 0.00 0.00 55.06 54.60 2i9b s HIS 129 Cb -0.34 -1.34 -0.10 0.00 -0.13 0.00 0.00 32.58 30.67 2i9b s HIS 129 CO 0.67 -0.11 1.51 0.34 -2.47 0.00 0.00 174.74 174.68 2i9b s ASP 130 N -3.75 6.58 -0.28 9.88 3.68 -1.26 -2.12 116.67 129.40 2i9b s ASP 130 Ca 0.13 2.71 -0.22 0.00 2.13 0.00 0.00 52.55 57.29 2i9b s ASP 130 Cb 0.01 -2.62 -0.24 0.00 -1.45 0.00 0.00 42.92 38.62 2i9b s ASP 130 CO 0.09 -0.78 1.64 0.00 0.13 0.00 0.00 175.17 176.25