#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 2.51 -0.86 1.12 1.09 -0.36 -4.95 121.20 119.75 2jy9 s ILE 2 Ca 0.00 -0.81 -0.25 0.00 -1.10 0.00 0.00 60.65 58.49 2jy9 s ILE 2 Cb 0.00 -2.06 0.03 0.00 -1.06 0.00 0.00 42.46 39.37 2jy9 s ILE 2 CO 0.00 0.52 1.40 0.00 -0.10 0.00 0.00 174.94 176.76 2jy9 s ALA 3 N 0.96 2.67 0.57 9.38 0.00 -1.26 -1.47 121.76 132.60 2jy9 s ALA 3 Ca -0.03 -1.73 -0.14 0.00 0.00 0.00 0.00 51.96 50.07 2jy9 s ALA 3 Cb -0.15 -4.39 -0.06 0.00 0.00 0.00 0.00 23.12 18.53 2jy9 s ALA 3 CO -0.03 -3.51 1.01 0.42 0.00 0.00 0.00 175.76 173.65 2jy9 s ILE 4 N 5.71 4.52 0.58 0.00 -1.09 -1.23 -4.99 121.20 124.70 2jy9 s ILE 4 Ca 0.42 1.03 -0.06 0.00 -2.23 0.00 0.00 60.65 59.82 2jy9 s ILE 4 Cb -0.05 -3.74 0.00 0.00 -1.58 0.00 0.00 42.46 37.10 2jy9 s ILE 4 CO 0.04 -0.86 0.89 -0.44 -1.23 0.00 0.00 174.94 173.34 2jy9 s SER 5 N -3.52 5.69 -0.45 3.58 0.01 -1.26 -4.51 113.70 113.24 2jy9 s SER 5 Ca 0.58 0.76 -0.01 0.00 1.31 0.00 0.00 55.95 58.59 2jy9 s SER 5 Cb -0.11 -1.79 0.00 0.00 0.21 0.00 0.00 66.02 64.33 2jy9 s SER 5 CO 0.42 -1.00 0.44 -1.14 0.41 0.00 0.00 173.24 172.37 2jy9 n ARG 6 N -2.55 -0.94 0.00 12.44 0.00 -1.26 -4.24 116.66 120.11 2jy9 n ARG 6 Ca 0.04 1.20 0.00 0.00 -0.00 0.00 0.00 57.85 59.09 2jy9 n ARG 6 Cb 0.57 -4.25 0.00 0.00 0.00 0.00 0.00 32.46 28.78 2jy9 n ARG 6 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 2jy9 n THR 7 N -1.36 0.00 -4.08 5.15 -1.04 -1.26 -4.85 114.28 106.84 2jy9 n THR 7 Ca 0.01 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.75 2jy9 n THR 7 Cb 0.48 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.93 2jy9 n THR 7 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2jy9 s VAL 8 N 0.00 4.47 0.08 12.58 0.11 -1.26 -5.08 120.40 131.31 2jy9 s VAL 8 Ca 0.00 -1.06 0.02 0.00 -2.93 0.00 0.00 61.98 58.01 2jy9 s VAL 8 Cb 0.00 -3.27 -0.04 0.00 -1.53 0.00 0.00 36.38 31.54 2jy9 s VAL 8 CO 0.00 -0.09 -0.08 -0.44 -3.33 0.00 0.00 175.10 171.17 2jy9 s SER 9 N -3.03 1.14 -0.11 3.54 0.01 -1.26 -3.57 113.70 110.41 2jy9 s SER 9 Ca 0.31 -0.84 -0.07 0.00 1.31 0.00 0.00 55.95 56.66 2jy9 s SER 9 Cb -0.10 0.06 -0.04 0.00 0.21 0.00 0.00 66.02 66.15 2jy9 s SER 9 CO 0.23 -0.35 0.14 -0.63 0.41 0.00 0.00 173.24 173.04 2jy9 s ILE 10 N -2.77 5.47 0.68 1.44 1.09 -0.54 -4.88 121.20 121.68 2jy9 s ILE 10 Ca 0.05 0.18 -0.11 0.00 -1.10 0.00 0.00 60.65 59.66 2jy9 s ILE 10 Cb -0.01 -3.39 0.17 0.00 -1.06 0.00 0.00 42.46 38.18 2jy9 s ILE 10 CO -0.02 0.61 0.52 0.00 -0.10 0.00 0.00 174.94 175.95 2jy9 n ALA 11 N 1.95 -2.12 -0.10 9.38 0.00 -1.26 -1.23 120.51 127.13 2jy9 n ALA 11 Ca -0.20 -0.82 -0.16 0.00 0.00 0.00 0.00 53.44 52.26 2jy9 n ALA 11 Cb 0.55 -0.06 -0.06 0.00 0.00 0.00 0.00 19.45 19.87 2jy9 n ALA 11 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jy9 n ASP 12 N -4.15 1.89 0.10 0.00 2.03 -1.26 -3.82 116.55 111.35 2jy9 n ASP 12 Ca 0.08 0.43 0.13 0.00 0.52 0.00 0.00 54.79 55.94 2jy9 n ASP 12 Cb 0.31 -0.84 0.42 0.00 -0.72 0.00 0.00 41.12 40.28 2jy9 n ASP 12 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2jy9 n ASN 13 N -4.44 0.78 -0.22 1.67 2.85 -1.26 -3.21 115.26 111.43 2jy9 n ASN 13 Ca -0.26 0.58 0.02 0.00 -0.11 0.00 0.00 54.58 54.81 2jy9 n ASN 13 Cb 0.58 -0.79 0.07 0.00 1.24 0.00 0.00 39.78 40.88 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 -2.24 1.27 -2.66 1.20 4.71 -1.26 -4.89 120.64 116.77 2jy9 n GLU 14 Ca 0.05 -0.42 -0.33 0.00 -0.01 0.00 0.00 57.16 56.45 2jy9 n GLU 14 Cb 0.41 -1.10 -0.05 0.00 -1.01 0.00 0.00 31.44 29.69 2jy9 n GLU 14 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2jy9 s LEU 15 N -1.02 3.87 -0.28 -4.62 1.43 -1.20 -4.98 118.68 111.88 2jy9 s LEU 15 Ca 0.09 1.77 -0.15 0.00 -1.03 0.00 0.00 54.13 54.81 2jy9 s LEU 15 Cb 0.04 -4.54 -0.03 0.00 0.03 0.00 0.00 46.19 41.69 2jy9 s LEU 15 CO 0.06 -0.56 0.37 -1.61 0.23 0.00 0.00 176.35 174.84 2jy9 s GLU 16 N -3.30 3.96 -0.12 1.70 0.41 -1.26 -5.06 118.70 115.03 2jy9 s GLU 16 Ca 0.64 -0.02 -0.00 0.00 -0.41 0.00 0.00 54.97 55.17 2jy9 s GLU 16 Cb -0.12 -3.67 0.02 0.00 -1.78 0.00 0.00 34.13 28.58 2jy9 s GLU 16 CO 0.18 -0.31 -0.10 0.42 -0.49 0.00 0.00 175.26 174.96 2jy9 s ILE 17 N 2.06 1.19 0.12 -1.63 -1.09 -1.26 -3.22 121.20 117.38 2jy9 s ILE 17 Ca 0.14 -0.40 0.10 0.00 -2.23 0.00 0.00 60.65 58.27 2jy9 s ILE 17 Cb -0.16 -1.17 -0.04 0.00 -1.58 0.00 0.00 42.46 39.51 2jy9 s ILE 17 CO 0.10 0.39 -0.25 -0.89 -1.23 0.00 0.00 174.94 173.06 2jy9 s THR 18 N 1.59 2.11 -0.22 2.92 2.01 0.26 -4.99 115.64 119.31 2jy9 s THR 18 Ca 0.04 -1.69 -0.06 0.00 0.31 0.00 0.00 61.69 60.28 2jy9 s THR 18 Cb -0.13 -1.88 -0.02 0.00 0.01 0.00 0.00 72.50 70.48 2jy9 s THR 18 CO -0.08 0.06 0.03 0.00 -0.69 0.00 0.00 174.62 173.93 2jy9 s ALA 19 N -1.08 3.08 -0.26 7.40 0.00 -1.26 -0.65 121.76 128.99 2jy9 s ALA 19 Ca 0.12 -1.07 -0.14 0.00 0.00 0.00 0.00 51.96 50.87 2jy9 s ALA 19 Cb -0.10 -1.91 -0.04 0.00 0.00 0.00 0.00 23.12 21.07 2jy9 s ALA 19 CO 0.05 -0.33 0.33 0.42 0.00 0.00 0.00 175.76 176.24 2jy9 s ILE 20 N 1.31 5.22 -0.51 0.00 1.01 -0.95 -4.99 121.20 122.29 2jy9 s ILE 20 Ca 0.04 0.49 -0.01 0.00 0.00 0.00 0.00 60.65 61.17 2jy9 s ILE 20 Cb -0.15 -3.66 0.13 0.00 0.01 0.00 0.00 42.46 38.80 2jy9 s ILE 20 CO 0.02 0.20 0.29 -0.60 0.00 0.00 0.00 174.94 174.86 2jy9 s ARG 21 N 1.82 2.17 0.01 2.79 3.52 -1.26 -3.49 118.95 124.50 2jy9 s ARG 21 Ca 0.14 -2.26 -0.26 0.00 -0.13 0.00 0.00 55.73 53.22 2jy9 s ARG 21 Cb -0.15 -3.56 -0.04 0.00 -1.56 0.00 0.00 34.95 29.64 2jy9 s ARG 21 CO 0.09 -1.11 0.81 0.00 -0.81 0.00 0.00 175.30 174.29 2jy9 s ALA 22 N 0.37 3.30 0.21 6.12 0.00 -1.26 -4.85 121.76 125.66 2jy9 s ALA 22 Ca 0.14 0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.42 2jy9 s ALA 22 Cb -0.22 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 19.81 2jy9 s ALA 22 CO -0.04 -0.06 0.00 0.94 0.00 0.00 0.00 175.76 176.61 2jy9 n GLN 23 N 3.34 -2.06 -2.58 0.00 -0.06 -1.26 -4.52 117.38 110.24 2jy9 n GLN 23 Ca 0.00 1.52 -0.42 0.00 -2.00 0.00 0.00 57.00 56.10 2jy9 n GLN 23 Cb 0.51 -1.70 -0.02 0.00 -4.06 0.00 0.00 30.24 24.96 2jy9 n GLN 23 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 2jy9 s GLY 24 N -2.29 1.16 0.31 1.69 0.00 -1.26 -5.00 107.32 101.93 2jy9 s GLY 24 Ca 0.00 -0.73 -0.29 0.00 0.00 0.00 0.00 44.72 43.70 2jy9 s GLY 24 CO 0.00 2.50 1.38 0.00 0.00 0.00 0.00 173.10 176.98 2jy9 s ALA 25 N 4.89 3.55 -1.24 3.20 0.00 -1.26 -4.93 121.76 125.97 2jy9 s ALA 25 Ca 0.45 1.33 -0.08 0.00 0.00 0.00 0.00 51.96 53.66 2jy9 s ALA 25 Cb -0.07 -3.52 0.20 0.00 0.00 0.00 0.00 23.12 19.72 2jy9 s ALA 25 CO 0.27 -0.74 1.79 0.41 0.00 0.00 0.00 175.76 177.49 2jy9 n GLY 26 N 1.19 4.83 4.63 0.00 0.00 -1.26 -4.80 105.19 109.78 2jy9 n GLY 26 Ca 0.02 -2.22 0.00 0.00 0.00 0.00 0.00 46.02 43.83 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 2.51 2.28 3.90 -0.02 0.00 -1.26 -4.87 105.19 107.73 2jy9 n GLY 27 Ca 0.37 -0.10 -0.28 0.00 0.00 0.00 0.00 46.02 46.01 2jy9 n GLY 27 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jy9 s GLN 28 N 0.00 3.36 -0.10 1.61 -1.52 -1.26 -5.02 119.66 116.73 2jy9 s GLN 28 Ca 0.00 0.23 -0.30 0.00 -1.95 0.00 0.00 55.36 53.35 2jy9 s GLN 28 Cb 0.00 -2.29 -0.03 0.00 -0.22 0.00 0.00 33.01 30.47 2jy9 s GLN 28 CO 0.00 -0.42 1.28 -3.38 -0.25 0.00 0.00 175.29 172.52 2jy9 s HIS 29 N -2.90 2.93 -0.19 0.91 -3.43 -1.26 -4.79 115.29 106.56 2jy9 s HIS 29 Ca 0.51 1.01 0.21 0.00 -0.80 0.00 0.00 55.06 55.99 2jy9 s HIS 29 Cb -0.10 -3.52 -0.07 0.00 -1.43 0.00 0.00 32.58 27.46 2jy9 s HIS 29 CO 0.47 -1.78 0.93 0.28 -2.00 0.00 0.00 174.74 172.64 2jy9 n VAL 30 N 5.00 0.67 -4.52 -5.38 0.31 -1.26 -4.95 118.33 108.20 2jy9 n VAL 30 Ca 0.13 -0.57 -0.25 0.00 -0.01 0.00 0.00 64.34 63.63 2jy9 n VAL 30 Cb 0.45 -0.38 -0.09 0.00 -0.91 0.00 0.00 33.84 32.91 2jy9 n VAL 30 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2jy9 s ASN 31 N -5.35 2.78 0.00 4.52 4.22 -1.26 -5.05 114.94 114.80 2jy9 s ASN 31 Ca -0.02 -1.58 0.00 0.00 -2.14 0.00 0.00 52.86 49.13 2jy9 s ASN 31 Cb 0.10 0.31 0.00 0.00 1.28 0.00 0.00 41.25 42.94 2jy9 s ASN 31 CO 0.81 -0.82 0.89 2.29 -2.04 0.00 0.00 177.10 178.23 2jy9 n LYS 32 N -0.87 2.32 -0.30 3.55 2.85 -1.26 -4.70 118.16 119.75 2jy9 n LYS 32 Ca -0.06 -1.29 0.08 0.00 -1.05 0.00 0.00 58.31 55.99 2jy9 n LYS 32 Cb 0.66 -0.92 0.23 0.00 -0.65 0.00 0.00 35.03 34.34 2jy9 n LYS 32 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2jy9 n THR 33 N -0.40 0.82 0.06 0.58 -2.24 -1.26 -4.30 114.28 107.54 2jy9 n THR 33 Ca 0.00 -0.71 -0.07 0.00 -2.27 0.00 0.00 64.05 61.00 2jy9 n THR 33 Cb 0.27 0.25 0.04 0.00 -2.10 0.00 0.00 70.33 68.80 2jy9 n THR 33 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2jy9 n SER 34 N 0.91 4.06 -3.27 3.42 7.64 -1.26 -4.06 113.62 121.05 2jy9 n SER 34 Ca 0.17 -2.54 -0.06 0.00 1.01 0.00 0.00 58.87 57.45 2jy9 n SER 34 Cb 0.48 -0.74 -0.04 0.00 -1.01 0.00 0.00 64.21 62.90 2jy9 n SER 34 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2jy9 s SER 35 N 0.56 -0.18 -0.05 6.43 0.15 -1.23 -4.66 113.70 114.72 2jy9 s SER 35 Ca 0.16 -0.64 -0.20 0.00 0.70 0.00 0.00 55.95 55.96 2jy9 s SER 35 Cb 0.13 1.32 0.04 0.00 -1.71 0.00 0.00 66.02 65.80 2jy9 s SER 35 CO 0.02 -0.29 0.46 0.00 1.20 0.00 0.00 173.24 174.63 2jy9 s ALA 36 N 2.20 -1.17 -0.24 5.45 0.00 -1.24 -4.70 121.76 122.07 2jy9 s ALA 36 Ca 0.13 0.81 -0.11 0.00 0.00 0.00 0.00 51.96 52.78 2jy9 s ALA 36 Cb -0.11 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.88 2jy9 s ALA 36 CO -0.19 -0.29 0.20 0.42 0.00 0.00 0.00 175.76 175.90 2jy9 s ILE 37 N -1.04 5.33 -0.21 0.00 -1.09 -0.95 -2.24 121.20 121.00 2jy9 s ILE 37 Ca -0.11 0.27 -0.03 0.00 -2.23 0.00 0.00 60.65 58.55 2jy9 s ILE 37 Cb -0.03 -3.54 -0.01 0.00 -1.58 0.00 0.00 42.46 37.30 2jy9 s ILE 37 CO 0.06 0.32 -0.05 -2.28 -1.23 0.00 0.00 174.94 171.75 2jy9 s HIS 38 N 1.17 2.94 0.05 3.97 5.65 0.17 -3.13 115.29 126.11 2jy9 s HIS 38 Ca 0.09 -0.87 0.04 0.00 0.25 0.00 0.00 55.06 54.57 2jy9 s HIS 38 Cb -0.14 -2.06 -0.02 0.00 -1.18 0.00 0.00 32.58 29.17 2jy9 s HIS 38 CO 0.06 -0.48 -0.12 -0.48 -0.65 0.00 0.00 174.74 173.07 2jy9 s LEU 39 N 1.27 2.23 -0.00 8.88 2.34 -1.09 0.90 118.68 133.21 2jy9 s LEU 39 Ca 0.03 -0.53 0.03 0.00 0.06 0.00 0.00 54.13 53.72 2jy9 s LEU 39 Cb -0.14 -0.43 -0.01 0.00 -0.56 0.00 0.00 46.19 45.05 2jy9 s LEU 39 CO -0.02 -0.08 -0.09 0.00 -1.06 0.00 0.00 176.35 175.11 2jy9 s ARG 40 N -1.45 0.70 -0.43 1.48 1.70 -1.20 -0.99 118.95 118.77 2jy9 s ARG 40 Ca -0.03 -0.33 -0.08 0.00 -0.47 0.00 0.00 55.73 54.82 2jy9 s ARG 40 Cb -0.09 -0.67 0.10 0.00 -0.57 0.00 0.00 34.95 33.71 2jy9 s ARG 40 CO 0.01 0.18 0.28 0.12 -1.08 0.00 0.00 175.30 174.81 2jy9 s PHE 41 N -0.24 3.40 -0.12 5.89 5.36 0.10 -4.38 117.98 127.99 2jy9 s PHE 41 Ca 0.03 -1.77 -0.03 0.00 -0.96 0.00 0.00 56.93 54.20 2jy9 s PHE 41 Cb -0.04 -3.15 -0.03 0.00 -0.34 0.00 0.00 43.02 39.46 2jy9 s PHE 41 CO -0.00 -0.91 0.01 0.34 -1.46 0.00 0.00 175.22 173.19 2jy9 s ASP 42 N 2.25 5.26 0.09 6.13 2.15 -1.26 -1.22 116.67 130.07 2jy9 s ASP 42 Ca 0.04 0.10 -0.17 0.00 0.43 0.00 0.00 52.55 52.95 2jy9 s ASP 42 Cb -0.24 -1.63 -0.08 0.00 -0.30 0.00 0.00 42.92 40.66 2jy9 s ASP 42 CO 0.00 0.31 1.47 0.40 -0.17 0.00 0.00 175.17 177.18 2jy9 h ILE 43 N 4.45 1.29 0.00 4.11 2.04 -1.91 -3.18 117.51 124.32 2jy9 h ILE 43 Ca -0.45 -1.14 -0.02 0.00 1.00 0.00 0.00 64.86 64.25 2jy9 h ILE 43 Cb 1.19 1.48 -0.00 0.00 -0.74 0.00 0.00 36.82 38.75 2jy9 h ILE 43 CO 0.59 0.36 -0.07 0.03 0.00 0.00 0.00 178.15 179.05 2jy9 h ARG 44 N 0.28 0.00 0.00 2.37 3.08 -1.95 -0.57 114.38 117.58 2jy9 h ARG 44 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2jy9 h ARG 44 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2jy9 h ARG 44 CO 0.03 0.07 -0.04 0.00 -1.07 0.00 0.00 179.97 178.96 2jy9 n ALA 45 N -2.18 2.35 -3.16 0.04 0.00 -1.20 -4.90 120.51 111.46 2jy9 n ALA 45 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2jy9 n ALA 45 Cb 0.25 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.25 2jy9 n ALA 45 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2jy9 n SER 46 N -2.03 1.11 -3.29 0.00 7.64 -0.22 -5.09 113.62 111.74 2jy9 n SER 46 Ca 0.06 -0.29 -0.25 0.00 1.01 0.00 0.00 58.87 59.40 2jy9 n SER 46 Cb 0.40 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.53 2jy9 n SER 46 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jy9 n GLY 47 N 2.77 3.39 3.77 0.23 0.00 -1.26 -4.95 105.19 109.13 2jy9 n GLY 47 Ca 0.00 -1.91 -0.38 0.00 0.00 0.00 0.00 46.02 43.73 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 -1.46 4.10 1.00 0.99 1.43 -1.26 -5.01 118.68 118.46 2jy9 s LEU 48 Ca 0.36 2.36 -0.12 0.00 -1.03 0.00 0.00 54.13 55.69 2jy9 s LEU 48 Cb 0.15 -4.12 0.19 0.00 0.03 0.00 0.00 46.19 42.44 2jy9 s LEU 48 CO -0.09 -0.82 1.09 -2.84 0.23 0.00 0.00 176.35 173.92 2jy9 s PRO 49 N -2.49 0.42 0.12 1.29 0.02 -1.26 -4.77 135.00 128.33 2jy9 s PRO 49 Ca 0.60 0.61 -0.20 0.00 0.02 0.00 0.00 61.00 62.04 2jy9 s PRO 49 Cb -0.30 -1.73 -0.07 0.00 0.02 0.00 0.00 34.50 32.42 2jy9 s PRO 49 CO 0.38 -2.76 1.76 1.05 -0.33 0.00 0.00 177.00 177.10 2jy9 h GLU 50 N -1.92 0.26 -0.59 5.54 9.09 -1.97 -1.82 114.58 123.18 2jy9 h GLU 50 Ca -0.54 -0.02 -0.07 0.00 0.05 0.00 0.00 59.36 58.78 2jy9 h GLU 50 Cb 1.32 -0.06 -0.02 0.00 -1.65 0.00 0.00 28.75 28.34 2jy9 h GLU 50 CO 0.56 0.19 0.10 -0.92 0.05 0.00 0.00 179.01 178.99 2jy9 h TYR 51 N 0.26 1.03 -0.16 2.06 3.20 -1.98 -2.42 116.97 118.95 2jy9 h TYR 51 Ca 0.07 -0.14 -0.02 0.00 3.14 0.00 0.00 58.73 61.78 2jy9 h TYR 51 Cb -0.01 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 37.97 2jy9 h TYR 51 CO -0.06 0.89 0.01 -0.92 -1.64 0.00 0.00 178.16 176.44 2jy9 h TYR 52 N 0.87 0.31 -0.29 -3.82 3.20 -1.87 -1.59 116.97 113.77 2jy9 h TYR 52 Ca 0.18 -0.05 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 2jy9 h TYR 52 Cb 0.41 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.58 2jy9 h TYR 52 CO 0.03 0.48 -0.09 1.57 -1.64 0.00 0.00 178.16 178.51 2jy9 h LYS 53 N 0.04 0.48 -0.69 1.82 2.10 -1.32 -2.03 116.57 116.97 2jy9 h LYS 53 Ca 0.05 -0.12 -0.05 0.00 -2.00 0.00 0.00 60.65 58.53 2jy9 h LYS 53 Cb 0.35 -0.06 -0.03 0.00 -0.90 0.00 0.00 32.23 31.59 2jy9 h LYS 53 CO 0.01 0.58 0.25 1.96 -2.00 0.00 0.00 179.45 180.24 2jy9 h GLN 54 N 0.45 1.05 -0.44 0.07 1.08 -1.21 -2.95 115.11 113.15 2jy9 h GLN 54 Ca 0.09 -0.21 0.02 0.00 -1.45 0.00 0.00 58.65 57.10 2jy9 h GLN 54 Cb 0.44 -0.16 -0.03 0.00 -0.05 0.00 0.00 27.48 27.68 2jy9 h GLN 54 CO 0.02 0.89 0.27 0.00 -0.95 0.00 0.00 178.83 179.05 2jy9 h ARG 55 N 0.99 0.52 -0.15 1.46 2.47 -0.60 -2.10 114.38 116.98 2jy9 h ARG 55 Ca 0.23 -0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.88 2jy9 h ARG 55 Cb 0.25 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.44 2jy9 h ARG 55 CO -0.01 0.35 -0.05 -0.07 0.56 0.00 0.00 179.97 180.74 2jy9 h LEU 56 N 0.54 0.20 0.00 3.04 3.38 -1.27 0.21 115.31 121.41 2jy9 h LEU 56 Ca 0.17 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2jy9 h LEU 56 Cb -0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2jy9 h LEU 56 CO -0.07 0.29 -0.76 0.18 0.09 0.00 0.00 178.44 178.16 2jy9 n LEU 57 N -4.36 0.63 -0.11 1.67 7.99 -1.10 -4.15 117.00 117.57 2jy9 n LEU 57 Ca -0.01 0.06 -0.14 0.00 -0.01 0.00 0.00 56.01 55.92 2jy9 n LEU 57 Cb 0.20 -0.16 -0.14 0.00 -0.11 0.00 0.00 43.42 43.21 2jy9 n LEU 57 CO 0.37 0.03 -1.20 0.35 -1.51 0.00 0.00 177.39 175.43 2jy9 n THR 58 N -1.90 1.45 -2.69 -5.08 -2.24 -0.80 -4.79 114.28 98.24 2jy9 n THR 58 Ca 0.03 -0.73 -0.42 0.00 -2.27 0.00 0.00 64.05 60.66 2jy9 n THR 58 Cb 0.41 -0.91 -0.03 0.00 -2.10 0.00 0.00 70.33 67.70 2jy9 n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jy9 s ALA 59 N -2.51 2.94 -0.55 6.98 0.00 0.67 -4.96 121.76 124.33 2jy9 s ALA 59 Ca -0.20 -2.43 -0.27 0.00 0.00 0.00 0.00 51.96 49.06 2jy9 s ALA 59 Cb 0.07 -4.36 -0.02 0.00 0.00 0.00 0.00 23.12 18.81 2jy9 s ALA 59 CO 0.74 -3.39 1.85 -1.12 0.00 0.00 0.00 175.76 173.84 2jy9 s SER 60 N 4.50 5.39 0.06 0.00 0.01 -1.26 -4.90 113.70 117.50 2jy9 s SER 60 Ca 0.41 0.56 0.04 0.00 1.31 0.00 0.00 55.95 58.27 2jy9 s SER 60 Cb -0.02 -2.53 -0.03 0.00 0.21 0.00 0.00 66.02 63.66 2jy9 s SER 60 CO -0.10 -2.24 -0.11 -1.00 0.41 0.00 0.00 173.24 170.20 2jy9 s HIS 61 N 8.67 0.95 0.44 2.43 3.76 -1.26 -4.94 115.29 125.34 2jy9 s HIS 61 Ca 0.70 -0.50 0.23 0.00 -0.15 0.00 0.00 55.06 55.35 2jy9 s HIS 61 Cb -0.15 -0.55 1.31 0.00 1.11 0.00 0.00 32.58 34.31 2jy9 s HIS 61 CO 0.24 -0.01 2.05 1.25 -0.85 0.00 0.00 174.74 177.42 2jy9 h HIS 62 N 4.32 0.00 0.00 1.40 2.76 -1.93 -0.76 115.15 120.94 2jy9 h HIS 62 Ca -0.38 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 57.78 2jy9 h HIS 62 Cb 1.20 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.15 2jy9 h HIS 62 CO 0.64 0.14 -0.04 -0.07 -1.30 0.00 0.00 177.93 177.30 2jy9 h LEU 63 N 0.00 0.00 -9.34 0.26 4.07 -1.87 -3.40 115.31 105.03 2jy9 h LEU 63 Ca -0.00 0.00 -0.55 0.00 0.08 0.00 0.00 57.88 57.41 2jy9 h LEU 63 Cb 0.32 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.03 2jy9 h LEU 63 CO 0.02 0.04 0.51 -0.63 -1.08 0.00 0.00 178.44 177.30 2jy9 s ILE 64 N -4.34 4.70 -0.06 1.22 -1.09 -0.29 -1.67 121.20 119.66 2jy9 s ILE 64 Ca -0.04 1.95 -0.20 0.00 -2.23 0.00 0.00 60.65 60.13 2jy9 s ILE 64 Cb 0.14 -4.25 -0.15 0.00 -1.58 0.00 0.00 42.46 36.61 2jy9 s ILE 64 CO 0.53 0.07 0.79 0.28 -1.23 0.00 0.00 174.94 175.39 2jy9 h SER 65 N 7.00 -0.15 0.00 3.58 0.02 -1.25 -3.47 113.55 119.28 2jy9 h SER 65 Ca -0.36 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 60.20 2jy9 h SER 65 Cb 1.18 0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2jy9 h SER 65 CO 0.81 0.44 0.00 -0.67 -1.14 0.00 0.00 176.83 176.27 2jy9 n ASP 66 N -4.88 0.00 -0.54 3.07 2.03 -1.26 -4.96 116.55 110.01 2jy9 n ASP 66 Ca -0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.24 2jy9 n ASP 66 Cb 0.26 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.69 2jy9 n ASP 66 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2jy9 n ASP 67 N 0.00 1.18 0.00 1.67 8.00 -1.26 -4.75 116.55 121.39 2jy9 n ASP 67 Ca 0.00 -2.05 0.00 0.00 0.71 0.00 0.00 54.79 53.45 2jy9 n ASP 67 Cb 0.00 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 40.63 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 0.08 0.59 3.83 0.44 0.00 -1.26 -4.91 105.19 103.96 2jy9 n GLY 68 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.42 4.78 -0.27 1.61 0.11 -1.26 -4.76 120.40 118.19 2jy9 s VAL 69 Ca 0.00 1.03 -0.10 0.00 -2.93 0.00 0.00 61.98 59.98 2jy9 s VAL 69 Cb 0.00 -3.81 -0.05 0.00 -1.53 0.00 0.00 36.38 30.99 2jy9 s VAL 69 CO 0.00 0.36 0.16 -0.63 -3.33 0.00 0.00 175.10 171.66 2jy9 s ILE 70 N -1.33 5.09 -0.19 7.04 1.09 -0.36 -0.90 121.20 131.63 2jy9 s ILE 70 Ca 0.35 0.09 -0.03 0.00 -1.10 0.00 0.00 60.65 59.96 2jy9 s ILE 70 Cb -0.17 -3.41 -0.01 0.00 -1.06 0.00 0.00 42.46 37.81 2jy9 s ILE 70 CO 0.19 0.28 -0.06 -0.63 -0.10 0.00 0.00 174.94 174.62 2jy9 s ILE 71 N 1.63 3.36 -0.24 2.92 1.09 -0.67 0.00 121.20 129.30 2jy9 s ILE 71 Ca 0.07 -0.51 -0.07 0.00 -1.10 0.00 0.00 60.65 59.04 2jy9 s ILE 71 Cb -0.15 -2.50 -0.03 0.00 -1.06 0.00 0.00 42.46 38.72 2jy9 s ILE 71 CO 0.09 0.46 0.05 -0.63 -0.10 0.00 0.00 174.94 174.80 2jy9 s ILE 72 N 1.08 4.18 -0.27 2.92 -1.09 -0.16 -4.80 121.20 123.05 2jy9 s ILE 72 Ca 0.01 -0.22 0.02 0.00 -2.23 0.00 0.00 60.65 58.23 2jy9 s ILE 72 Cb -0.15 -2.94 0.06 0.00 -1.58 0.00 0.00 42.46 37.86 2jy9 s ILE 72 CO -0.01 0.37 -0.08 -0.54 -1.23 0.00 0.00 174.94 173.45 2jy9 s LYS 73 N 1.46 2.25 -0.08 2.79 1.02 -1.26 -2.69 119.74 123.23 2jy9 s LYS 73 Ca 0.05 -1.35 0.03 0.00 0.02 0.00 0.00 55.97 54.72 2jy9 s LYS 73 Cb -0.15 -2.97 0.01 0.00 -0.52 0.00 0.00 37.83 34.20 2jy9 s LYS 73 CO 0.03 -0.60 -0.16 0.00 -0.92 0.00 0.00 175.35 173.69 2jy9 s ALA 74 N 1.13 1.59 -0.29 5.17 0.00 -1.19 -5.03 121.76 123.14 2jy9 s ALA 74 Ca -0.07 -0.62 0.02 0.00 0.00 0.00 0.00 51.96 51.29 2jy9 s ALA 74 Cb -0.20 -0.67 0.18 0.00 0.00 0.00 0.00 23.12 22.43 2jy9 s ALA 74 CO -0.04 0.15 0.52 1.14 0.00 0.00 0.00 175.76 177.52 2jy9 s GLN 75 N 0.60 0.50 0.14 0.00 -2.07 -1.26 -2.24 119.66 115.32 2jy9 s GLN 75 Ca -0.15 0.56 0.00 0.00 -1.82 0.00 0.00 55.36 53.95 2jy9 s GLN 75 Cb -0.16 0.09 0.00 0.00 -1.09 0.00 0.00 33.01 31.85 2jy9 s GLN 75 CO 0.05 -0.88 0.00 -1.91 -1.32 0.00 0.00 175.29 171.23 2jy9 n GLU 76 N 5.40 0.00 -4.27 9.60 2.13 -1.26 -5.07 120.64 127.17 2jy9 n GLU 76 Ca 0.01 0.00 -0.16 0.00 0.66 0.00 0.00 57.16 57.67 2jy9 n GLU 76 Cb 0.52 -0.38 -0.09 0.00 0.27 0.00 0.00 31.44 31.75 2jy9 n GLU 76 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 2jy9 s PHE 77 N -1.96 1.45 0.00 4.31 5.36 -1.26 -5.17 117.98 120.71 2jy9 s PHE 77 Ca 0.00 -1.41 0.00 0.00 -0.96 0.00 0.00 56.93 54.56 2jy9 s PHE 77 Cb 0.00 -0.72 0.00 0.00 -0.34 0.00 0.00 43.02 41.96 2jy9 s PHE 77 CO 0.00 -0.61 0.00 0.54 -1.46 0.00 0.00 175.22 173.69 2jy9 n ARG 78 N -0.46 0.25 -2.02 10.12 1.74 -1.26 -4.81 116.66 120.22 2jy9 n ARG 78 Ca 0.02 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.10 2jy9 n ARG 78 Cb 0.65 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.09 2jy9 n ARG 78 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2jy9 n SER 79 N -1.20 -4.57 -0.02 0.55 7.64 -1.26 -4.64 113.62 110.13 2jy9 n SER 79 Ca 0.00 0.59 0.15 0.00 1.01 0.00 0.00 58.87 60.62 2jy9 n SER 79 Cb 0.00 -2.85 0.59 0.00 -1.01 0.00 0.00 64.21 60.94 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 1.27 0.19 -0.51 1.43 7.50 -1.99 0.69 115.11 123.69 2jy9 h GLN 80 Ca 0.00 -0.01 0.10 0.00 0.50 0.00 0.00 58.65 59.24 2jy9 h GLN 80 Cb 0.03 -0.04 -0.09 0.00 0.05 0.00 0.00 27.48 27.43 2jy9 h GLN 80 CO 0.05 0.13 -0.03 1.49 -1.50 0.00 0.00 178.83 178.97 2jy9 h GLU 81 N 0.20 0.09 -0.11 1.46 4.57 -2.00 0.95 114.58 119.73 2jy9 h GLU 81 Ca 0.24 -0.01 -0.22 0.00 -1.18 0.00 0.00 59.36 58.20 2jy9 h GLU 81 Cb 0.69 -0.02 0.01 0.00 -0.16 0.00 0.00 28.75 29.27 2jy9 h GLU 81 CO -0.04 0.06 -0.81 1.25 -1.18 0.00 0.00 179.01 178.29 2jy9 h LEU 82 N 0.09 0.82 -0.52 1.64 5.85 -1.18 -1.72 115.31 120.29 2jy9 h LEU 82 Ca 0.26 -0.56 0.01 0.00 0.84 0.00 0.00 57.88 58.43 2jy9 h LEU 82 Cb 0.39 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 2jy9 h LEU 82 CO -0.45 1.35 0.33 0.78 -0.34 0.00 0.00 178.44 180.10 2jy9 h ASN 83 N 0.46 0.55 0.47 1.25 -0.26 -0.83 -0.73 115.58 116.49 2jy9 h ASN 83 Ca -0.06 -0.01 -0.02 0.00 -0.56 0.00 0.00 56.30 55.65 2jy9 h ASN 83 Cb 1.43 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 38.56 2jy9 h ASN 83 CO 0.16 0.40 -0.23 0.03 -1.06 0.00 0.00 177.43 176.73 2jy9 h ARG 84 N 0.66 -0.61 -0.61 0.81 3.08 -0.78 -2.35 114.38 114.58 2jy9 h ARG 84 Ca 0.20 0.04 0.10 0.00 0.07 0.00 0.00 59.98 60.39 2jy9 h ARG 84 Cb -0.04 0.14 -0.08 0.00 0.08 0.00 0.00 29.97 30.08 2jy9 h ARG 84 CO -0.06 -0.30 0.22 0.93 -1.07 0.00 0.00 179.97 179.68 2jy9 h GLU 85 N -0.91 0.38 -0.39 0.04 4.39 -1.20 0.22 114.58 117.11 2jy9 h GLU 85 Ca -0.06 -0.02 -0.06 0.00 0.34 0.00 0.00 59.36 59.55 2jy9 h GLU 85 Cb 0.58 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 2jy9 h GLU 85 CO 0.11 0.25 0.01 0.00 -1.16 0.00 0.00 179.01 178.22 2jy9 h ALA 86 N 1.43 0.52 -0.29 3.43 0.00 -1.19 0.16 119.26 123.32 2jy9 h ALA 86 Ca 0.31 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2jy9 h ALA 86 Cb 0.41 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2jy9 h ALA 86 CO -0.33 0.28 0.13 0.00 0.00 0.00 0.00 179.25 179.34 2jy9 h ALA 87 N 0.89 0.37 0.17 0.00 0.00 -0.80 -1.13 119.26 118.76 2jy9 h ALA 87 Ca 0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2jy9 h ALA 87 Cb 0.45 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2jy9 h ALA 87 CO 0.02 -0.06 -0.08 0.82 0.00 0.00 0.00 179.25 179.94 2jy9 h ILE 88 N 0.33 0.89 -0.88 0.00 2.04 -0.49 -1.11 117.51 118.28 2jy9 h ILE 88 Ca 0.10 -0.24 0.11 0.00 1.00 0.00 0.00 64.86 65.82 2jy9 h ILE 88 Cb 0.13 1.03 -0.08 0.00 -0.74 0.00 0.00 36.82 37.16 2jy9 h ILE 88 CO -0.01 0.06 0.52 0.00 0.00 0.00 0.00 178.15 178.72 2jy9 h ALA 89 N 0.47 1.29 -0.19 1.87 0.00 -0.58 0.92 119.26 123.04 2jy9 h ALA 89 Ca -0.02 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 2jy9 h ALA 89 Cb 0.27 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2jy9 h ALA 89 CO 0.04 0.13 -0.08 0.00 0.00 0.00 0.00 179.25 179.33 2jy9 h ARG 90 N 0.85 0.40 -0.46 0.00 2.47 -1.07 -2.31 114.38 114.26 2jy9 h ARG 90 Ca 0.43 -0.17 -0.11 0.00 -1.26 0.00 0.00 59.98 58.87 2jy9 h ARG 90 Cb 0.42 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.71 2jy9 h ARG 90 CO -0.26 0.69 -0.15 1.37 0.56 0.00 0.00 179.97 182.18 2jy9 h LEU 91 N 0.10 0.88 -0.53 3.04 8.10 -0.49 -0.50 115.31 125.92 2jy9 h LEU 91 Ca 0.04 -0.29 -0.01 0.00 0.11 0.00 0.00 57.88 57.74 2jy9 h LEU 91 Cb 0.56 -0.24 -0.03 0.00 -0.44 0.00 0.00 40.66 40.52 2jy9 h LEU 91 CO 0.03 1.03 0.31 0.58 -4.11 0.00 0.00 178.44 176.27 2jy9 h VAL 92 N 0.78 1.17 -0.14 0.15 2.07 -0.86 0.23 116.25 119.63 2jy9 h VAL 92 Ca 0.12 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.25 2jy9 h VAL 92 Cb 0.67 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2jy9 h VAL 92 CO 0.05 0.17 0.09 0.00 0.02 0.00 0.00 177.57 177.90 2jy9 h ALA 93 N 1.14 0.18 -0.36 1.67 0.00 -1.07 -1.23 119.26 119.60 2jy9 h ALA 93 Ca 0.19 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.10 2jy9 h ALA 93 Cb 0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2jy9 h ALA 93 CO -0.03 -0.32 0.18 0.28 0.00 0.00 0.00 179.25 179.36 2jy9 h VAL 94 N 0.18 0.98 -0.40 0.00 2.07 -0.75 -0.07 116.25 118.25 2jy9 h VAL 94 Ca 0.05 -0.13 0.08 0.00 0.82 0.00 0.00 66.70 67.52 2jy9 h VAL 94 Cb 0.01 0.58 -0.07 0.00 -1.52 0.00 0.00 31.29 30.29 2jy9 h VAL 94 CO -0.01 0.07 -0.05 0.40 0.02 0.00 0.00 177.57 178.00 2jy9 h ILE 95 N 0.37 0.65 -0.43 4.57 2.04 -0.34 -0.30 117.51 124.07 2jy9 h ILE 95 Ca 0.15 -0.02 -0.04 0.00 1.00 0.00 0.00 64.86 65.96 2jy9 h ILE 95 Cb 0.06 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 2jy9 h ILE 95 CO -0.11 0.01 0.11 0.11 0.00 0.00 0.00 178.15 178.27 2jy9 h LYS 96 N 0.05 0.63 -0.25 2.37 1.57 -0.71 0.29 116.57 120.52 2jy9 h LYS 96 Ca 0.19 -0.11 -0.19 0.00 -1.87 0.00 0.00 60.65 58.68 2jy9 h LYS 96 Cb 0.29 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2jy9 h LYS 96 CO -0.37 0.57 -0.58 0.93 -0.57 0.00 0.00 179.45 179.43 2jy9 h GLU 97 N 0.62 0.79 0.00 3.15 4.39 0.22 -2.04 114.58 121.71 2jy9 h GLU 97 Ca 0.14 -0.52 -0.10 0.00 0.34 0.00 0.00 59.36 59.22 2jy9 h GLU 97 Cb 0.22 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 2jy9 h GLU 97 CO -0.00 1.15 -1.00 -0.07 -1.16 0.00 0.00 179.01 177.92 2jy9 h LEU 98 N 0.60 0.00 -0.23 1.33 -0.00 -0.94 -3.08 115.31 112.98 2jy9 h LEU 98 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2jy9 h LEU 98 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.84 2jy9 h LEU 98 CO 0.12 0.36 0.00 0.41 -0.00 0.00 0.00 178.44 179.34 2jy9 n THR 99 N -2.92 0.67 -1.42 0.22 -1.04 0.08 -4.77 114.28 105.10 2jy9 n THR 99 Ca -0.04 -0.12 -0.29 0.00 -2.04 0.00 0.00 64.05 61.56 2jy9 n THR 99 Cb 0.72 -0.77 0.15 0.00 -1.82 0.00 0.00 70.33 68.60 2jy9 n THR 99 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jy9 s ALA 100 N -3.17 1.52 1.00 2.41 0.00 -0.77 -5.06 121.76 117.69 2jy9 s ALA 100 Ca 0.09 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.59 2jy9 s ALA 100 Cb 0.11 -3.06 0.00 0.00 0.00 0.00 0.00 23.12 20.17 2jy9 s ALA 100 CO 0.53 -2.45 0.00 0.39 0.00 0.00 0.00 175.76 174.24 2jy9 n GLU 101 N -3.89 -0.70 -0.73 0.00 1.02 -1.26 -4.97 120.64 110.10 2jy9 n GLU 101 Ca 0.06 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.91 2jy9 n GLU 101 Cb 0.58 0.00 0.24 0.00 -0.02 0.00 0.00 31.44 32.25 2jy9 n GLU 101 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 2jy9 s GLN 102 N -2.19 -1.23 0.00 3.49 -2.07 -1.26 -3.94 119.66 112.46 2jy9 s GLN 102 Ca 0.00 0.42 0.00 0.00 -1.82 0.00 0.00 55.36 53.96 2jy9 s GLN 102 Cb 0.00 -1.55 0.00 0.00 -1.09 0.00 0.00 33.01 30.37 2jy9 s GLN 102 CO 0.00 -3.82 0.00 1.17 -1.32 0.00 0.00 175.29 171.32 2jy9 n LYS 103 N -4.93 0.00 -2.67 9.60 4.81 -1.26 -4.93 118.16 118.79 2jy9 n LYS 103 Ca 0.07 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.09 2jy9 n LYS 103 Cb 0.57 -1.79 -0.03 0.00 0.02 0.00 0.00 35.03 33.81 2jy9 n LYS 103 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2jy9 s SER 104 N -2.42 6.39 0.20 3.14 0.15 -1.25 -4.94 113.70 114.97 2jy9 s SER 104 Ca 0.00 -1.24 0.04 0.00 0.70 0.00 0.00 55.95 55.45 2jy9 s SER 104 Cb 0.00 -2.51 -0.01 0.00 -1.71 0.00 0.00 66.02 61.78 2jy9 s SER 104 CO 0.00 -1.50 0.14 0.54 1.20 0.00 0.00 173.24 173.62 2jy9 n ARG 105 N 8.39 0.36 0.00 5.44 1.74 -1.26 -4.78 116.66 126.55 2jy9 n ARG 105 Ca 0.18 -1.89 0.00 0.00 -0.77 0.00 0.00 57.85 55.37 2jy9 n ARG 105 Cb 0.49 1.41 0.00 0.00 -1.02 0.00 0.00 32.46 33.35 2jy9 n ARG 105 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2jy9 n ARG 106 N -0.40 0.00 -1.00 5.56 0.63 -1.26 -4.92 116.66 115.27 2jy9 n ARG 106 Ca 0.02 0.00 -0.00 0.00 -0.92 0.00 0.00 57.85 56.95 2jy9 n ARG 106 Cb 0.34 0.00 -0.00 0.00 0.45 0.00 0.00 32.46 33.25 2jy9 n ARG 106 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2jy9 n ALA 107 N 0.63 -0.00 -3.71 5.13 0.00 -1.26 -4.97 120.51 116.33 2jy9 n ALA 107 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 2jy9 n ALA 107 Cb 0.00 -0.26 -0.13 0.00 0.00 0.00 0.00 19.45 19.06 2jy9 n ALA 107 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2jy9 s THR 108 N -1.85 1.47 -0.41 0.00 -4.23 -1.26 -5.02 115.64 104.35 2jy9 s THR 108 Ca 0.00 -2.71 0.03 0.00 -1.18 0.00 0.00 61.69 57.83 2jy9 s THR 108 Cb 0.00 -2.02 0.16 0.00 1.34 0.00 0.00 72.50 71.98 2jy9 s THR 108 CO 0.00 -0.93 0.30 -0.13 -0.54 0.00 0.00 174.62 173.32 2jy9 s ARG 109 N 0.18 0.88 -0.72 3.99 1.81 -1.26 -4.35 118.95 119.48 2jy9 s ARG 109 Ca 0.19 -1.91 -0.17 0.00 -1.72 0.00 0.00 55.73 52.13 2jy9 s ARG 109 Cb -0.21 -1.52 0.15 0.00 -0.45 0.00 0.00 34.95 32.92 2jy9 s ARG 109 CO -0.02 -1.31 0.77 -1.25 -0.68 0.00 0.00 175.30 172.80 2jy9 s PRO 110 N 0.33 3.30 -1.16 3.54 0.04 -1.26 -5.01 135.00 134.79 2jy9 s PRO 110 Ca 0.27 -1.81 -0.17 0.00 0.04 0.00 0.00 61.00 59.33 2jy9 s PRO 110 Cb -0.07 -4.43 0.12 0.00 0.04 0.00 0.00 34.50 30.16 2jy9 s PRO 110 CO -0.12 -1.48 1.47 0.95 0.04 0.00 0.00 177.00 177.87 2jy9 s THR 111 N 1.75 4.56 -0.44 1.26 -4.23 -1.26 -4.87 115.64 112.41 2jy9 s THR 111 Ca 0.16 -1.99 0.03 0.00 -1.18 0.00 0.00 61.69 58.70 2jy9 s THR 111 Cb -0.17 -4.99 0.13 0.00 1.34 0.00 0.00 72.50 68.80 2jy9 s THR 111 CO -0.02 -1.77 0.21 -0.13 -0.54 0.00 0.00 174.62 172.38 2jy9 s ARG 112 N 3.01 1.50 -0.28 3.99 3.00 -1.26 -5.05 118.95 123.86 2jy9 s ARG 112 Ca 0.45 -2.12 -0.01 0.00 0.00 0.00 0.00 55.73 54.05 2jy9 s ARG 112 Cb -0.01 -2.76 0.17 0.00 0.00 0.00 0.00 34.95 32.35 2jy9 s ARG 112 CO -0.01 -1.10 0.50 0.00 0.00 0.00 0.00 175.30 174.70 2jy9 s ALA 113 N 0.31 -1.75 -0.30 2.13 0.00 -1.26 -5.13 121.76 115.77 2jy9 s ALA 113 Ca 0.16 1.26 -0.15 0.00 0.00 0.00 0.00 51.96 53.23 2jy9 s ALA 113 Cb -0.24 -2.02 0.17 0.00 0.00 0.00 0.00 23.12 21.04 2jy9 s ALA 113 CO -0.03 -1.40 1.04 0.45 0.00 0.00 0.00 175.76 175.82 2jy9 s SER 114 N 2.71 -0.48 -0.30 0.00 0.15 -1.26 -5.15 113.70 109.37 2jy9 s SER 114 Ca 0.16 0.54 -0.12 0.00 0.70 0.00 0.00 55.95 57.22 2jy9 s SER 114 Cb -0.14 1.50 0.18 0.00 -1.71 0.00 0.00 66.02 65.84 2jy9 s SER 114 CO -0.21 -0.09 0.99 -0.75 1.20 0.00 0.00 173.24 174.38 2jy9 s LYS 115 N 2.54 0.25 -0.01 5.44 2.20 -1.26 -4.97 119.74 123.93 2jy9 s LYS 115 Ca -0.01 0.51 -0.17 0.00 -0.36 0.00 0.00 55.97 55.94 2jy9 s LYS 115 Cb -0.07 0.29 0.03 0.00 -1.51 0.00 0.00 37.83 36.57 2jy9 s LYS 115 CO -0.16 -0.22 0.36 -1.83 -0.36 0.00 0.00 175.35 173.15 2jy9 s GLU 116 N 2.77 0.75 0.19 4.03 -1.05 -1.26 -5.17 118.70 118.96 2jy9 s GLU 116 Ca 0.01 -0.17 -0.07 0.00 -0.15 0.00 0.00 54.97 54.59 2jy9 s GLU 116 Cb -0.09 0.33 0.03 0.00 -0.44 0.00 0.00 34.13 33.96 2jy9 s GLU 116 CO -0.14 -0.22 0.38 -2.13 0.95 0.00 0.00 175.26 174.10 2jy9 n ARG 117 N 1.12 0.54 -4.19 -4.83 0.63 -1.26 -5.13 116.66 103.54 2jy9 n ARG 117 Ca -0.21 -1.12 -0.12 0.00 -0.92 0.00 0.00 57.85 55.47 2jy9 n ARG 117 Cb 0.57 1.37 -0.10 0.00 0.45 0.00 0.00 32.46 34.74 2jy9 n ARG 117 CO 0.00 0.00 0.00 -0.98 -2.51 0.00 0.00 177.63 174.14 2jy9 s ARG 118 N -2.07 0.88 -0.29 -0.14 1.70 -1.26 -5.14 118.95 112.62 2jy9 s ARG 118 Ca 0.08 -1.30 -0.00 0.00 -0.47 0.00 0.00 55.73 54.04 2jy9 s ARG 118 Cb -0.02 -0.38 0.19 0.00 -0.57 0.00 0.00 34.95 34.17 2jy9 s ARG 118 CO 0.06 0.03 0.75 -1.17 -1.08 0.00 0.00 175.30 173.89 2jy9 s LEU 119 N -2.87 -1.21 -0.10 -1.89 2.96 -1.26 -5.13 118.68 109.18 2jy9 s LEU 119 Ca 0.10 0.20 -0.04 0.00 -0.22 0.00 0.00 54.13 54.18 2jy9 s LEU 119 Cb 0.02 1.79 0.05 0.00 0.50 0.00 0.00 46.19 48.55 2jy9 s LEU 119 CO -0.02 -0.22 0.16 -0.94 -1.32 0.00 0.00 176.35 174.01 2jy9 s SER 120 N 2.88 0.93 -0.19 3.68 1.04 -1.26 -5.13 113.70 115.65 2jy9 s SER 120 Ca 0.16 0.21 -0.04 0.00 0.48 0.00 0.00 55.95 56.75 2jy9 s SER 120 Cb -0.08 0.25 0.09 0.00 0.10 0.00 0.00 66.02 66.38 2jy9 s SER 120 CO -0.24 -0.26 0.30 -0.44 0.98 0.00 0.00 173.24 173.58 2jy9 s SER 121 N 2.29 0.52 -0.11 7.02 0.01 -1.26 -5.12 113.70 117.04 2jy9 s SER 121 Ca 0.04 0.33 -0.04 0.00 1.31 0.00 0.00 55.95 57.59 2jy9 s SER 121 Cb -0.13 0.80 0.05 0.00 0.21 0.00 0.00 66.02 66.96 2jy9 s SER 121 CO -0.07 -0.28 0.14 -1.59 0.41 0.00 0.00 173.24 171.86 2jy9 s LYS 122 N 2.45 0.04 -0.25 12.44 -2.85 -1.26 -5.11 119.74 125.20 2jy9 s LYS 122 Ca 0.05 0.35 -0.01 0.00 -1.00 0.00 0.00 55.97 55.37 2jy9 s LYS 122 Cb -0.14 -0.75 0.08 0.00 -2.06 0.00 0.00 37.83 34.95 2jy9 s LYS 122 CO -0.12 -0.44 0.04 0.00 0.10 0.00 0.00 175.35 174.94 2jy9 s ALA 123 N 2.25 1.46 -0.11 0.59 0.00 -1.26 -5.09 121.76 119.60 2jy9 s ALA 123 Ca 0.04 -1.28 -0.04 0.00 0.00 0.00 0.00 51.96 50.68 2jy9 s ALA 123 Cb -0.13 -1.43 0.06 0.00 0.00 0.00 0.00 23.12 21.61 2jy9 s ALA 123 CO -0.07 -1.39 0.22 -1.14 0.00 0.00 0.00 175.76 173.38 2jy9 s GLN 124 N 1.64 0.12 -0.12 0.00 0.74 -1.26 -5.15 119.66 115.64 2jy9 s GLN 124 Ca 0.03 0.64 0.02 0.00 0.05 0.00 0.00 55.36 56.10 2jy9 s GLN 124 Cb -0.18 -0.12 0.01 0.00 1.10 0.00 0.00 33.01 33.83 2jy9 s GLN 124 CO -0.15 -0.27 -0.16 0.21 -0.55 0.00 0.00 175.29 174.37 2jy9 s LYS 125 N 2.15 2.34 -0.32 1.67 2.36 -1.26 -5.08 119.74 121.60 2jy9 s LYS 125 Ca -0.00 -0.60 -0.01 0.00 -2.55 0.00 0.00 55.97 52.80 2jy9 s LYS 125 Cb -0.12 -1.99 0.11 0.00 -1.05 0.00 0.00 37.83 34.78 2jy9 s LYS 125 CO -0.08 -0.08 0.14 0.45 1.55 0.00 0.00 175.35 177.34 2jy9 s SER 126 N 1.02 3.69 -0.60 1.43 0.15 -1.26 -5.09 113.70 113.04 2jy9 s SER 126 Ca -0.05 -1.71 -0.16 0.00 0.70 0.00 0.00 55.95 54.73 2jy9 s SER 126 Cb -0.15 -0.65 0.15 0.00 -1.71 0.00 0.00 66.02 63.66 2jy9 s SER 126 CO -0.03 -0.39 0.56 -0.94 1.20 0.00 0.00 173.24 173.64 2jy9 s SER 127 N 1.56 6.32 0.00 5.45 1.04 -1.26 -4.76 113.70 122.05 2jy9 s SER 127 Ca 0.11 -1.98 0.00 0.00 0.48 0.00 0.00 55.95 54.56 2jy9 s SER 127 Cb -0.18 -2.21 0.00 0.00 0.10 0.00 0.00 66.02 63.72 2jy9 s SER 127 CO -0.23 -0.80 0.51 1.33 0.98 0.00 0.00 173.24 175.04 2jy9 n VAL 128 N 4.97 0.26 -3.21 5.02 0.24 -1.26 -5.02 118.33 119.33 2jy9 n VAL 128 Ca -0.08 -0.34 -0.43 0.00 -2.04 0.00 0.00 64.34 61.45 2jy9 n VAL 128 Cb 0.42 1.10 -0.07 0.00 -1.47 0.00 0.00 33.84 33.81 2jy9 n VAL 128 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2jy9 s LYS 129 N -0.26 3.13 0.05 7.34 2.36 -1.26 -5.04 119.74 126.07 2jy9 s LYS 129 Ca 0.00 -0.79 0.05 0.00 -2.55 0.00 0.00 55.97 52.68 2jy9 s LYS 129 Cb 0.00 -4.04 -0.02 0.00 -1.05 0.00 0.00 37.83 32.72 2jy9 s LYS 129 CO 0.00 -1.06 -0.13 0.00 1.55 0.00 0.00 175.35 175.70 2jy9 s ALA 130 N 2.46 1.10 0.17 3.13 0.00 -1.26 -5.16 121.76 122.19 2jy9 s ALA 130 Ca 0.15 -0.87 -0.10 0.00 0.00 0.00 0.00 51.96 51.14 2jy9 s ALA 130 Cb -0.18 -0.13 -0.00 0.00 0.00 0.00 0.00 23.12 22.81 2jy9 s ALA 130 CO 0.13 0.17 0.32 -0.48 0.00 0.00 0.00 175.76 175.90 2jy9 s LEU 131 N -1.38 0.84 0.00 0.00 0.05 -1.26 -5.18 118.68 111.76 2jy9 s LEU 131 Ca -0.01 -0.83 0.03 0.00 0.05 0.00 0.00 54.13 53.37 2jy9 s LEU 131 Cb -0.09 1.31 -0.01 0.00 -2.05 0.00 0.00 46.19 45.35 2jy9 s LEU 131 CO 0.02 -0.92 0.19 0.54 -0.55 0.00 0.00 176.35 175.63 2jy9 n ARG 132 N -0.23 0.28 0.00 1.48 1.74 -1.26 -5.14 116.66 113.53 2jy9 n ARG 132 Ca -0.07 -1.76 0.00 0.00 -0.77 0.00 0.00 57.85 55.25 2jy9 n ARG 132 Cb 0.63 1.52 0.00 0.00 -1.02 0.00 0.00 32.46 33.58 2jy9 n ARG 132 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jy9 n GLY 133 N -0.34 0.65 2.63 -0.13 0.00 -1.26 -5.14 105.19 101.61 2jy9 n GLY 133 Ca 0.03 0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 0.57 -0.02 1.61 2.20 -1.26 -5.11 119.74 117.73 2jy9 s LYS 134 Ca 0.00 -1.00 0.01 0.00 -0.36 0.00 0.00 55.97 54.62 2jy9 s LYS 134 Cb 0.00 -1.65 0.01 0.00 -1.51 0.00 0.00 37.83 34.68 2jy9 s LYS 134 CO 0.00 -1.04 -0.02 0.54 -0.36 0.00 0.00 175.35 174.47 2jy9 s VAL 135 N 1.60 0.25 -0.39 4.02 0.11 -1.26 -5.12 120.40 119.62 2jy9 s VAL 135 Ca 0.11 -0.04 -0.17 0.00 -2.93 0.00 0.00 61.98 58.95 2jy9 s VAL 135 Cb -0.18 -0.27 0.01 0.00 -1.53 0.00 0.00 36.38 34.40 2jy9 s VAL 135 CO -0.24 0.12 0.41 -0.13 -3.33 0.00 0.00 175.10 171.93 2jy9 s ARG 136 N 0.47 3.29 -0.35 1.54 0.52 -1.26 -5.01 118.95 118.15 2jy9 s ARG 136 Ca -0.05 -0.61 0.00 0.00 -0.52 0.00 0.00 55.73 54.56 2jy9 s ARG 136 Cb -0.08 -3.90 0.14 0.00 0.52 0.00 0.00 34.95 31.64 2jy9 s ARG 136 CO -0.01 -0.72 0.24 0.50 0.02 0.00 0.00 175.30 175.33 2jy9 s ARG 137 N 2.10 0.55 -0.19 3.54 6.06 -1.26 -5.12 118.95 124.64 2jy9 s ARG 137 Ca 0.12 -1.22 -0.19 0.00 -2.50 0.00 0.00 55.73 51.94 2jy9 s ARG 137 Cb -0.17 -1.19 -0.03 0.00 0.06 0.00 0.00 34.95 33.62 2jy9 s ARG 137 CO 0.13 -1.20 0.54 -1.25 -2.50 0.00 0.00 175.30 171.01 2jy9 s PRO 138 N 1.16 4.22 -0.55 5.12 0.04 -1.26 -5.04 135.00 138.69 2jy9 s PRO 138 Ca 0.18 0.47 -0.07 0.00 0.04 0.00 0.00 61.00 61.62 2jy9 s PRO 138 Cb -0.21 -3.55 0.14 0.00 0.04 0.00 0.00 34.50 30.92 2jy9 s PRO 138 CO -0.00 -0.13 0.40 -0.51 0.04 0.00 0.00 177.00 176.80 2jy9 s LEU 139 N 1.55 5.62 -0.08 -3.56 1.02 -1.26 -5.07 118.68 116.90 2jy9 s LEU 139 Ca 0.25 -2.29 -0.05 0.00 0.02 0.00 0.00 54.13 52.06 2jy9 s LEU 139 Cb -0.16 -1.96 -0.04 0.00 0.02 0.00 0.00 46.19 44.06 2jy9 s LEU 139 CO 0.10 -0.56 0.13 1.51 0.02 0.00 0.00 176.35 177.55 2jy9 s ASP 140 N 1.92 6.21 -0.33 2.29 -4.77 -1.26 -5.07 116.67 115.66 2jy9 s ASP 140 Ca 0.11 0.38 0.00 0.00 -3.30 0.00 0.00 52.55 49.75 2jy9 s ASP 140 Cb -0.22 -1.96 0.14 0.00 -1.09 0.00 0.00 42.92 39.79 2jy9 s ASP 140 CO -0.03 0.37 0.29 -1.48 0.70 0.00 0.00 175.17 175.02 2jy9 s LEU 141 N -1.26 0.09 0.51 2.11 2.34 -1.26 -5.14 118.68 116.07 2jy9 s LEU 141 Ca 0.18 -1.31 0.06 0.00 0.06 0.00 0.00 54.13 53.12 2jy9 s LEU 141 Cb -0.12 0.29 0.02 0.00 -0.56 0.00 0.00 46.19 45.82 2jy9 s LEU 141 CO 0.08 -0.34 0.39 -1.83 -1.06 0.00 0.00 176.35 173.58 2jy9 s GLU 142 N 1.82 2.30 -0.01 1.48 -1.05 -1.26 -5.14 118.70 116.83 2jy9 s GLU 142 Ca 0.13 -1.92 0.02 0.00 -0.15 0.00 0.00 54.97 53.06 2jy9 s GLU 142 Cb -0.16 -2.14 -0.00 0.00 -0.44 0.00 0.00 34.13 31.38 2jy9 s GLU 142 CO -0.18 -0.51 -0.08 -3.38 0.95 0.00 0.00 175.26 172.05 2jy9 s HIS 143 N -2.71 0.77 -0.06 4.83 -3.43 -1.26 -5.14 115.29 108.30 2jy9 s HIS 143 Ca 0.37 -0.16 -0.03 0.00 -0.80 0.00 0.00 55.06 54.45 2jy9 s HIS 143 Cb -0.02 -0.52 0.04 0.00 -1.43 0.00 0.00 32.58 30.65 2jy9 s HIS 143 CO 0.23 -0.03 0.10 -1.58 -2.00 0.00 0.00 174.74 171.45 2jy9 s HIS 144 N -0.08 -0.05 -0.23 0.38 5.04 -1.26 -5.13 115.29 113.96 2jy9 s HIS 144 Ca 0.01 0.41 -0.30 0.00 -1.54 0.00 0.00 55.06 53.64 2jy9 s HIS 144 Cb -0.05 -0.37 0.16 0.00 0.04 0.00 0.00 32.58 32.37 2jy9 s HIS 144 CO -0.00 -0.22 1.22 -3.38 -2.34 0.00 0.00 174.74 170.02 2jy9 s HIS 145 N 2.14 -0.16 0.10 3.88 -3.43 -1.26 -5.15 115.29 111.42 2jy9 s HIS 145 Ca 0.03 0.25 -0.26 0.00 -0.80 0.00 0.00 55.06 54.28 2jy9 s HIS 145 Cb -0.12 0.48 -0.06 0.00 -1.43 0.00 0.00 32.58 31.45 2jy9 s HIS 145 CO -0.04 -0.16 0.81 -1.58 -2.00 0.00 0.00 174.74 171.78 2jy9 s HIS 146 N -1.20 3.81 -0.15 0.38 2.46 -1.26 -5.01 115.29 114.31 2jy9 s HIS 146 Ca 0.05 1.60 -0.28 0.00 0.47 0.00 0.00 55.06 56.90 2jy9 s HIS 146 Cb -0.01 -2.86 -0.01 0.00 -0.13 0.00 0.00 32.58 29.58 2jy9 s HIS 146 CO -0.04 0.34 0.96 -1.58 -2.47 0.00 0.00 174.74 171.94 2jy9 s HIS 147 N -0.39 3.45 0.00 3.88 2.46 -1.26 -5.35 115.29 118.07 2jy9 s HIS 147 Ca 0.39 1.46 0.00 0.00 0.47 0.00 0.00 55.06 57.39 2jy9 s HIS 147 Cb -0.22 -3.15 0.00 0.00 -0.13 0.00 0.00 32.58 29.08 2jy9 s HIS 147 CO 0.26 -0.29 0.27 0.72 -2.47 0.00 0.00 174.74 173.23