#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jy9 s ILE 2 N 0.00 4.83 -0.17 1.12 1.09 -0.18 -4.92 121.20 122.97 2jy9 s ILE 2 Ca 0.00 -0.30 -0.01 0.00 -1.10 0.00 0.00 60.65 59.24 2jy9 s ILE 2 Cb 0.00 -3.44 -0.01 0.00 -1.06 0.00 0.00 42.46 37.95 2jy9 s ILE 2 CO 0.00 0.08 -0.11 0.00 -0.10 0.00 0.00 174.94 174.82 2jy9 s ALA 3 N 1.66 2.66 0.35 9.38 0.00 -1.26 -0.11 121.76 134.43 2jy9 s ALA 3 Ca 0.05 -1.03 0.08 0.00 0.00 0.00 0.00 51.96 51.06 2jy9 s ALA 3 Cb -0.17 -1.40 -0.04 0.00 0.00 0.00 0.00 23.12 21.52 2jy9 s ALA 3 CO 0.08 -0.08 0.20 0.42 0.00 0.00 0.00 175.76 176.38 2jy9 s ILE 4 N 0.89 3.10 0.75 0.00 -1.09 -1.02 -5.02 121.20 118.81 2jy9 s ILE 4 Ca -0.03 -1.58 -0.15 0.00 -2.23 0.00 0.00 60.65 56.66 2jy9 s ILE 4 Cb -0.15 -3.04 0.02 0.00 -1.58 0.00 0.00 42.46 37.72 2jy9 s ILE 4 CO 0.00 -0.16 0.96 -0.24 -1.23 0.00 0.00 174.94 174.27 2jy9 n SER 5 N -1.24 0.35 -0.10 3.58 2.88 -1.26 -4.43 113.62 113.41 2jy9 n SER 5 Ca -0.02 0.63 0.00 0.00 -1.33 0.00 0.00 58.87 58.14 2jy9 n SER 5 Cb 0.61 -1.41 0.00 0.00 -0.75 0.00 0.00 64.21 62.66 2jy9 n SER 5 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2jy9 n ARG 6 N -2.09 0.00 -1.31 -1.46 5.12 -1.26 -4.20 116.66 111.46 2jy9 n ARG 6 Ca 0.13 0.00 -0.28 0.00 -1.93 0.00 0.00 57.85 55.76 2jy9 n ARG 6 Cb 0.50 0.00 0.12 0.00 -1.16 0.00 0.00 32.46 31.92 2jy9 n ARG 6 CO 0.00 0.00 0.00 -2.37 -1.93 0.00 0.00 177.63 173.33 2jy9 n THR 7 N -0.19 3.35 -4.01 0.55 5.66 -1.26 -4.93 114.28 113.45 2jy9 n THR 7 Ca 0.00 -2.66 -0.35 0.00 -3.05 0.00 0.00 64.05 57.99 2jy9 n THR 7 Cb 0.00 -0.87 -0.13 0.00 -1.55 0.00 0.00 70.33 67.78 2jy9 n THR 7 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2jy9 s VAL 8 N -4.19 3.85 0.12 1.08 0.11 -1.26 -5.09 120.40 115.02 2jy9 s VAL 8 Ca 0.60 -0.34 0.07 0.00 -2.93 0.00 0.00 61.98 59.38 2jy9 s VAL 8 Cb 0.49 -2.75 -0.04 0.00 -1.53 0.00 0.00 36.38 32.55 2jy9 s VAL 8 CO 0.03 0.42 -0.17 -0.44 -3.33 0.00 0.00 175.10 171.61 2jy9 s SER 9 N 1.17 2.22 -0.09 3.54 0.01 -1.26 -2.43 113.70 116.87 2jy9 s SER 9 Ca 0.03 -0.75 0.04 0.00 1.31 0.00 0.00 55.95 56.57 2jy9 s SER 9 Cb -0.14 -0.10 -0.01 0.00 0.21 0.00 0.00 66.02 65.97 2jy9 s SER 9 CO 0.01 -0.06 -0.20 -0.63 0.41 0.00 0.00 173.24 172.77 2jy9 s ILE 10 N -1.71 2.47 0.63 1.44 1.09 0.84 -5.01 121.20 120.95 2jy9 s ILE 10 Ca 0.08 -0.90 -0.18 0.00 -1.10 0.00 0.00 60.65 58.55 2jy9 s ILE 10 Cb -0.07 -1.96 -0.02 0.00 -1.06 0.00 0.00 42.46 39.35 2jy9 s ILE 10 CO 0.04 0.56 1.23 0.00 -0.10 0.00 0.00 174.94 176.66 2jy9 s ALA 11 N 0.03 2.45 0.33 9.38 0.00 -1.26 -1.01 121.76 131.66 2jy9 s ALA 11 Ca -0.07 1.03 0.03 0.00 0.00 0.00 0.00 51.96 52.95 2jy9 s ALA 11 Cb -0.15 -3.48 0.56 0.00 0.00 0.00 0.00 23.12 20.05 2jy9 s ALA 11 CO 0.05 -1.37 1.87 0.22 0.00 0.00 0.00 175.76 176.54 2jy9 h ASP 12 N 0.63 0.57 -0.68 0.00 3.58 -1.94 -1.95 116.42 116.64 2jy9 h ASP 12 Ca -0.50 -0.10 -0.41 0.00 0.42 0.00 0.00 57.03 56.44 2jy9 h ASP 12 Cb 1.31 -0.15 -0.24 0.00 1.72 0.00 0.00 39.33 41.97 2jy9 h ASP 12 CO 0.54 0.60 0.16 -3.20 -2.88 0.00 0.00 179.24 174.47 2jy9 n ASN 13 N -4.29 4.14 -0.03 2.28 2.85 -1.26 -4.31 115.26 114.64 2jy9 n ASN 13 Ca 0.02 -3.75 -0.15 0.00 -0.11 0.00 0.00 54.58 50.59 2jy9 n ASN 13 Cb 0.22 -0.71 -0.14 0.00 1.24 0.00 0.00 39.78 40.40 2jy9 n ASN 13 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2jy9 n GLU 14 N -1.03 0.69 -2.40 1.20 1.02 -0.73 -4.94 120.64 114.45 2jy9 n GLU 14 Ca 0.47 0.23 -0.41 0.00 -0.02 0.00 0.00 57.16 57.43 2jy9 n GLU 14 Cb 1.10 -1.69 -0.04 0.00 -0.02 0.00 0.00 31.44 30.79 2jy9 n GLU 14 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2jy9 s LEU 15 N -6.46 4.48 -0.77 -4.62 1.43 -1.26 -4.95 118.68 106.52 2jy9 s LEU 15 Ca -0.16 2.25 -0.26 0.00 -1.03 0.00 0.00 54.13 54.92 2jy9 s LEU 15 Cb 0.07 -3.61 0.03 0.00 0.03 0.00 0.00 46.19 42.71 2jy9 s LEU 15 CO 0.78 -0.31 1.29 -1.61 0.23 0.00 0.00 176.35 176.72 2jy9 s GLU 16 N -0.59 3.24 0.15 1.70 2.02 -1.26 -4.97 118.70 118.98 2jy9 s GLU 16 Ca 0.50 -0.38 -0.28 0.00 0.02 0.00 0.00 54.97 54.83 2jy9 s GLU 16 Cb -0.32 -4.33 -0.07 0.00 0.10 0.00 0.00 34.13 29.50 2jy9 s GLU 16 CO 0.38 -2.14 0.89 0.42 0.02 0.00 0.00 175.26 174.83 2jy9 s ILE 17 N 5.56 4.37 0.04 -1.63 -1.09 -1.26 -3.08 121.20 124.12 2jy9 s ILE 17 Ca 0.36 1.95 0.02 0.00 -2.23 0.00 0.00 60.65 60.75 2jy9 s ILE 17 Cb -0.07 -4.26 -0.02 0.00 -1.58 0.00 0.00 42.46 36.52 2jy9 s ILE 17 CO 0.12 0.42 -0.07 0.42 -1.23 0.00 0.00 174.94 174.59 2jy9 s THR 18 N -0.58 0.52 0.06 2.92 -4.23 0.12 -5.00 115.64 109.45 2jy9 s THR 18 Ca 0.42 -1.02 -0.17 0.00 -1.18 0.00 0.00 61.69 59.74 2jy9 s THR 18 Cb -0.24 -0.58 -0.06 0.00 1.34 0.00 0.00 72.50 72.96 2jy9 s THR 18 CO 0.29 -0.35 0.51 0.00 -0.54 0.00 0.00 174.62 174.52 2jy9 s ALA 19 N -1.30 3.63 -0.33 3.99 0.00 -1.26 -0.75 121.76 125.74 2jy9 s ALA 19 Ca -0.09 -0.08 -0.21 0.00 0.00 0.00 0.00 51.96 51.57 2jy9 s ALA 19 Cb -0.09 -2.53 -0.00 0.00 0.00 0.00 0.00 23.12 20.50 2jy9 s ALA 19 CO 0.00 0.44 0.68 0.42 0.00 0.00 0.00 175.76 177.30 2jy9 s ILE 20 N -1.14 4.88 -0.41 0.00 1.01 -0.67 -4.86 121.20 120.00 2jy9 s ILE 20 Ca 0.28 0.83 0.02 0.00 0.00 0.00 0.00 60.65 61.78 2jy9 s ILE 20 Cb -0.18 -4.07 0.13 0.00 0.01 0.00 0.00 42.46 38.35 2jy9 s ILE 20 CO 0.17 -0.24 0.20 -0.60 0.00 0.00 0.00 174.94 174.47 2jy9 s ARG 21 N 2.75 1.22 -0.80 2.79 3.52 -1.26 -4.03 118.95 123.14 2jy9 s ARG 21 Ca 0.27 -1.85 -0.21 0.00 -0.13 0.00 0.00 55.73 53.80 2jy9 s ARG 21 Cb -0.14 -2.35 0.09 0.00 -1.56 0.00 0.00 34.95 30.98 2jy9 s ARG 21 CO 0.13 -1.12 1.08 0.00 -0.81 0.00 0.00 175.30 174.59 2jy9 s ALA 22 N 0.59 3.15 -1.24 6.12 0.00 -1.26 -4.95 121.76 124.17 2jy9 s ALA 22 Ca 0.16 -2.20 -0.18 0.00 0.00 0.00 0.00 51.96 49.74 2jy9 s ALA 22 Cb -0.23 -4.01 0.09 0.00 0.00 0.00 0.00 23.12 18.97 2jy9 s ALA 22 CO -0.04 -2.95 1.63 -1.14 0.00 0.00 0.00 175.76 173.25 2jy9 s GLN 23 N 3.72 3.96 -0.26 0.00 2.00 -1.26 -4.83 119.66 122.99 2jy9 s GLN 23 Ca 0.29 -2.03 -0.01 0.00 -2.00 0.00 0.00 55.36 51.60 2jy9 s GLN 23 Cb -0.10 -5.41 0.14 0.00 0.80 0.00 0.00 33.01 28.44 2jy9 s GLN 23 CO 0.01 -2.14 0.37 0.20 -0.50 0.00 0.00 175.29 173.23 2jy9 s GLY 24 N 3.99 -0.41 -0.06 2.59 0.00 -1.26 -5.06 107.32 107.12 2jy9 s GLY 24 Ca 0.50 0.58 -0.05 0.00 0.00 0.00 0.00 44.72 45.75 2jy9 s GLY 24 CO 0.04 2.73 -0.10 0.00 0.00 0.00 0.00 173.10 175.77 2jy9 n ALA 25 N 5.35 0.25 -0.00 3.20 0.00 -1.26 -4.54 120.51 123.52 2jy9 n ALA 25 Ca -0.02 -0.37 -0.08 0.00 0.00 0.00 0.00 53.44 52.97 2jy9 n ALA 25 Cb 0.50 0.01 0.04 0.00 0.00 0.00 0.00 19.45 20.00 2jy9 n ALA 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jy9 n GLY 26 N 1.57 2.98 0.07 0.00 0.00 -1.26 -3.72 105.19 104.83 2jy9 n GLY 26 Ca -0.04 -0.44 -0.01 0.00 0.00 0.00 0.00 46.02 45.54 2jy9 n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jy9 n GLY 27 N 0.25 -1.07 3.57 -0.02 0.00 -1.26 -5.03 105.19 101.62 2jy9 n GLY 27 Ca 0.18 -0.31 -0.06 0.00 0.00 0.00 0.00 46.02 45.83 2jy9 n GLY 27 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jy9 s GLN 28 N -2.93 0.50 0.00 1.61 0.74 -1.24 -5.02 119.66 113.31 2jy9 s GLN 28 Ca -0.07 -0.19 0.17 0.00 0.05 0.00 0.00 55.36 55.32 2jy9 s GLN 28 Cb 0.09 0.23 0.68 0.00 1.10 0.00 0.00 33.01 35.11 2jy9 s GLN 28 CO 0.85 -0.22 1.49 1.58 -0.55 0.00 0.00 175.29 178.43 2jy9 n HIS 29 N -0.16 0.20 0.15 1.67 -0.00 -1.26 -3.98 115.22 111.83 2jy9 n HIS 29 Ca -0.03 -0.10 0.03 0.00 -0.00 0.00 0.00 57.72 57.62 2jy9 n HIS 29 Cb 0.60 0.00 0.42 0.00 -0.00 0.00 0.00 29.99 31.00 2jy9 n HIS 29 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.34 176.10 2jy9 h VAL 30 N 1.56 1.17 -4.17 3.57 3.04 -1.95 -3.48 116.25 115.99 2jy9 h VAL 30 Ca 0.00 -0.75 0.00 0.00 -1.01 0.00 0.00 66.70 64.94 2jy9 h VAL 30 Cb 0.35 1.25 -0.06 0.00 -2.01 0.00 0.00 31.29 30.82 2jy9 h VAL 30 CO 0.00 0.23 -0.83 -3.20 -1.01 0.00 0.00 177.57 172.76 2jy9 n ASN 31 N -4.28 -2.33 -4.58 3.17 5.15 -1.26 -4.96 115.26 106.17 2jy9 n ASN 31 Ca -0.01 0.79 -0.42 0.00 -0.60 0.00 0.00 54.58 54.34 2jy9 n ASN 31 Cb 0.26 -3.48 -0.05 0.00 -0.53 0.00 0.00 39.78 35.99 2jy9 n ASN 31 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2jy9 s LYS 32 N -0.85 3.74 0.11 1.20 1.02 -1.26 -5.03 119.74 118.67 2jy9 s LYS 32 Ca -0.12 0.29 -0.30 0.00 0.02 0.00 0.00 55.97 55.86 2jy9 s LYS 32 Cb 0.01 -3.81 -0.06 0.00 -0.52 0.00 0.00 37.83 33.45 2jy9 s LYS 32 CO 0.46 -0.85 0.95 0.95 -0.92 0.00 0.00 175.35 175.94 2jy9 s THR 33 N 3.08 4.51 -0.38 2.17 -4.23 -1.26 -4.85 115.64 114.67 2jy9 s THR 33 Ca 0.31 2.05 0.06 0.00 -1.18 0.00 0.00 61.69 62.93 2jy9 s THR 33 Cb -0.13 -4.32 0.55 0.00 1.34 0.00 0.00 72.50 69.95 2jy9 s THR 33 CO 0.17 0.32 1.65 -1.20 -0.54 0.00 0.00 174.62 175.02 2jy9 n SER 34 N 2.77 3.46 -1.97 3.99 7.64 -1.26 -4.53 113.62 123.72 2jy9 n SER 34 Ca 0.02 -3.74 -0.24 0.00 1.01 0.00 0.00 58.87 55.93 2jy9 n SER 34 Cb 0.49 -0.72 0.06 0.00 -1.01 0.00 0.00 64.21 63.04 2jy9 n SER 34 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2jy9 n SER 35 N -1.10 5.29 -4.54 6.43 3.41 -1.26 -4.64 113.62 117.21 2jy9 n SER 35 Ca 0.45 -3.77 -0.26 0.00 -0.26 0.00 0.00 58.87 55.03 2jy9 n SER 35 Cb 1.21 -0.55 -0.10 0.00 -0.26 0.00 0.00 64.21 64.52 2jy9 n SER 35 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jy9 s ALA 36 N -3.61 2.87 -0.14 7.33 0.00 -1.26 -4.17 121.76 122.78 2jy9 s ALA 36 Ca 0.54 -1.56 -0.06 0.00 0.00 0.00 0.00 51.96 50.87 2jy9 s ALA 36 Cb 0.44 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 2jy9 s ALA 36 CO 0.02 0.42 0.10 0.42 0.00 0.00 0.00 175.76 176.72 2jy9 s ILE 37 N -1.82 5.12 -0.05 0.00 -1.09 0.13 -1.67 121.20 121.82 2jy9 s ILE 37 Ca 0.25 0.07 0.04 0.00 -2.23 0.00 0.00 60.65 58.78 2jy9 s ILE 37 Cb -0.08 -3.25 0.00 0.00 -1.58 0.00 0.00 42.46 37.55 2jy9 s ILE 37 CO 0.15 0.56 -0.15 -2.28 -1.23 0.00 0.00 174.94 171.98 2jy9 s HIS 38 N -0.54 1.58 0.04 3.97 5.65 0.07 -1.85 115.29 124.21 2jy9 s HIS 38 Ca 0.11 -0.48 0.02 0.00 0.25 0.00 0.00 55.06 54.96 2jy9 s HIS 38 Cb -0.12 -1.09 -0.02 0.00 -1.18 0.00 0.00 32.58 30.17 2jy9 s HIS 38 CO 0.02 -0.18 -0.07 -0.48 -0.65 0.00 0.00 174.74 173.37 2jy9 s LEU 39 N 0.18 2.24 -0.36 8.88 2.34 -1.24 0.16 118.68 130.89 2jy9 s LEU 39 Ca -0.06 -0.53 -0.09 0.00 0.06 0.00 0.00 54.13 53.51 2jy9 s LEU 39 Cb -0.12 -0.14 0.03 0.00 -0.56 0.00 0.00 46.19 45.40 2jy9 s LEU 39 CO 0.02 -0.20 0.16 -0.13 -1.06 0.00 0.00 176.35 175.14 2jy9 s ARG 40 N -1.51 2.75 -0.54 1.48 0.52 -1.18 -3.71 118.95 116.76 2jy9 s ARG 40 Ca -0.10 -1.12 -0.17 0.00 -0.52 0.00 0.00 55.73 53.82 2jy9 s ARG 40 Cb -0.10 -3.61 0.10 0.00 0.52 0.00 0.00 34.95 31.86 2jy9 s ARG 40 CO 0.00 -0.68 0.58 0.12 0.02 0.00 0.00 175.30 175.34 2jy9 s PHE 41 N 1.49 3.12 -0.15 -0.53 5.36 -0.99 -4.31 117.98 121.97 2jy9 s PHE 41 Ca 0.00 -0.97 -0.07 0.00 -0.96 0.00 0.00 56.93 54.94 2jy9 s PHE 41 Cb -0.19 -3.71 -0.04 0.00 -0.34 0.00 0.00 43.02 38.74 2jy9 s PHE 41 CO 0.05 -1.08 0.10 0.34 -1.46 0.00 0.00 175.22 173.17 2jy9 s ASP 42 N 3.25 5.97 0.00 6.13 -1.08 -1.26 0.08 116.67 129.76 2jy9 s ASP 42 Ca 0.08 0.27 -0.19 0.00 -0.52 0.00 0.00 52.55 52.19 2jy9 s ASP 42 Cb -0.25 -1.95 -0.26 0.00 -1.46 0.00 0.00 42.92 39.00 2jy9 s ASP 42 CO 0.06 0.30 1.05 0.40 0.52 0.00 0.00 175.17 177.50 2jy9 h ILE 43 N 4.38 1.42 -0.53 4.11 5.03 -1.24 -3.20 117.51 127.49 2jy9 h ILE 43 Ca -0.47 -2.26 -0.10 0.00 -0.12 0.00 0.00 64.86 61.91 2jy9 h ILE 43 Cb 1.19 2.76 -0.02 0.00 -3.03 0.00 0.00 36.82 37.72 2jy9 h ILE 43 CO 0.64 0.66 -0.08 -0.09 -0.68 0.00 0.00 178.15 178.61 2jy9 h ARG 44 N -0.10 0.97 0.00 2.37 2.43 -1.91 -2.60 114.38 115.54 2jy9 h ARG 44 Ca -0.11 -0.33 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 2jy9 h ARG 44 Cb 1.50 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.97 2jy9 h ARG 44 CO 0.15 1.00 0.00 0.00 -1.51 0.00 0.00 179.97 179.61 2jy9 n ALA 45 N -2.49 1.92 -3.75 2.80 0.00 -1.25 -4.77 120.51 112.96 2jy9 n ALA 45 Ca 0.02 -0.07 -0.07 0.00 0.00 0.00 0.00 53.44 53.32 2jy9 n ALA 45 Cb 0.38 -1.31 -0.00 0.00 0.00 0.00 0.00 19.45 18.51 2jy9 n ALA 45 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2jy9 n SER 46 N -1.44 1.66 -3.00 0.00 3.41 -0.98 -5.05 113.62 108.22 2jy9 n SER 46 Ca 0.06 -1.46 -0.20 0.00 -0.26 0.00 0.00 58.87 57.01 2jy9 n SER 46 Cb 0.20 0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.15 2jy9 n SER 46 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jy9 n GLY 47 N 3.50 3.99 3.81 5.00 0.00 -1.26 -4.98 105.19 115.26 2jy9 n GLY 47 Ca -0.02 -1.99 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 2jy9 n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jy9 s LEU 48 N -2.88 3.50 0.61 0.99 1.43 -1.26 -4.99 118.68 116.08 2jy9 s LEU 48 Ca 0.41 1.74 -0.19 0.00 -1.03 0.00 0.00 54.13 55.06 2jy9 s LEU 48 Cb 0.35 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 42.02 2jy9 s LEU 48 CO -0.09 -1.04 1.21 -2.65 0.23 0.00 0.00 176.35 174.01 2jy9 n PRO 49 N -2.00 1.17 -0.05 1.29 -0.02 -1.26 -4.77 135.00 129.37 2jy9 n PRO 49 Ca 0.08 0.45 -0.09 0.00 -2.02 0.00 0.00 63.50 61.92 2jy9 n PRO 49 Cb 0.53 -2.43 -0.03 0.00 -0.02 0.00 0.00 33.50 31.55 2jy9 n PRO 49 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2jy9 h GLU 50 N 0.71 -0.30 -0.22 -0.52 5.08 -2.00 -1.28 114.58 116.05 2jy9 h GLU 50 Ca -0.50 0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 57.78 2jy9 h GLU 50 Cb 1.34 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.65 2jy9 h GLU 50 CO 0.53 -0.20 -0.29 1.88 -1.00 0.00 0.00 179.01 179.93 2jy9 h TYR 51 N -0.32 0.49 -0.34 4.33 0.05 -1.99 -2.16 116.97 117.02 2jy9 h TYR 51 Ca 0.13 -0.11 -0.09 0.00 0.05 0.00 0.00 58.73 58.72 2jy9 h TYR 51 Cb 0.53 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 38.14 2jy9 h TYR 51 CO -0.45 0.68 -0.12 1.88 -1.05 0.00 0.00 178.16 179.10 2jy9 h TYR 52 N 0.38 0.78 -0.16 4.88 -1.99 -1.73 -2.08 116.97 117.05 2jy9 h TYR 52 Ca 0.05 -0.18 -0.12 0.00 2.00 0.00 0.00 58.73 60.48 2jy9 h TYR 52 Cb 0.70 -0.19 -0.01 0.00 2.00 0.00 0.00 36.73 39.23 2jy9 h TYR 52 CO 0.02 0.87 -0.43 1.57 -0.00 0.00 0.00 178.16 180.19 2jy9 h LYS 53 N 0.47 0.37 -0.14 4.88 2.10 -1.11 -3.08 116.57 120.06 2jy9 h LYS 53 Ca 0.08 -0.19 -0.15 0.00 -2.00 0.00 0.00 60.65 58.39 2jy9 h LYS 53 Cb 0.64 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.96 2jy9 h LYS 53 CO 0.04 0.74 -0.56 1.96 -2.00 0.00 0.00 179.45 179.63 2jy9 h GLN 54 N 0.31 0.44 -0.00 0.07 1.08 -1.27 -2.80 115.11 112.94 2jy9 h GLN 54 Ca 0.02 -0.28 0.00 0.00 -1.45 0.00 0.00 58.65 56.94 2jy9 h GLN 54 Cb 0.89 0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 28.35 2jy9 h GLN 54 CO 0.07 0.88 0.00 0.00 -0.95 0.00 0.00 178.83 178.84 2jy9 h ARG 55 N 0.33 0.00 -0.01 1.46 2.47 -1.28 -0.25 114.38 117.10 2jy9 h ARG 55 Ca 0.00 0.00 -0.21 0.00 -1.26 0.00 0.00 59.98 58.51 2jy9 h ARG 55 Cb 1.09 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.41 2jy9 h ARG 55 CO 0.10 0.00 -0.90 -0.07 0.56 0.00 0.00 179.97 179.66 2jy9 h LEU 56 N 0.00 0.47 0.00 3.04 3.38 -1.52 -2.79 115.31 117.89 2jy9 h LEU 56 Ca 0.00 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2jy9 h LEU 56 Cb 0.01 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.61 2jy9 h LEU 56 CO -0.00 1.16 -0.84 0.18 0.09 0.00 0.00 178.44 179.02 2jy9 n LEU 57 N -3.74 0.66 0.01 1.67 7.99 -0.81 -3.99 117.00 118.80 2jy9 n LEU 57 Ca -0.06 0.12 -0.14 0.00 -0.01 0.00 0.00 56.01 55.92 2jy9 n LEU 57 Cb 0.81 -0.14 -0.14 0.00 -0.11 0.00 0.00 43.42 43.85 2jy9 n LEU 57 CO 0.50 -0.02 -0.55 0.71 -1.51 0.00 0.00 177.39 176.53 2jy9 h THR 58 N 0.00 0.88 -3.07 -5.08 1.35 -1.13 -3.45 112.91 102.41 2jy9 h THR 58 Ca 0.00 -2.64 -0.56 0.00 -0.55 0.00 0.00 66.41 62.67 2jy9 h THR 58 Cb 0.75 2.54 -0.03 0.00 -1.73 0.00 0.00 68.15 69.68 2jy9 h THR 58 CO 0.00 0.71 0.73 0.00 -0.25 0.00 0.00 175.52 176.71 2jy9 s ALA 59 N -2.59 3.53 -1.40 6.62 0.00 -1.05 -4.93 121.76 121.94 2jy9 s ALA 59 Ca -0.11 0.53 -0.15 0.00 0.00 0.00 0.00 51.96 52.24 2jy9 s ALA 59 Cb 0.07 -3.53 0.02 0.00 0.00 0.00 0.00 23.12 19.68 2jy9 s ALA 59 CO 0.81 -0.85 2.22 0.43 0.00 0.00 0.00 175.76 178.38 2jy9 n SER 60 N 5.54 3.89 -4.76 0.00 7.64 -1.26 -4.91 113.62 119.75 2jy9 n SER 60 Ca 0.11 -2.82 -0.37 0.00 1.01 0.00 0.00 58.87 56.81 2jy9 n SER 60 Cb 0.46 -1.60 -0.06 0.00 -1.01 0.00 0.00 64.21 61.99 2jy9 n SER 60 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2jy9 s HIS 61 N 3.34 3.56 -1.17 1.43 5.04 -1.26 -4.96 115.29 121.26 2jy9 s HIS 61 Ca 0.49 0.80 0.23 0.00 -1.54 0.00 0.00 55.06 55.04 2jy9 s HIS 61 Cb 0.14 -2.38 1.07 0.00 0.04 0.00 0.00 32.58 31.45 2jy9 s HIS 61 CO -0.07 0.36 1.75 0.72 -2.34 0.00 0.00 174.74 175.16 2jy9 n HIS 62 N 3.03 0.00 0.47 3.88 -0.00 -1.26 -1.15 115.22 120.19 2jy9 n HIS 62 Ca -0.11 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.74 2jy9 n HIS 62 Cb 0.52 -0.41 0.44 0.00 -0.00 0.00 0.00 29.99 30.54 2jy9 n HIS 62 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 2jy9 h LEU 63 N 0.00 0.00 -9.69 2.41 4.07 -1.93 -3.44 115.31 106.73 2jy9 h LEU 63 Ca 0.00 0.00 -0.51 0.00 0.08 0.00 0.00 57.88 57.45 2jy9 h LEU 63 Cb 0.32 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.06 2jy9 h LEU 63 CO 0.00 0.00 0.43 -0.63 -1.08 0.00 0.00 178.44 177.16 2jy9 s ILE 64 N -3.25 3.94 0.00 1.22 -1.09 -0.30 -0.42 121.20 121.31 2jy9 s ILE 64 Ca 0.07 1.78 0.00 0.00 -2.23 0.00 0.00 60.65 60.27 2jy9 s ILE 64 Cb 0.10 -4.13 0.00 0.00 -1.58 0.00 0.00 42.46 36.85 2jy9 s ILE 64 CO 0.52 0.35 0.00 -1.54 -1.23 0.00 0.00 174.94 173.04 2jy9 n SER 65 N 2.00 0.00 0.00 3.58 3.41 -0.98 -4.92 113.62 116.71 2jy9 n SER 65 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2jy9 n SER 65 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 2jy9 n SER 65 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2jy9 n ASP 66 N -0.71 0.00 -3.65 4.04 8.00 -1.26 -4.99 116.55 117.97 2jy9 n ASP 66 Ca 0.00 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.12 2jy9 n ASP 66 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2jy9 n ASP 66 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2jy9 n ASP 67 N -1.46 6.28 -1.64 -2.24 8.00 -1.26 -4.77 116.55 119.46 2jy9 n ASP 67 Ca 0.00 -3.57 -0.10 0.00 0.71 0.00 0.00 54.79 51.83 2jy9 n ASP 67 Cb 0.00 -1.07 0.03 0.00 -0.02 0.00 0.00 41.12 40.05 2jy9 n ASP 67 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jy9 n GLY 68 N 0.50 0.27 3.01 0.44 0.00 -1.26 -4.89 105.19 103.26 2jy9 n GLY 68 Ca 0.36 -0.33 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 2jy9 n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jy9 s VAL 69 N -3.00 0.55 -0.16 1.61 0.11 -1.26 -0.66 120.40 117.59 2jy9 s VAL 69 Ca 0.20 -0.49 -0.07 0.00 -2.93 0.00 0.00 61.98 58.68 2jy9 s VAL 69 Cb -0.09 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 34.22 2jy9 s VAL 69 CO 0.25 0.02 0.10 -0.63 -3.33 0.00 0.00 175.10 171.50 2jy9 s ILE 70 N -0.46 5.11 -0.22 7.04 1.01 0.11 -2.32 121.20 131.47 2jy9 s ILE 70 Ca -0.00 0.07 -0.06 0.00 0.00 0.00 0.00 60.65 60.66 2jy9 s ILE 70 Cb -0.04 -3.27 -0.03 0.00 0.01 0.00 0.00 42.46 39.12 2jy9 s ILE 70 CO 0.00 0.52 0.04 -0.63 0.00 0.00 0.00 174.94 174.87 2jy9 s ILE 71 N -0.16 4.23 -0.08 2.92 -1.09 0.44 -2.36 121.20 125.11 2jy9 s ILE 71 Ca 0.09 -0.21 0.05 0.00 -2.23 0.00 0.00 60.65 58.35 2jy9 s ILE 71 Cb -0.12 -2.94 -0.00 0.00 -1.58 0.00 0.00 42.46 37.82 2jy9 s ILE 71 CO 0.01 0.39 -0.23 -0.63 -1.23 0.00 0.00 174.94 173.24 2jy9 s ILE 72 N 1.23 1.95 -0.28 2.92 1.09 -1.24 -4.75 121.20 122.13 2jy9 s ILE 72 Ca 0.04 -0.99 0.02 0.00 -1.10 0.00 0.00 60.65 58.63 2jy9 s ILE 72 Cb -0.15 -1.68 0.06 0.00 -1.06 0.00 0.00 42.46 39.64 2jy9 s ILE 72 CO 0.03 0.54 -0.07 -0.54 -0.10 0.00 0.00 174.94 174.79 2jy9 s LYS 73 N 0.12 2.19 -0.17 2.79 1.02 -1.26 -3.63 119.74 120.80 2jy9 s LYS 73 Ca -0.11 -1.40 -0.02 0.00 0.02 0.00 0.00 55.97 54.47 2jy9 s LYS 73 Cb -0.16 -2.98 -0.01 0.00 -0.52 0.00 0.00 37.83 34.17 2jy9 s LYS 73 CO 0.06 -0.62 -0.10 0.00 -0.92 0.00 0.00 175.35 173.76 2jy9 s ALA 74 N 1.10 2.67 -0.28 5.17 0.00 -0.77 -4.98 121.76 124.66 2jy9 s ALA 74 Ca -0.06 -1.04 -0.00 0.00 0.00 0.00 0.00 51.96 50.85 2jy9 s ALA 74 Cb -0.20 -1.41 0.17 0.00 0.00 0.00 0.00 23.12 21.68 2jy9 s ALA 74 CO -0.05 -0.10 0.51 1.14 0.00 0.00 0.00 175.76 177.26 2jy9 s GLN 75 N 0.93 0.49 -0.04 0.00 -2.07 -1.26 -0.69 119.66 117.01 2jy9 s GLN 75 Ca -0.02 0.73 -0.08 0.00 -1.82 0.00 0.00 55.36 54.17 2jy9 s GLN 75 Cb -0.15 0.12 -0.04 0.00 -1.09 0.00 0.00 33.01 31.85 2jy9 s GLN 75 CO -0.00 -0.72 0.40 1.49 -1.32 0.00 0.00 175.29 175.14 2jy9 h GLU 76 N 8.07 -0.28 0.00 9.60 4.81 -1.90 -3.48 114.58 131.39 2jy9 h GLU 76 Ca -0.18 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 2jy9 h GLU 76 Cb 1.16 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2jy9 h GLU 76 CO 0.25 -0.19 0.00 0.34 -0.73 0.00 0.00 179.01 178.69 2jy9 n PHE 77 N -4.26 -3.05 0.00 0.92 7.35 -1.26 -5.07 117.46 112.09 2jy9 n PHE 77 Ca -0.04 0.78 0.00 0.00 -0.76 0.00 0.00 57.45 57.43 2jy9 n PHE 77 Cb 0.11 1.73 0.00 0.00 0.35 0.00 0.00 39.48 41.67 2jy9 n PHE 77 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 2jy9 n ARG 78 N -3.32 0.00 -1.54 -4.13 0.63 -1.26 -4.75 116.66 102.30 2jy9 n ARG 78 Ca 0.00 0.00 -0.52 0.00 -0.92 0.00 0.00 57.85 56.41 2jy9 n ARG 78 Cb 0.00 -0.05 -0.07 0.00 0.45 0.00 0.00 32.46 32.80 2jy9 n ARG 78 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2jy9 n SER 79 N -1.79 2.40 -0.13 6.15 7.64 -1.26 -4.81 113.62 121.82 2jy9 n SER 79 Ca 0.00 0.63 -0.11 0.00 1.01 0.00 0.00 58.87 60.40 2jy9 n SER 79 Cb 0.00 -1.26 -0.02 0.00 -1.01 0.00 0.00 64.21 61.92 2jy9 n SER 79 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2jy9 h GLN 80 N 10.88 0.77 0.31 1.43 7.50 -1.99 -2.70 115.11 131.32 2jy9 h GLN 80 Ca -0.34 -0.31 -0.01 0.00 0.50 0.00 0.00 58.65 58.48 2jy9 h GLN 80 Cb 1.31 -0.03 -0.00 0.00 0.05 0.00 0.00 27.48 28.81 2jy9 h GLN 80 CO 1.00 0.92 -0.18 1.49 -1.50 0.00 0.00 178.83 180.56 2jy9 h GLU 81 N 0.57 -0.44 -0.23 1.46 4.81 -1.99 0.25 114.58 119.00 2jy9 h GLU 81 Ca 0.09 0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.24 2jy9 h GLU 81 Cb 0.66 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 2jy9 h GLU 81 CO 0.05 -0.30 -0.35 1.37 -0.73 0.00 0.00 179.01 179.04 2jy9 h LEU 82 N -0.46 0.52 -0.73 1.64 8.10 -1.97 -0.66 115.31 121.75 2jy9 h LEU 82 Ca -0.03 -0.21 -0.09 0.00 0.11 0.00 0.00 57.88 57.66 2jy9 h LEU 82 Cb 0.37 -0.14 -0.02 0.00 -0.44 0.00 0.00 40.66 40.43 2jy9 h LEU 82 CO 0.04 0.83 0.03 0.78 -4.11 0.00 0.00 178.44 176.01 2jy9 h ASN 83 N 0.42 0.97 -0.16 0.17 2.35 -1.23 0.74 115.58 118.84 2jy9 h ASN 83 Ca 0.05 -0.25 -0.02 0.00 -0.55 0.00 0.00 56.30 55.52 2jy9 h ASN 83 Cb 0.82 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 2jy9 h ASN 83 CO 0.07 1.01 0.01 -0.09 -1.65 0.00 0.00 177.43 176.78 2jy9 h ARG 84 N 0.93 0.28 -0.72 0.81 2.43 0.04 -0.27 114.38 117.87 2jy9 h ARG 84 Ca 0.17 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 2jy9 h ARG 84 Cb 0.50 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.99 2jy9 h ARG 84 CO 0.02 0.48 0.35 0.93 -1.51 0.00 0.00 179.97 180.25 2jy9 h GLU 85 N 0.05 1.02 -0.13 0.20 4.39 -1.02 -0.45 114.58 118.65 2jy9 h GLU 85 Ca 0.05 -0.13 -0.08 0.00 0.34 0.00 0.00 59.36 59.54 2jy9 h GLU 85 Cb 0.34 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 2jy9 h GLU 85 CO 0.01 0.78 -0.26 0.00 -1.16 0.00 0.00 179.01 178.38 2jy9 h ALA 86 N 1.37 1.33 -0.37 3.43 0.00 -0.65 -0.94 119.26 123.42 2jy9 h ALA 86 Ca 0.25 -0.30 -0.14 0.00 0.00 0.00 0.00 54.91 54.72 2jy9 h ALA 86 Cb 0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2jy9 h ALA 86 CO -0.03 0.46 -0.32 0.00 0.00 0.00 0.00 179.25 179.36 2jy9 h ALA 87 N 1.53 0.72 0.05 0.00 0.00 -0.06 0.28 119.26 121.77 2jy9 h ALA 87 Ca 0.03 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 2jy9 h ALA 87 Cb 0.58 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2jy9 h ALA 87 CO 0.04 0.66 -0.02 0.82 0.00 0.00 0.00 179.25 180.75 2jy9 h ILE 88 N 0.70 0.98 -0.40 0.00 2.04 -0.61 -1.05 117.51 119.17 2jy9 h ILE 88 Ca 0.07 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 2jy9 h ILE 88 Cb 0.88 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.97 2jy9 h ILE 88 CO 0.08 0.02 0.15 0.00 0.00 0.00 0.00 178.15 178.40 2jy9 h ALA 89 N 0.85 1.50 -0.08 1.87 0.00 -1.09 -2.56 119.26 119.75 2jy9 h ALA 89 Ca -0.01 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2jy9 h ALA 89 Cb 0.08 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2jy9 h ALA 89 CO 0.01 0.38 0.05 -0.09 0.00 0.00 0.00 179.25 179.60 2jy9 h ARG 90 N 0.57 0.11 -0.62 0.00 9.65 0.07 0.07 114.38 124.23 2jy9 h ARG 90 Ca 0.14 -0.01 -0.07 0.00 -1.10 0.00 0.00 59.98 58.94 2jy9 h ARG 90 Cb 0.14 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.67 2jy9 h ARG 90 CO -0.01 0.11 0.11 1.37 2.80 0.00 0.00 179.97 184.35 2jy9 h LEU 91 N 0.07 0.96 -0.73 3.80 8.10 -0.97 0.23 115.31 126.77 2jy9 h LEU 91 Ca 0.03 -0.21 -0.04 0.00 0.11 0.00 0.00 57.88 57.77 2jy9 h LEU 91 Cb 0.03 -0.25 -0.03 0.00 -0.44 0.00 0.00 40.66 39.97 2jy9 h LEU 91 CO -0.01 0.96 0.31 0.58 -4.11 0.00 0.00 178.44 176.17 2jy9 h VAL 92 N 0.95 1.25 -0.32 0.15 2.07 -1.25 -0.62 116.25 118.48 2jy9 h VAL 92 Ca 0.19 -0.76 -0.05 0.00 0.82 0.00 0.00 66.70 66.91 2jy9 h VAL 92 Cb 0.40 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 2jy9 h VAL 92 CO 0.01 0.31 0.02 0.00 0.02 0.00 0.00 177.57 177.92 2jy9 h ALA 93 N 1.15 0.43 -0.74 1.67 0.00 -0.39 -1.94 119.26 119.44 2jy9 h ALA 93 Ca 0.25 -0.23 0.09 0.00 0.00 0.00 0.00 54.91 55.02 2jy9 h ALA 93 Cb 0.19 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 2jy9 h ALA 93 CO -0.02 0.17 0.40 0.28 0.00 0.00 0.00 179.25 180.07 2jy9 h VAL 94 N 0.36 0.90 -0.40 0.00 2.07 -0.24 0.42 116.25 119.37 2jy9 h VAL 94 Ca 0.09 -0.24 0.01 0.00 0.82 0.00 0.00 66.70 67.39 2jy9 h VAL 94 Cb 0.41 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 2jy9 h VAL 94 CO 0.01 0.13 0.24 0.40 0.02 0.00 0.00 177.57 178.37 2jy9 h ILE 95 N 0.69 1.05 -0.00 4.57 2.04 -0.88 -1.99 117.51 122.98 2jy9 h ILE 95 Ca 0.35 -0.17 -0.16 0.00 1.00 0.00 0.00 64.86 65.88 2jy9 h ILE 95 Cb 0.32 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 2jy9 h ILE 95 CO -0.24 0.09 -0.77 0.07 0.00 0.00 0.00 178.15 177.30 2jy9 h LYS 96 N 0.49 0.01 -0.13 2.37 2.10 -0.52 0.63 116.57 121.53 2jy9 h LYS 96 Ca 0.15 -0.01 -0.05 0.00 -2.00 0.00 0.00 60.65 58.74 2jy9 h LYS 96 Cb -0.01 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.31 2jy9 h LYS 96 CO -0.06 0.78 -0.15 0.93 -2.00 0.00 0.00 179.45 178.94 2jy9 h GLU 97 N 0.01 0.20 0.09 0.07 4.39 0.04 -0.33 114.58 119.05 2jy9 h GLU 97 Ca -0.01 -0.05 -0.36 0.00 0.34 0.00 0.00 59.36 59.29 2jy9 h GLU 97 Cb 1.37 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.96 2jy9 h GLU 97 CO 0.10 0.36 -2.01 1.28 -1.16 0.00 0.00 179.01 177.59 2jy9 n LEU 98 N -4.27 2.30 0.03 1.33 4.32 -0.77 -3.95 117.00 116.00 2jy9 n LEU 98 Ca -0.01 0.21 -0.15 0.00 -0.02 0.00 0.00 56.01 56.04 2jy9 n LEU 98 Cb 0.28 -0.84 -0.04 0.00 -1.62 0.00 0.00 43.42 41.20 2jy9 n LEU 98 CO 0.38 0.77 0.24 0.71 -1.22 0.00 0.00 177.39 178.27 2jy9 h THR 99 N 0.05 1.34 -1.89 -5.08 1.35 -0.86 -3.45 112.91 104.37 2jy9 h THR 99 Ca -0.42 -2.19 -0.46 0.00 -0.55 0.00 0.00 66.41 62.79 2jy9 h THR 99 Cb 2.02 2.20 -0.01 0.00 -1.73 0.00 0.00 68.15 70.64 2jy9 h THR 99 CO 0.07 0.67 -0.38 0.00 -0.25 0.00 0.00 175.52 175.63 2jy9 s ALA 100 N -3.51 4.09 -1.25 6.62 0.00 -0.14 -5.03 121.76 122.55 2jy9 s ALA 100 Ca -0.08 -1.46 -0.12 0.00 0.00 0.00 0.00 51.96 50.31 2jy9 s ALA 100 Cb 0.09 -1.57 0.17 0.00 0.00 0.00 0.00 23.12 21.80 2jy9 s ALA 100 CO 0.88 0.03 1.66 0.39 0.00 0.00 0.00 175.76 178.72 2jy9 n GLU 101 N -1.53 3.49 -4.45 0.00 1.02 -1.26 -4.60 120.64 113.30 2jy9 n GLU 101 Ca -0.02 -3.68 -0.22 0.00 -0.02 0.00 0.00 57.16 53.21 2jy9 n GLU 101 Cb 0.58 -2.99 -0.10 0.00 -0.02 0.00 0.00 31.44 28.91 2jy9 n GLU 101 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2jy9 s GLN 102 N 1.02 1.71 -0.30 3.49 -0.21 -1.25 -5.14 119.66 118.99 2jy9 s GLN 102 Ca 0.41 -1.99 0.01 0.00 0.02 0.00 0.00 55.36 53.82 2jy9 s GLN 102 Cb 0.03 -0.68 0.19 0.00 1.00 0.00 0.00 33.01 33.55 2jy9 s GLN 102 CO 0.00 -0.31 0.62 -1.59 -2.12 0.00 0.00 175.29 171.89 2jy9 s LYS 103 N -3.85 0.55 -0.03 2.91 -2.85 -1.26 -4.86 119.74 110.34 2jy9 s LYS 103 Ca 0.32 0.82 0.04 0.00 -1.00 0.00 0.00 55.97 56.15 2jy9 s LYS 103 Cb 0.06 0.43 -0.01 0.00 -2.06 0.00 0.00 37.83 36.26 2jy9 s LYS 103 CO 0.15 -0.75 -0.17 -1.54 0.10 0.00 0.00 175.35 173.14 2jy9 s SER 104 N 2.85 2.08 -0.29 0.03 1.04 -1.26 -5.13 113.70 113.03 2jy9 s SER 104 Ca 0.17 -0.34 -0.24 0.00 0.48 0.00 0.00 55.95 56.02 2jy9 s SER 104 Cb -0.13 -0.49 0.17 0.00 0.10 0.00 0.00 66.02 65.67 2jy9 s SER 104 CO -0.22 0.16 1.30 0.00 0.98 0.00 0.00 173.24 175.46 2jy9 s ARG 105 N -0.06 0.20 -0.19 4.02 1.70 -1.26 -5.12 118.95 118.24 2jy9 s ARG 105 Ca -0.01 0.25 -0.08 0.00 -0.47 0.00 0.00 55.73 55.42 2jy9 s ARG 105 Cb -0.10 0.10 0.08 0.00 -0.57 0.00 0.00 34.95 34.46 2jy9 s ARG 105 CO 0.01 -0.03 0.42 0.50 -1.08 0.00 0.00 175.30 175.13 2jy9 s ARG 106 N 0.16 0.35 -0.25 3.89 3.52 -1.26 -5.13 118.95 120.23 2jy9 s ARG 106 Ca 0.05 0.98 -0.02 0.00 -0.13 0.00 0.00 55.73 56.62 2jy9 s ARG 106 Cb -0.05 0.25 0.08 0.00 -1.56 0.00 0.00 34.95 33.67 2jy9 s ARG 106 CO -0.13 -0.23 0.05 0.00 -0.81 0.00 0.00 175.30 174.19 2jy9 s ALA 107 N 2.31 1.33 -0.25 6.12 0.00 -1.26 -5.08 121.76 124.94 2jy9 s ALA 107 Ca -0.04 -1.18 -0.03 0.00 0.00 0.00 0.00 51.96 50.71 2jy9 s ALA 107 Cb -0.11 -1.40 0.14 0.00 0.00 0.00 0.00 23.12 21.75 2jy9 s ALA 107 CO -0.13 -1.39 0.39 0.99 0.00 0.00 0.00 175.76 175.62 2jy9 s THR 108 N 1.71 -0.63 -0.25 0.00 2.01 -1.26 -5.13 115.64 112.09 2jy9 s THR 108 Ca 0.03 -0.06 -0.02 0.00 0.31 0.00 0.00 61.69 61.94 2jy9 s THR 108 Cb -0.17 -0.82 0.08 0.00 0.01 0.00 0.00 72.50 71.60 2jy9 s THR 108 CO -0.15 -0.11 0.07 0.00 -0.69 0.00 0.00 174.62 173.74 2jy9 s ARG 109 N 2.57 0.60 -0.08 4.92 1.70 -1.26 -5.12 118.95 122.27 2jy9 s ARG 109 Ca 0.13 -0.67 -0.22 0.00 -0.47 0.00 0.00 55.73 54.50 2jy9 s ARG 109 Cb -0.15 -1.91 -0.04 0.00 -0.57 0.00 0.00 34.95 32.27 2jy9 s ARG 109 CO -0.16 -0.83 0.63 -1.25 -1.08 0.00 0.00 175.30 172.61 2jy9 s PRO 110 N 1.81 4.41 -0.19 3.89 0.04 -1.26 -5.06 135.00 138.64 2jy9 s PRO 110 Ca 0.04 0.74 -0.06 0.00 0.04 0.00 0.00 61.00 61.77 2jy9 s PRO 110 Cb -0.17 -3.44 0.09 0.00 0.04 0.00 0.00 34.50 31.02 2jy9 s PRO 110 CO -0.19 0.10 0.37 0.99 0.04 0.00 0.00 177.00 178.31 2jy9 s THR 111 N 0.74 -0.58 -0.22 1.26 2.01 -1.26 -5.15 115.64 112.43 2jy9 s THR 111 Ca 0.34 0.15 -0.18 0.00 0.31 0.00 0.00 61.69 62.30 2jy9 s THR 111 Cb -0.17 -0.64 0.06 0.00 0.01 0.00 0.00 72.50 71.76 2jy9 s THR 111 CO 0.16 0.04 0.57 -0.60 -0.69 0.00 0.00 174.62 174.10 2jy9 s ARG 112 N 2.55 0.65 0.13 4.92 6.06 -1.26 -5.17 118.95 126.82 2jy9 s ARG 112 Ca 0.02 0.84 -0.16 0.00 -2.50 0.00 0.00 55.73 53.93 2jy9 s ARG 112 Cb -0.13 0.27 0.03 0.00 0.06 0.00 0.00 34.95 35.19 2jy9 s ARG 112 CO -0.12 -0.10 0.40 0.00 -2.50 0.00 0.00 175.30 172.98 2jy9 s ALA 113 N 0.56 -0.92 0.00 6.12 0.00 -1.26 -5.11 121.76 121.16 2jy9 s ALA 113 Ca -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 51.87 2jy9 s ALA 113 Cb -0.05 0.70 0.00 0.00 0.00 0.00 0.00 23.12 23.77 2jy9 s ALA 113 CO -0.03 -0.65 0.00 0.43 0.00 0.00 0.00 175.76 175.51 2jy9 n SER 114 N -0.23 0.00 -2.92 0.00 7.64 -1.26 -5.13 113.62 111.73 2jy9 n SER 114 Ca -0.16 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.72 2jy9 n SER 114 Cb 0.64 0.01 -0.00 0.00 -1.01 0.00 0.00 64.21 63.84 2jy9 n SER 114 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2jy9 n LYS 115 N -1.09 -2.19 -3.85 1.43 4.01 -1.26 -5.07 118.16 110.14 2jy9 n LYS 115 Ca 0.00 1.96 -0.09 0.00 -0.51 0.00 0.00 58.31 59.67 2jy9 n LYS 115 Cb 0.00 -3.28 -0.06 0.00 -0.51 0.00 0.00 35.03 31.18 2jy9 n LYS 115 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 2jy9 s GLU 116 N -1.15 1.07 -0.28 1.97 4.04 -1.26 -5.17 118.70 117.91 2jy9 s GLU 116 Ca -0.03 -1.00 -0.23 0.00 0.04 0.00 0.00 54.97 53.75 2jy9 s GLU 116 Cb 0.00 0.40 0.13 0.00 0.02 0.00 0.00 34.13 34.68 2jy9 s GLU 116 CO 0.42 -0.39 1.05 0.50 -1.84 0.00 0.00 175.26 174.99 2jy9 s ARG 117 N -3.90 0.44 -0.27 -4.83 3.52 -1.26 -5.15 118.95 107.51 2jy9 s ARG 117 Ca 0.10 0.58 -0.07 0.00 -0.13 0.00 0.00 55.73 56.21 2jy9 s ARG 117 Cb 0.03 0.19 0.13 0.00 -1.56 0.00 0.00 34.95 33.74 2jy9 s ARG 117 CO -0.06 -0.06 0.55 -0.98 -0.81 0.00 0.00 175.30 173.94 2jy9 s ARG 118 N 0.50 0.48 -0.28 5.12 3.03 -1.26 -5.16 118.95 121.38 2jy9 s ARG 118 Ca 0.00 1.18 -0.22 0.00 2.03 0.00 0.00 55.73 58.72 2jy9 s ARG 118 Cb -0.05 0.54 0.12 0.00 -1.03 0.00 0.00 34.95 34.54 2jy9 s ARG 118 CO -0.09 -0.33 0.96 -1.17 -1.13 0.00 0.00 175.30 173.54 2jy9 s LEU 119 N 2.78 -0.54 -0.30 -1.89 2.96 -1.26 -5.15 118.68 115.28 2jy9 s LEU 119 Ca 0.01 0.97 -0.07 0.00 -0.22 0.00 0.00 54.13 54.83 2jy9 s LEU 119 Cb -0.13 1.95 0.17 0.00 0.50 0.00 0.00 46.19 48.69 2jy9 s LEU 119 CO -0.17 -0.16 0.76 -0.94 -1.32 0.00 0.00 176.35 174.51 2jy9 s SER 120 N 0.61 -1.04 -0.09 3.68 1.04 -1.26 -5.17 113.70 111.47 2jy9 s SER 120 Ca -0.01 0.85 -0.08 0.00 0.48 0.00 0.00 55.95 57.19 2jy9 s SER 120 Cb -0.05 1.95 0.03 0.00 0.10 0.00 0.00 66.02 68.05 2jy9 s SER 120 CO -0.09 -0.20 0.24 -0.94 0.98 0.00 0.00 173.24 173.24 2jy9 s SER 121 N 2.84 -0.25 -0.30 7.02 1.04 -1.26 -5.14 113.70 117.65 2jy9 s SER 121 Ca 0.09 0.48 -0.13 0.00 0.48 0.00 0.00 55.95 56.88 2jy9 s SER 121 Cb -0.12 0.47 0.13 0.00 0.10 0.00 0.00 66.02 66.60 2jy9 s SER 121 CO -0.18 -0.10 0.76 -1.59 0.98 0.00 0.00 173.24 173.11 2jy9 s LYS 122 N 0.32 0.53 -0.30 4.02 -2.85 -1.26 -5.15 119.74 115.05 2jy9 s LYS 122 Ca -0.02 1.19 -0.11 0.00 -1.00 0.00 0.00 55.97 56.04 2jy9 s LYS 122 Cb -0.03 0.58 0.18 0.00 -2.06 0.00 0.00 37.83 36.49 2jy9 s LYS 122 CO -0.01 -0.16 0.98 0.00 0.10 0.00 0.00 175.35 176.26 2jy9 s ALA 123 N 2.43 -3.29 -0.37 0.59 0.00 -1.26 -5.11 121.76 114.76 2jy9 s ALA 123 Ca -0.06 1.48 0.01 0.00 0.00 0.00 0.00 51.96 53.39 2jy9 s ALA 123 Cb -0.09 -2.47 0.15 0.00 0.00 0.00 0.00 23.12 20.71 2jy9 s ALA 123 CO -0.19 -1.47 0.27 -0.65 0.00 0.00 0.00 175.76 173.72 2jy9 s GLN 124 N 2.94 0.63 -0.11 0.00 -0.21 -1.26 -5.10 119.66 116.55 2jy9 s GLN 124 Ca 0.03 -1.39 -0.03 0.00 0.02 0.00 0.00 55.36 53.99 2jy9 s GLN 124 Cb -0.11 -1.21 0.04 0.00 1.00 0.00 0.00 33.01 32.74 2jy9 s GLN 124 CO -0.13 -1.24 0.06 0.21 -2.12 0.00 0.00 175.29 172.06 2jy9 s LYS 125 N 0.94 0.16 -0.25 2.91 2.47 -1.26 -5.12 119.74 119.60 2jy9 s LYS 125 Ca 0.21 0.09 -0.11 0.00 -1.56 0.00 0.00 55.97 54.60 2jy9 s LYS 125 Cb -0.17 -1.20 0.09 0.00 -1.46 0.00 0.00 37.83 35.10 2jy9 s LYS 125 CO -0.03 -0.47 0.57 -1.12 0.16 0.00 0.00 175.35 174.45 2jy9 s SER 126 N 2.09 -0.78 -0.32 1.43 0.01 -1.26 -5.12 113.70 109.76 2jy9 s SER 126 Ca 0.03 1.30 0.04 0.00 1.31 0.00 0.00 55.95 58.64 2jy9 s SER 126 Cb -0.14 1.51 0.19 0.00 0.21 0.00 0.00 66.02 67.79 2jy9 s SER 126 CO -0.06 -0.22 0.66 -0.55 0.41 0.00 0.00 173.24 173.48 2jy9 s SER 127 N 2.13 -1.46 -0.11 2.44 0.15 -1.26 -5.15 113.70 110.44 2jy9 s SER 127 Ca -0.07 -0.06 -0.17 0.00 0.70 0.00 0.00 55.95 56.35 2jy9 s SER 127 Cb -0.09 1.90 0.04 0.00 -1.71 0.00 0.00 66.02 66.16 2jy9 s SER 127 CO -0.17 -0.24 0.43 0.54 1.20 0.00 0.00 173.24 175.00 2jy9 s VAL 128 N 2.59 0.02 -0.29 4.45 0.11 -1.26 -5.14 120.40 120.86 2jy9 s VAL 128 Ca 0.13 -0.14 -0.01 0.00 -2.93 0.00 0.00 61.98 59.04 2jy9 s VAL 128 Cb -0.07 -0.65 0.19 0.00 -1.53 0.00 0.00 36.38 34.32 2jy9 s VAL 128 CO -0.21 -0.08 0.72 -0.75 -3.33 0.00 0.00 175.10 171.45 2jy9 s LYS 129 N -0.37 0.45 -0.24 1.54 2.20 -1.26 -5.14 119.74 116.93 2jy9 s LYS 129 Ca -0.05 0.57 -0.09 0.00 -0.36 0.00 0.00 55.97 56.04 2jy9 s LYS 129 Cb -0.03 0.29 0.10 0.00 -1.51 0.00 0.00 37.83 36.67 2jy9 s LYS 129 CO 0.03 -0.73 0.52 0.00 -0.36 0.00 0.00 175.35 174.81 2jy9 s ALA 130 N 2.87 -1.53 -0.27 3.13 0.00 -1.26 -5.16 121.76 119.55 2jy9 s ALA 130 Ca 0.15 1.89 -0.18 0.00 0.00 0.00 0.00 51.96 53.82 2jy9 s ALA 130 Cb -0.10 -1.46 0.07 0.00 0.00 0.00 0.00 23.12 21.63 2jy9 s ALA 130 CO -0.23 -0.74 0.67 -0.48 0.00 0.00 0.00 175.76 174.98 2jy9 s LEU 131 N 2.52 -0.80 -0.16 0.00 -0.00 -1.26 -5.17 118.68 113.82 2jy9 s LEU 131 Ca -0.05 1.44 -0.33 0.00 -0.00 0.00 0.00 54.13 55.19 2jy9 s LEU 131 Cb -0.11 2.32 0.13 0.00 -0.00 0.00 0.00 46.19 48.53 2jy9 s LEU 131 CO -0.16 -0.24 1.14 -0.60 -0.00 0.00 0.00 176.35 176.50 2jy9 s ARG 132 N 1.22 0.41 0.00 1.48 3.52 -1.26 -5.19 118.95 119.13 2jy9 s ARG 132 Ca -0.07 -0.12 0.00 0.00 -0.13 0.00 0.00 55.73 55.42 2jy9 s ARG 132 Cb -0.05 0.19 0.00 0.00 -1.56 0.00 0.00 34.95 33.53 2jy9 s ARG 132 CO -0.13 -0.17 0.00 0.41 -0.81 0.00 0.00 175.30 174.60 2jy9 n GLY 133 N -0.00 4.13 2.66 8.12 0.00 -1.26 -5.12 105.19 113.73 2jy9 n GLY 133 Ca -0.02 -0.71 -0.29 0.00 0.00 0.00 0.00 46.02 45.00 2jy9 n GLY 133 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jy9 s LYS 134 N -2.69 0.49 -0.12 1.61 2.47 -1.26 -5.11 119.74 115.13 2jy9 s LYS 134 Ca 0.00 -0.69 0.01 0.00 -1.56 0.00 0.00 55.97 53.73 2jy9 s LYS 134 Cb 0.00 -1.74 0.02 0.00 -1.46 0.00 0.00 37.83 34.65 2jy9 s LYS 134 CO 0.00 -0.90 -0.13 0.14 0.16 0.00 0.00 175.35 174.61 2jy9 s VAL 135 N 1.86 1.42 -0.30 4.02 -7.23 -1.26 -5.08 120.40 113.83 2jy9 s VAL 135 Ca 0.07 -0.57 -0.19 0.00 -1.81 0.00 0.00 61.98 59.48 2jy9 s VAL 135 Cb -0.17 -1.33 0.19 0.00 0.56 0.00 0.00 36.38 35.63 2jy9 s VAL 135 CO -0.24 0.43 1.24 -0.60 -0.31 0.00 0.00 175.10 175.62 2jy9 s ARG 136 N 1.26 0.07 -0.42 4.82 6.06 -1.26 -5.12 118.95 124.36 2jy9 s ARG 136 Ca -0.01 0.17 0.04 0.00 -2.50 0.00 0.00 55.73 53.43 2jy9 s ARG 136 Cb -0.14 0.10 0.17 0.00 0.06 0.00 0.00 34.95 35.14 2jy9 s ARG 136 CO -0.05 -0.03 0.44 0.50 -2.50 0.00 0.00 175.30 173.65 2jy9 s ARG 137 N 2.22 0.85 0.10 5.12 6.06 -1.26 -5.15 118.95 126.89 2jy9 s ARG 137 Ca -0.01 -1.44 -0.05 0.00 -2.50 0.00 0.00 55.73 51.73 2jy9 s ARG 137 Cb -0.02 -0.86 -0.05 0.00 0.06 0.00 0.00 34.95 34.07 2jy9 s ARG 137 CO -0.15 -1.31 0.33 -1.25 -2.50 0.00 0.00 175.30 170.42 2jy9 s PRO 138 N 0.73 3.60 -0.12 5.12 0.04 -1.26 -5.11 135.00 138.00 2jy9 s PRO 138 Ca 0.27 -0.11 -0.08 0.00 0.04 0.00 0.00 61.00 61.11 2jy9 s PRO 138 Cb -0.04 -2.94 0.04 0.00 0.04 0.00 0.00 34.50 31.60 2jy9 s PRO 138 CO -0.10 0.53 0.29 -0.51 0.04 0.00 0.00 177.00 177.26 2jy9 s LEU 139 N -2.38 0.58 -0.29 -3.56 1.43 -1.26 -5.14 118.68 108.06 2jy9 s LEU 139 Ca 0.37 0.61 0.05 0.00 -1.03 0.00 0.00 54.13 54.13 2jy9 s LEU 139 Cb -0.13 0.96 0.19 0.00 0.03 0.00 0.00 46.19 47.25 2jy9 s LEU 139 CO 0.23 -0.14 0.57 -0.62 0.23 0.00 0.00 176.35 176.62 2jy9 s ASP 140 N 0.71 -1.37 -0.19 2.29 2.15 -1.26 -5.12 116.67 113.88 2jy9 s ASP 140 Ca -0.05 0.12 -0.05 0.00 0.43 0.00 0.00 52.55 53.01 2jy9 s ASP 140 Cb -0.06 1.92 0.07 0.00 -0.30 0.00 0.00 42.92 44.55 2jy9 s ASP 140 CO -0.05 -0.31 0.09 -0.22 -0.17 0.00 0.00 175.17 174.52 2jy9 s LEU 141 N 2.79 0.48 -0.05 -1.34 2.96 -1.26 -5.12 118.68 117.15 2jy9 s LEU 141 Ca 0.10 -0.76 -0.02 0.00 -0.22 0.00 0.00 54.13 53.24 2jy9 s LEU 141 Cb -0.10 -0.30 0.03 0.00 0.50 0.00 0.00 46.19 46.32 2jy9 s LEU 141 CO -0.27 -0.36 0.08 -0.70 -1.32 0.00 0.00 176.35 173.79 2jy9 s GLU 142 N 2.10 -0.02 -0.23 1.98 -6.30 -1.26 -5.12 118.70 109.85 2jy9 s GLU 142 Ca 0.03 0.35 -0.03 0.00 -2.50 0.00 0.00 54.97 52.82 2jy9 s GLU 142 Cb -0.16 -0.33 0.11 0.00 0.00 0.00 0.00 34.13 33.75 2jy9 s GLU 142 CO -0.14 -0.25 0.28 -1.01 0.02 0.00 0.00 175.26 174.17 2jy9 s HIS 143 N 1.67 -0.48 0.19 5.30 3.76 -1.26 -5.15 115.29 119.31 2jy9 s HIS 143 Ca -0.02 0.35 0.10 0.00 -0.15 0.00 0.00 55.06 55.34 2jy9 s HIS 143 Cb -0.12 -0.26 -0.04 0.00 1.11 0.00 0.00 32.58 33.27 2jy9 s HIS 143 CO -0.04 -0.70 -0.22 -1.01 -0.85 0.00 0.00 174.74 171.93 2jy9 s HIS 144 N 2.40 2.14 0.20 1.40 3.76 -1.26 -5.15 115.29 118.78 2jy9 s HIS 144 Ca 0.09 -0.39 0.11 0.00 -0.15 0.00 0.00 55.06 54.72 2jy9 s HIS 144 Cb -0.15 -1.06 -0.04 0.00 1.11 0.00 0.00 32.58 32.44 2jy9 s HIS 144 CO -0.17 0.45 -0.22 -3.38 -0.85 0.00 0.00 174.74 170.57 2jy9 s HIS 145 N -1.80 2.35 -0.35 1.40 -3.43 -1.26 -5.11 115.29 107.09 2jy9 s HIS 145 Ca 0.19 -0.34 -0.00 0.00 -0.80 0.00 0.00 55.06 54.11 2jy9 s HIS 145 Cb -0.07 -1.15 0.11 0.00 -1.43 0.00 0.00 32.58 30.04 2jy9 s HIS 145 CO 0.09 0.51 0.15 -1.58 -2.00 0.00 0.00 174.74 171.91 2jy9 s HIS 146 N -1.72 1.65 -0.00 0.38 2.46 -1.26 -5.11 115.29 111.68 2jy9 s HIS 146 Ca 0.22 -1.88 0.04 0.00 0.47 0.00 0.00 55.06 53.91 2jy9 s HIS 146 Cb -0.08 -1.66 -0.01 0.00 -0.13 0.00 0.00 32.58 30.70 2jy9 s HIS 146 CO 0.11 -0.85 -0.13 -1.01 -2.47 0.00 0.00 174.74 170.39 2jy9 s HIS 147 N 1.26 1.15 0.00 3.88 3.76 -1.26 -5.39 115.29 118.69 2jy9 s HIS 147 Ca 0.13 -0.24 0.00 0.00 -0.15 0.00 0.00 55.06 54.80 2jy9 s HIS 147 Cb -0.20 -0.73 0.00 0.00 1.11 0.00 0.00 32.58 32.76 2jy9 s HIS 147 CO -0.17 -0.01 0.00 1.58 -0.85 0.00 0.00 174.74 175.29