#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jna n LYS 2 N 0.00 -2.60 -3.36 3.17 5.02 -1.26 -4.97 118.16 114.17 2jna n LYS 2 Ca 0.00 2.24 -0.43 0.00 -2.02 0.00 0.00 58.31 58.09 2jna n LYS 2 Cb 0.00 -5.18 -0.09 0.00 -0.02 0.00 0.00 35.03 29.74 2jna n LYS 2 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2jna s LYS 3 N -2.06 3.04 -0.19 1.97 -2.85 -1.26 -5.03 119.74 113.37 2jna s LYS 3 Ca 0.13 -0.95 0.01 0.00 -1.00 0.00 0.00 55.97 54.16 2jna s LYS 3 Cb -0.04 -4.01 0.04 0.00 -2.06 0.00 0.00 37.83 31.76 2jna s LYS 3 CO 0.71 -0.89 -0.10 0.50 0.10 0.00 0.00 175.35 175.67 2jna s ARG 4 N 1.96 1.98 -0.22 1.78 6.06 -1.26 -4.90 118.95 124.36 2jna s ARG 4 Ca 0.09 -0.75 -0.03 0.00 -2.50 0.00 0.00 55.73 52.54 2jna s ARG 4 Cb -0.19 -2.31 0.01 0.00 0.06 0.00 0.00 34.95 32.52 2jna s ARG 4 CO 0.11 -0.40 0.05 -0.89 -2.50 0.00 0.00 175.30 171.68 2jna n ILE 5 N 4.72-10.16 -4.32 4.11 5.41 -1.26 -5.09 119.36 112.77 2jna n ILE 5 Ca -0.15 1.66 -0.20 0.00 1.00 0.00 0.00 62.75 65.06 2jna n ILE 5 Cb 0.47 -6.20 -0.08 0.00 -0.71 0.00 0.00 39.64 33.12 2jna n ILE 5 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 176.55 176.82 2jna s ILE 6 N -1.07 0.09 -1.25 1.39 -4.36 -1.26 -4.95 121.20 109.79 2jna s ILE 6 Ca -0.06 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.32 2jna s ILE 6 Cb 0.00 -2.47 -0.00 0.00 1.25 0.00 0.00 42.46 41.24 2jna s ILE 6 CO 0.62 0.00 0.82 0.00 0.24 0.00 0.00 174.94 176.62 2jna n ALA 7 N -0.67 -2.05 -2.54 2.27 0.00 -1.26 -5.00 120.51 111.26 2jna n ALA 7 Ca 0.05 -0.12 -0.31 0.00 0.00 0.00 0.00 53.44 53.06 2jna n ALA 7 Cb 0.63 -2.33 -0.11 0.00 0.00 0.00 0.00 19.45 17.64 2jna n ALA 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jna s ALA 8 N -3.54 2.85 -0.17 0.00 0.00 -1.26 -5.11 121.76 114.52 2jna s ALA 8 Ca 0.03 -1.13 -0.04 0.00 0.00 0.00 0.00 51.96 50.82 2jna s ALA 8 Cb -0.01 -0.94 0.07 0.00 0.00 0.00 0.00 23.12 22.24 2jna s ALA 8 CO 0.78 0.61 0.14 0.00 0.00 0.00 0.00 175.76 177.28 2jna s ALA 9 N -1.02 0.15 -0.28 0.00 0.00 -1.26 -5.00 121.76 114.35 2jna s ALA 9 Ca 0.17 -0.04 0.20 0.00 0.00 0.00 0.00 51.96 52.29 2jna s ALA 9 Cb -0.11 -1.10 0.49 0.00 0.00 0.00 0.00 23.12 22.41 2jna s ALA 9 CO 0.08 -1.12 1.09 -0.11 0.00 0.00 0.00 175.76 175.70 2jna n LEU 10 N 5.30 1.95 -4.56 0.00 7.94 -1.26 -5.05 117.00 121.32 2jna n LEU 10 Ca -0.06 -3.35 -0.40 0.00 -1.11 0.00 0.00 56.01 51.08 2jna n LEU 10 Cb 0.49 0.37 -0.03 0.00 0.53 0.00 0.00 43.42 44.78 2jna n LEU 10 CO 0.09 1.25 1.35 -1.48 -1.11 0.00 0.00 177.39 177.48 2jna s LEU 11 N -3.67 3.34 -0.24 -1.96 0.05 -1.26 -4.90 118.68 110.03 2jna s LEU 11 Ca 0.30 -0.94 -0.06 0.00 0.05 0.00 0.00 54.13 53.48 2jna s LEU 11 Cb 0.35 -2.56 0.12 0.00 -2.05 0.00 0.00 46.19 42.05 2jna s LEU 11 CO -0.02 -1.72 0.48 0.00 -0.55 0.00 0.00 176.35 174.53 2jna s ALA 12 N 5.60 -1.45 -0.29 1.48 0.00 -1.26 -5.15 121.76 120.70 2jna s ALA 12 Ca 0.43 1.57 -0.20 0.00 0.00 0.00 0.00 51.96 53.76 2jna s ALA 12 Cb -0.04 -1.60 0.17 0.00 0.00 0.00 0.00 23.12 21.65 2jna s ALA 12 CO 0.02 -0.98 1.16 -0.08 0.00 0.00 0.00 175.76 175.89 2jna s THR 13 N 2.68 0.00 -0.44 0.00 -1.32 -1.26 -5.12 115.64 110.18 2jna s THR 13 Ca 0.04 0.00 -0.08 0.00 -1.21 0.00 0.00 61.69 60.44 2jna s THR 13 Cb -0.13 -1.00 0.10 0.00 -1.51 0.00 0.00 72.50 69.96 2jna s THR 13 CO -0.16 0.00 0.29 -0.69 -2.21 0.00 0.00 174.62 171.85 2jna s VAL 14 N 0.73 4.04 0.19 5.08 1.01 -1.26 -5.04 120.40 125.17 2jna s VAL 14 Ca -0.02 -1.70 -0.24 0.00 0.00 0.00 0.00 61.98 60.02 2jna s VAL 14 Cb -0.04 -3.61 0.05 0.00 0.00 0.00 0.00 36.38 32.78 2jna s VAL 14 CO -0.12 -0.66 0.90 0.00 0.00 0.00 0.00 175.10 175.22 2jna s ALA 15 N 1.35 -1.52 -0.70 5.51 0.00 -1.26 -5.10 121.76 120.04 2jna s ALA 15 Ca 0.05 -0.03 0.05 0.00 0.00 0.00 0.00 51.96 52.03 2jna s ALA 15 Cb -0.25 0.70 0.18 0.00 0.00 0.00 0.00 23.12 23.75 2jna s ALA 15 CO -0.00 -1.04 0.53 -1.13 0.00 0.00 0.00 175.76 174.11 2jna n SER 16 N -0.52 3.11 -4.13 0.00 3.41 -1.26 -5.06 113.62 109.18 2jna n SER 16 Ca -0.05 -3.24 -0.19 0.00 -0.26 0.00 0.00 58.87 55.13 2jna n SER 16 Cb 0.60 -0.75 -0.13 0.00 -0.26 0.00 0.00 64.21 63.68 2jna n SER 16 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2jna s PHE 17 N -1.60 1.12 0.00 7.33 0.08 -1.26 -5.02 117.98 118.62 2jna s PHE 17 Ca 0.27 -0.38 0.00 0.00 0.12 0.00 0.00 56.93 56.94 2jna s PHE 17 Cb -0.02 -0.65 0.00 0.00 -0.57 0.00 0.00 43.02 41.78 2jna s PHE 17 CO -0.15 0.02 0.00 0.43 -0.10 0.00 0.00 175.22 175.42 2jna n SER 18 N 1.75 0.00 -3.64 1.36 7.64 -1.26 -5.11 113.62 114.36 2jna n SER 18 Ca -0.19 0.00 -0.20 0.00 1.01 0.00 0.00 58.87 59.49 2jna n SER 18 Cb 0.55 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.58 2jna n SER 18 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2jna s THR 19 N -0.53 -0.16 0.13 0.44 -4.23 -1.26 -4.93 115.64 105.09 2jna s THR 19 Ca 0.00 0.23 0.00 0.00 -1.18 0.00 0.00 61.69 60.74 2jna s THR 19 Cb 0.00 -0.33 0.00 0.00 1.34 0.00 0.00 72.50 73.51 2jna s THR 19 CO 0.00 0.03 0.00 -0.11 -0.54 0.00 0.00 174.62 174.00 2jna n LEU 20 N 5.30 -1.14 0.00 4.79 7.94 -1.26 -5.16 117.00 127.48 2jna n LEU 20 Ca -0.05 0.29 0.00 0.00 -1.11 0.00 0.00 56.01 55.15 2jna n LEU 20 Cb 0.50 1.33 0.00 0.00 0.53 0.00 0.00 43.42 45.78 2jna n LEU 20 CO 0.07 -0.14 0.00 0.00 -1.11 0.00 0.00 177.39 176.21 2jna n ALA 21 N -2.71 0.00 -1.89 1.96 0.00 -1.26 -5.11 120.51 111.50 2jna n ALA 21 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 2jna n ALA 21 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 2jna n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jna n ALA 22 N -3.00 -3.17 -2.21 0.00 0.00 -1.26 -5.10 120.51 105.76 2jna n ALA 22 Ca 0.00 0.26 -0.13 0.00 0.00 0.00 0.00 53.44 53.58 2jna n ALA 22 Cb 0.00 -0.52 -0.10 0.00 0.00 0.00 0.00 19.45 18.83 2jna n ALA 22 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2jna s GLU 23 N -0.59 0.97 0.00 0.00 2.02 -1.26 -5.13 118.70 114.71 2jna s GLU 23 Ca -0.01 -1.41 0.00 0.00 0.02 0.00 0.00 54.97 53.56 2jna s GLU 23 Cb 0.00 -0.39 0.00 0.00 0.10 0.00 0.00 34.13 33.84 2jna s GLU 23 CO 0.26 0.00 0.00 0.94 0.02 0.00 0.00 175.26 176.48 2jna n GLN 24 N -0.14 0.00 -4.50 1.61 0.00 -1.26 -5.10 117.38 107.99 2jna n GLN 24 Ca -0.10 0.00 -0.29 0.00 -0.00 0.00 0.00 57.00 56.60 2jna n GLN 24 Cb 0.61 0.00 -0.17 0.00 0.00 0.00 0.00 30.24 30.68 2jna n GLN 24 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.06 177.20 2jna s VAL 25 N -1.29 1.63 0.00 1.69 -7.23 -1.26 -5.06 120.40 108.89 2jna s VAL 25 Ca 0.00 -0.72 0.00 0.00 -1.81 0.00 0.00 61.98 59.45 2jna s VAL 25 Cb 0.00 -1.48 0.00 0.00 0.56 0.00 0.00 36.38 35.46 2jna s VAL 25 CO 0.00 0.47 0.00 -0.24 -0.31 0.00 0.00 175.10 175.02 2jna n SER 26 N 4.18 0.00 -0.00 4.85 2.88 -1.26 -4.38 113.62 119.89 2jna n SER 26 Ca -0.19 -0.79 -0.10 0.00 -1.33 0.00 0.00 58.87 56.45 2jna n SER 26 Cb 0.51 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 64.02 2jna n SER 26 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2jna h LYS 27 N 0.00 0.59 0.03 -1.46 3.11 -2.00 -3.26 116.57 113.58 2jna h LYS 27 Ca 0.00 -0.37 -0.00 0.00 -2.81 0.00 0.00 60.65 57.47 2jna h LYS 27 Cb 0.00 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 31.27 2jna h LYS 27 CO 0.00 0.99 -0.01 1.96 -2.81 0.00 0.00 179.45 179.57 2jna h GLN 28 N 0.45 -0.03 -0.65 1.90 7.50 -2.00 -2.90 115.11 119.38 2jna h GLN 28 Ca 0.01 0.00 0.03 0.00 0.50 0.00 0.00 58.65 59.19 2jna h GLN 28 Cb 1.10 0.01 -0.03 0.00 0.05 0.00 0.00 27.48 28.61 2jna h GLN 28 CO 0.11 0.20 0.43 0.93 -1.50 0.00 0.00 178.83 178.99 2jna h GLU 29 N -0.26 0.77 0.39 1.46 3.07 -1.97 0.12 114.58 118.16 2jna h GLU 29 Ca -0.00 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.80 2jna h GLU 29 Cb 0.25 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 27.97 2jna h GLU 29 CO 0.01 0.51 -0.32 0.82 -1.40 0.00 0.00 179.01 178.63 2jna h ILE 30 N 0.80 0.34 -0.01 3.13 2.04 -1.55 0.19 117.51 122.45 2jna h ILE 30 Ca 0.25 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.96 2jna h ILE 30 Cb 0.03 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 36.43 2jna h ILE 30 CO -0.07 0.00 -0.69 0.28 0.00 0.00 0.00 178.15 177.67 2jna h SER 31 N -0.71 0.05 0.01 1.72 0.02 -1.40 -2.04 113.55 111.20 2jna h SER 31 Ca -0.03 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2jna h SER 31 Cb 0.62 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.15 2jna h SER 31 CO -0.02 0.73 -0.00 -0.74 -1.14 0.00 0.00 176.83 175.65 2jna h HIS 32 N 0.03 -0.01 -0.00 3.45 6.17 -0.58 -3.35 115.15 120.85 2jna h HIS 32 Ca -0.01 -0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.07 2jna h HIS 32 Cb 1.23 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.16 2jna h HIS 32 CO 0.00 0.77 -0.51 1.19 0.71 0.00 0.00 177.93 180.10 2jna n PHE 33 N -4.67 0.00 -3.17 5.26 3.72 0.65 -4.98 117.46 114.28 2jna n PHE 33 Ca -0.08 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.24 2jna n PHE 33 Cb 0.38 -0.14 0.03 0.00 -0.94 0.00 0.00 39.48 38.82 2jna n PHE 33 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2jna n LYS 34 N -1.06 -1.76 -2.04 -1.08 4.76 -0.78 -4.78 118.16 111.43 2jna n LYS 34 Ca 0.08 1.18 -0.39 0.00 -2.87 0.00 0.00 58.31 56.31 2jna n LYS 34 Cb 0.35 -5.74 0.01 0.00 -1.84 0.00 0.00 35.03 27.81 2jna n LYS 34 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2jna s LEU 35 N -4.71 4.07 -0.33 -0.35 1.43 -1.12 -4.61 118.68 113.07 2jna s LEU 35 Ca 0.22 2.60 -0.29 0.00 -1.03 0.00 0.00 54.13 55.63 2jna s LEU 35 Cb -0.03 -4.08 -0.00 0.00 0.03 0.00 0.00 46.19 42.11 2jna s LEU 35 CO 0.75 -1.04 1.47 -0.69 0.23 0.00 0.00 176.35 177.07 2jna s VAL 36 N -1.34 3.88 -0.39 -1.59 1.01 -0.64 -4.87 120.40 116.46 2jna s VAL 36 Ca 0.62 0.94 -0.29 0.00 0.00 0.00 0.00 61.98 63.26 2jna s VAL 36 Cb -0.36 -4.01 0.02 0.00 0.00 0.00 0.00 36.38 32.02 2jna s VAL 36 CO 0.45 -0.53 1.18 -0.75 0.00 0.00 0.00 175.10 175.44 2jna s LYS 37 N 4.74 3.85 0.01 2.72 2.47 -1.26 -0.48 119.74 131.78 2jna s LYS 37 Ca 0.64 0.89 0.22 0.00 -1.56 0.00 0.00 55.97 56.16 2jna s LYS 37 Cb -0.18 -3.86 -0.14 0.00 -1.46 0.00 0.00 37.83 32.19 2jna s LYS 37 CO 0.29 -1.20 0.87 1.33 0.16 0.00 0.00 175.35 176.80 2jna n VAL 38 N 6.45 0.04 -1.01 4.02 0.24 -1.11 -4.99 118.33 121.97 2jna n VAL 38 Ca 0.13 -0.16 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 2jna n VAL 38 Cb 0.48 0.56 0.00 0.00 -1.47 0.00 0.00 33.84 33.40 2jna n VAL 38 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2jna n GLY 39 N 1.42 0.31 2.93 7.63 0.00 -1.23 -4.98 105.19 111.27 2jna n GLY 39 Ca 0.02 -1.73 -0.15 0.00 0.00 0.00 0.00 46.02 44.16 2jna n GLY 39 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jna s THR 40 N -2.19 0.29 0.20 2.61 2.01 -1.26 -0.50 115.64 116.79 2jna s THR 40 Ca 0.00 -0.14 0.10 0.00 0.31 0.00 0.00 61.69 61.96 2jna s THR 40 Cb 0.00 -0.25 -0.04 0.00 0.01 0.00 0.00 72.50 72.21 2jna s THR 40 CO 0.00 0.09 -0.21 0.27 -0.69 0.00 0.00 174.62 174.08 2jna s ILE 41 N -0.02 2.17 -0.01 1.82 -4.36 0.00 -4.92 121.20 115.88 2jna s ILE 41 Ca 0.01 -2.06 -0.01 0.00 -0.26 0.00 0.00 60.65 58.32 2jna s ILE 41 Cb -0.02 -2.05 0.00 0.00 1.25 0.00 0.00 42.46 41.64 2jna s ILE 41 CO -0.00 -0.25 0.04 0.54 0.24 0.00 0.00 174.94 175.51 2jna s ASN 42 N -2.82 -0.03 -0.19 4.36 2.20 -1.26 -0.97 114.94 116.23 2jna s ASN 42 Ca 0.20 0.06 -0.16 0.00 -0.94 0.00 0.00 52.86 52.03 2jna s ASN 42 Cb -0.06 0.09 -0.04 0.00 -2.00 0.00 0.00 41.25 39.23 2jna s ASN 42 CO 0.09 -0.03 0.38 -0.69 -2.94 0.00 0.00 177.10 173.92 2jna s VAL 43 N -0.05 5.22 -0.16 3.54 1.01 0.26 -4.92 120.40 125.30 2jna s VAL 43 Ca -0.01 0.69 0.23 0.00 0.00 0.00 0.00 61.98 62.89 2jna s VAL 43 Cb -0.01 -3.71 0.47 0.00 0.00 0.00 0.00 36.38 33.13 2jna s VAL 43 CO 0.00 0.28 1.14 -1.54 0.00 0.00 0.00 175.10 174.98 2jna n SER 44 N 4.28 1.48 -4.97 3.32 3.41 -1.23 -1.20 113.62 118.71 2jna n SER 44 Ca -0.09 -2.13 -0.21 0.00 -0.26 0.00 0.00 58.87 56.18 2jna n SER 44 Cb 0.51 -0.41 -0.02 0.00 -0.26 0.00 0.00 64.21 64.04 2jna n SER 44 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2jna s GLN 45 N -2.30 3.44 0.99 4.33 1.11 -1.23 -4.81 119.66 121.19 2jna s GLN 45 Ca 0.31 -0.73 -0.14 0.00 0.01 0.00 0.00 55.36 54.81 2jna s GLN 45 Cb 0.35 -2.88 0.18 0.00 -1.01 0.00 0.00 33.01 29.65 2jna s GLN 45 CO -0.09 0.42 1.14 0.45 0.01 0.00 0.00 175.29 177.22 2jna s SER 46 N -3.94 2.78 0.00 5.90 0.15 -1.26 -0.19 113.70 117.14 2jna s SER 46 Ca 0.34 0.89 0.00 0.00 0.70 0.00 0.00 55.95 57.88 2jna s SER 46 Cb -0.09 -1.38 0.00 0.00 -1.71 0.00 0.00 66.02 62.84 2jna s SER 46 CO 0.29 -3.00 0.45 0.61 1.20 0.00 0.00 173.24 172.80 2jna n GLY 47 N -1.87 1.20 0.02 9.45 0.00 -0.60 -1.95 105.19 111.44 2jna n GLY 47 Ca 0.08 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.16 2jna n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jna n GLY 48 N 0.23 -0.80 0.01 -0.02 0.00 -1.26 -4.35 105.19 99.00 2jna n GLY 48 Ca 0.00 -0.39 0.09 0.00 0.00 0.00 0.00 46.02 45.72 2jna n GLY 48 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2jna n GLN 49 N -2.20 0.59 -3.87 1.61 6.02 -0.82 -4.72 117.38 113.99 2jna n GLN 49 Ca -0.07 -0.17 -0.30 0.00 -0.01 0.00 0.00 57.00 56.44 2jna n GLN 49 Cb 0.56 -1.46 -0.15 0.00 1.02 0.00 0.00 30.24 30.22 2jna n GLN 49 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2jna s ILE 50 N -3.32 1.68 -0.05 5.09 -1.09 -1.11 -4.79 121.20 117.61 2jna s ILE 50 Ca -0.07 -2.09 -0.05 0.00 -2.23 0.00 0.00 60.65 56.20 2jna s ILE 50 Cb 0.12 -2.24 -0.02 0.00 -1.58 0.00 0.00 42.46 38.75 2jna s ILE 50 CO 0.80 -0.68 -0.10 -1.20 -1.23 0.00 0.00 174.94 172.53 2jna n SER 51 N 4.30 0.63 -4.81 3.58 7.64 -1.26 -4.39 113.62 119.31 2jna n SER 51 Ca 0.02 0.10 -0.22 0.00 1.01 0.00 0.00 58.87 59.79 2jna n SER 51 Cb 0.40 -0.51 -0.05 0.00 -1.01 0.00 0.00 64.21 63.05 2jna n SER 51 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2jna s SER 52 N -4.77 5.06 0.47 6.43 0.01 -1.26 -5.00 113.70 114.63 2jna s SER 52 Ca -0.08 -0.60 0.19 0.00 1.31 0.00 0.00 55.95 56.76 2jna s SER 52 Cb 0.01 -0.88 1.17 0.00 0.21 0.00 0.00 66.02 66.53 2jna s SER 52 CO 0.12 -0.33 1.97 1.55 0.41 0.00 0.00 173.24 176.96 2jna h PRO 53 N 1.36 0.25 -0.65 12.44 0.13 -2.00 -0.73 132.00 142.80 2jna h PRO 53 Ca -0.44 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2jna h PRO 53 Cb 1.25 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 2jna h PRO 53 CO 0.60 0.17 0.40 0.77 -0.23 0.00 0.00 178.00 179.71 2jna h SER 54 N 0.26 0.78 -0.46 1.44 0.02 -2.00 -2.56 113.55 111.03 2jna h SER 54 Ca 0.29 -0.06 -0.04 0.00 -0.84 0.00 0.00 61.79 61.14 2jna h SER 54 Cb 0.80 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.12 2jna h SER 54 CO -0.06 0.60 0.14 0.44 -1.14 0.00 0.00 176.83 176.81 2jna h ASP 55 N 0.88 0.72 -0.31 3.07 3.32 -1.51 -2.22 116.42 120.37 2jna h ASP 55 Ca 0.23 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 2jna h ASP 55 Cb -0.04 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.31 2jna h ASP 55 CO -0.04 0.70 0.19 0.25 -1.72 0.00 0.00 179.24 178.61 2jna h LEU 56 N 0.75 0.37 -0.71 1.55 5.85 -1.25 -1.58 115.31 120.30 2jna h LEU 56 Ca 0.17 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 2jna h LEU 56 Cb 0.26 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 2jna h LEU 56 CO -0.00 0.32 0.44 -0.09 -0.34 0.00 0.00 178.44 178.76 2jna h ARG 57 N 0.40 0.96 -0.40 1.25 2.43 -1.11 0.07 114.38 117.98 2jna h ARG 57 Ca 0.11 -0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 2jna h ARG 57 Cb 0.01 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 2jna h ARG 57 CO -0.02 0.67 0.09 0.93 -1.51 0.00 0.00 179.97 180.12 2jna h GLU 58 N 0.97 0.59 -0.03 0.20 4.39 -1.10 -0.59 114.58 119.01 2jna h GLU 58 Ca 0.26 -0.10 -0.17 0.00 0.34 0.00 0.00 59.36 59.69 2jna h GLU 58 Cb -0.06 -0.10 0.01 0.00 -0.10 0.00 0.00 28.75 28.51 2jna h GLU 58 CO -0.05 0.55 -0.63 0.87 -1.16 0.00 0.00 179.01 178.58 2jna h LYS 59 N 0.57 0.47 -0.30 2.33 1.79 -0.65 -2.66 116.57 118.12 2jna h LYS 59 Ca 0.13 -0.48 -0.01 0.00 -2.18 0.00 0.00 60.65 58.11 2jna h LYS 59 Cb 0.23 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.00 2jna h LYS 59 CO -0.00 1.12 0.14 -0.07 -1.08 0.00 0.00 179.45 179.56 2jna h LEU 60 N 0.01 0.41 -0.70 2.94 3.38 -0.74 -1.59 115.31 119.01 2jna h LEU 60 Ca -0.07 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.68 2jna h LEU 60 Cb 1.32 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.94 2jna h LEU 60 CO 0.13 0.43 0.15 0.77 0.09 0.00 0.00 178.44 180.01 2jna h SER 61 N 0.35 1.08 -0.62 -0.43 4.64 -1.21 0.12 113.55 117.48 2jna h SER 61 Ca 0.10 -0.24 0.03 0.00 -0.47 0.00 0.00 61.79 61.21 2jna h SER 61 Cb 0.14 -0.29 -0.04 0.00 -0.31 0.00 0.00 62.40 61.91 2jna h SER 61 CO -0.01 1.05 0.38 -0.08 -0.87 0.00 0.00 176.83 177.29 2jna h GLU 62 N 1.07 0.73 -0.05 4.77 4.81 -1.24 0.43 114.58 125.10 2jna h GLU 62 Ca 0.22 -0.04 -0.21 0.00 -0.13 0.00 0.00 59.36 59.20 2jna h GLU 62 Cb 0.40 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.61 2jna h GLU 62 CO 0.01 0.48 -0.83 -0.07 -0.73 0.00 0.00 179.01 177.87 2jna h LEU 63 N 0.75 0.57 -0.18 1.64 3.38 -0.97 -2.51 115.31 118.00 2jna h LEU 63 Ca 0.25 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 2jna h LEU 63 Cb 0.01 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2jna h LEU 63 CO -0.10 1.18 -0.01 0.00 0.09 0.00 0.00 178.44 179.61 2jna h ALA 64 N 0.80 0.24 -0.39 1.53 0.00 -0.49 -2.63 119.26 118.32 2jna h ALA 64 Ca -0.06 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 2jna h ALA 64 Cb 1.44 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 2jna h ALA 64 CO 0.15 -0.04 0.01 0.22 0.00 0.00 0.00 179.25 179.58 2jna h ASP 65 N 0.06 0.59 0.00 0.00 3.58 -0.97 -0.88 116.42 118.79 2jna h ASP 65 Ca 0.05 -0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.38 2jna h ASP 65 Cb 0.40 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.29 2jna h ASP 65 CO 0.01 0.65 0.00 0.00 -2.88 0.00 0.00 179.24 177.02 2jna n ALA 66 N -2.47 2.52 0.01 -0.78 0.00 -0.94 -2.48 120.51 116.36 2jna n ALA 66 Ca 0.02 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2jna n ALA 66 Cb 0.26 -1.25 0.01 0.00 0.00 0.00 0.00 19.45 18.46 2jna n ALA 66 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jna n LYS 67 N -0.76 0.63 0.00 0.00 4.76 -0.36 -5.00 118.16 117.43 2jna n LYS 67 Ca 0.12 -0.93 0.00 0.00 -2.87 0.00 0.00 58.31 54.63 2jna n LYS 67 Cb 0.05 -1.01 0.00 0.00 -1.84 0.00 0.00 35.03 32.23 2jna n LYS 67 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jna n GLY 68 N -0.15 2.74 4.00 0.72 0.00 -1.04 -4.87 105.19 106.59 2jna n GLY 68 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 2jna n GLY 68 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jna s GLY 69 N -2.26 1.74 0.11 -0.02 0.00 -1.04 -4.98 107.32 100.88 2jna s GLY 69 Ca 0.00 -1.88 0.00 0.00 0.00 0.00 0.00 44.72 42.84 2jna s GLY 69 CO 0.00 -1.25 0.00 0.28 0.00 0.00 0.00 173.10 172.13 2jna n LYS 70 N -2.89 0.00 -2.69 2.90 4.76 -1.24 -3.72 118.16 115.28 2jna n LYS 70 Ca 0.17 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.38 2jna n LYS 70 Cb 0.61 -0.45 0.03 0.00 -1.84 0.00 0.00 35.03 33.38 2jna n LYS 70 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2jna s TYR 71 N -2.00 3.04 0.06 2.13 1.51 -0.92 -4.80 117.35 116.38 2jna s TYR 71 Ca 0.00 0.20 -0.08 0.00 -1.01 0.00 0.00 57.07 56.17 2jna s TYR 71 Cb 0.00 -2.63 -0.00 0.00 -0.11 0.00 0.00 41.96 39.21 2jna s TYR 71 CO 0.00 -0.73 0.17 1.52 -1.11 0.00 0.00 175.55 175.40 2jna s TYR 72 N -2.76 0.14 -0.29 2.71 -0.85 -1.26 -0.41 117.35 114.62 2jna s TYR 72 Ca 0.54 -0.48 0.01 0.00 -0.52 0.00 0.00 57.07 56.61 2jna s TYR 72 Cb -0.10 -0.07 0.09 0.00 0.38 0.00 0.00 41.96 42.26 2jna s TYR 72 CO 0.40 -0.48 0.05 -1.58 -1.52 0.00 0.00 175.55 172.41 2jna s HIS 73 N -3.28 2.38 0.12 -3.49 2.46 0.12 -4.03 115.29 109.56 2jna s HIS 73 Ca 0.01 -2.03 -0.31 0.00 0.47 0.00 0.00 55.06 53.19 2jna s HIS 73 Cb 0.02 -1.97 -0.09 0.00 -0.13 0.00 0.00 32.58 30.41 2jna s HIS 73 CO -0.08 -0.86 1.65 0.42 -2.47 0.00 0.00 174.74 173.40 2jna s ILE 74 N 1.39 2.76 -0.18 0.89 1.01 -1.26 -1.22 121.20 124.58 2jna s ILE 74 Ca 0.06 0.39 0.07 0.00 0.00 0.00 0.00 60.65 61.17 2jna s ILE 74 Cb -0.18 -3.25 -0.09 0.00 0.01 0.00 0.00 42.46 38.95 2jna s ILE 74 CO -0.15 0.01 0.23 2.30 0.00 0.00 0.00 174.94 177.33 2jna n ILE 75 N 4.40 0.00 -3.68 2.92 -5.35 0.23 -4.95 119.36 112.93 2jna n ILE 75 Ca 0.15 -0.26 -0.11 0.00 -0.27 0.00 0.00 62.75 62.27 2jna n ILE 75 Cb 0.39 0.69 -0.11 0.00 -1.74 0.00 0.00 39.64 38.88 2jna n ILE 75 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jna s ALA 76 N -2.04 -0.93 -0.21 -1.28 0.00 -1.04 -5.00 121.76 111.26 2jna s ALA 76 Ca 0.00 1.33 -0.03 0.00 0.00 0.00 0.00 51.96 53.26 2jna s ALA 76 Cb 0.05 -1.07 0.07 0.00 0.00 0.00 0.00 23.12 22.16 2jna s ALA 76 CO 0.29 -0.54 0.05 0.00 0.00 0.00 0.00 175.76 175.57 2jna s ALA 77 N 2.09 0.96 0.26 0.00 0.00 -1.26 0.16 121.76 123.98 2jna s ALA 77 Ca -0.04 -0.77 -0.09 0.00 0.00 0.00 0.00 51.96 51.06 2jna s ALA 77 Cb -0.11 -1.22 -0.01 0.00 0.00 0.00 0.00 23.12 21.78 2jna s ALA 77 CO -0.11 -1.26 0.44 -0.98 0.00 0.00 0.00 175.76 173.85 2jna s ARG 78 N 1.88 1.59 -0.02 0.00 1.70 0.17 -5.03 118.95 119.24 2jna s ARG 78 Ca 0.01 -1.41 0.08 0.00 -0.47 0.00 0.00 55.73 53.93 2jna s ARG 78 Cb -0.17 0.44 -0.02 0.00 -0.57 0.00 0.00 34.95 34.63 2jna s ARG 78 CO -0.12 -0.65 -0.25 -2.00 -1.08 0.00 0.00 175.30 171.20 2jna s GLU 79 N -3.79 2.14 -0.35 3.89 2.12 -1.26 -0.60 118.70 120.84 2jna s GLU 79 Ca 0.26 -0.91 0.01 0.00 0.36 0.00 0.00 54.97 54.68 2jna s GLU 79 Cb 0.00 -2.07 0.11 0.00 0.26 0.00 0.00 34.13 32.44 2jna s GLU 79 CO 0.12 0.56 0.14 -1.58 -0.54 0.00 0.00 175.26 173.96 2jna s HIS 80 N -0.62 1.95 0.00 5.30 5.65 0.74 -4.89 115.29 123.42 2jna s HIS 80 Ca 0.10 -2.06 0.00 0.00 0.25 0.00 0.00 55.06 53.35 2jna s HIS 80 Cb -0.10 -1.86 0.00 0.00 -1.18 0.00 0.00 32.58 29.44 2jna s HIS 80 CO -0.01 -0.85 0.00 0.41 -0.65 0.00 0.00 174.74 173.64 2jna n GLY 81 N 4.38 3.88 1.27 1.59 0.00 -1.26 -1.03 105.19 114.02 2jna n GLY 81 Ca 0.02 -0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.07 2jna n GLY 81 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jna n PRO 82 N 13.92 3.02 -4.33 1.61 -0.04 -1.26 -4.89 135.00 143.03 2jna n PRO 82 Ca 0.00 -1.68 -0.24 0.00 -0.04 0.00 0.00 63.50 61.54 2jna n PRO 82 Cb 0.00 -1.90 -0.12 0.00 -0.04 0.00 0.00 33.50 31.44 2jna n PRO 82 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2jna s ASN 83 N -0.40 2.78 -0.22 3.54 0.01 -0.20 -1.56 114.94 118.89 2jna s ASN 83 Ca 0.29 -0.76 -0.04 0.00 -0.71 0.00 0.00 52.86 51.64 2jna s ASN 83 Cb 0.22 -0.17 -0.01 0.00 0.41 0.00 0.00 41.25 41.71 2jna s ASN 83 CO 0.08 0.06 -0.03 0.12 -1.51 0.00 0.00 177.10 175.82 2jna s PHE 84 N -1.45 2.97 -0.39 2.20 5.36 0.74 -0.18 117.98 127.23 2jna s PHE 84 Ca 0.11 -0.85 -0.13 0.00 -0.96 0.00 0.00 56.93 55.10 2jna s PHE 84 Cb -0.09 -2.11 0.02 0.00 -0.34 0.00 0.00 43.02 40.50 2jna s PHE 84 CO 0.06 -0.51 0.25 -1.21 -1.46 0.00 0.00 175.22 172.35 2jna s GLU 85 N 1.44 2.96 -0.17 10.12 0.41 0.23 -3.48 118.70 130.20 2jna s GLU 85 Ca 0.05 -1.01 -0.00 0.00 -0.41 0.00 0.00 54.97 53.60 2jna s GLU 85 Cb -0.14 -3.85 0.04 0.00 -1.78 0.00 0.00 34.13 28.40 2jna s GLU 85 CO -0.02 -0.70 -0.06 0.00 -0.49 0.00 0.00 175.26 173.99 2jna s ALA 86 N 1.63 1.56 -0.28 5.21 0.00 -0.34 -0.66 121.76 128.88 2jna s ALA 86 Ca 0.04 -0.89 -0.08 0.00 0.00 0.00 0.00 51.96 51.02 2jna s ALA 86 Cb -0.19 -1.15 -0.01 0.00 0.00 0.00 0.00 23.12 21.77 2jna s ALA 86 CO 0.08 -0.80 0.11 0.08 0.00 0.00 0.00 175.76 175.23 2jna s VAL 87 N 1.60 4.39 -0.04 0.00 1.01 0.12 0.93 120.40 128.40 2jna s VAL 87 Ca 0.00 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.65 2jna s VAL 87 Cb -0.15 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.07 2jna s VAL 87 CO -0.08 0.18 -0.09 0.00 0.00 0.00 0.00 175.10 175.12 2jna s ALA 88 N 1.60 0.92 -0.04 5.51 0.00 -0.14 -0.60 121.76 129.00 2jna s ALA 88 Ca 0.05 -0.29 -0.17 0.00 0.00 0.00 0.00 51.96 51.55 2jna s ALA 88 Cb -0.16 -0.40 -0.05 0.00 0.00 0.00 0.00 23.12 22.51 2jna s ALA 88 CO 0.05 0.10 0.46 -1.21 0.00 0.00 0.00 175.76 175.16 2jna s GLU 89 N 0.46 4.16 -0.15 0.00 2.02 -0.36 -0.82 118.70 124.02 2jna s GLU 89 Ca -0.08 0.48 -0.19 0.00 0.02 0.00 0.00 54.97 55.21 2jna s GLU 89 Cb -0.12 -3.33 -0.04 0.00 0.10 0.00 0.00 34.13 30.75 2jna s GLU 89 CO 0.01 0.43 0.51 0.08 0.02 0.00 0.00 175.26 176.31 2jna s VAL 90 N -0.28 5.15 -0.03 2.63 1.01 0.34 0.14 120.40 129.36 2jna s VAL 90 Ca 0.25 0.99 0.04 0.00 0.00 0.00 0.00 61.98 63.26 2jna s VAL 90 Cb -0.16 -3.84 -0.00 0.00 0.00 0.00 0.00 36.38 32.37 2jna s VAL 90 CO 0.13 0.26 -0.15 -0.31 0.00 0.00 0.00 175.10 175.03 2jna s TYR 91 N 1.04 1.43 0.48 5.22 2.02 0.46 -2.73 117.35 125.25 2jna s TYR 91 Ca 0.26 -0.35 0.02 0.00 -0.37 0.00 0.00 57.07 56.63 2jna s TYR 91 Cb -0.15 -0.96 0.09 0.00 -0.40 0.00 0.00 41.96 40.54 2jna s TYR 91 CO 0.10 -0.10 0.66 -1.71 -1.57 0.00 0.00 175.55 172.93 2jna n ASN 92 N 3.03 1.15 -2.71 2.29 2.85 0.36 -2.16 115.26 120.08 2jna n ASN 92 Ca -0.17 -1.91 0.00 0.00 -0.11 0.00 0.00 54.58 52.39 2jna n ASN 92 Cb 0.54 -0.40 0.00 0.00 1.24 0.00 0.00 39.78 41.16 2jna n ASN 92 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 2jna n ASP 93 N -2.79 -0.57 -1.15 1.20 2.03 -1.26 -3.31 116.55 110.70 2jna n ASP 93 Ca 0.12 -0.41 0.11 0.00 0.52 0.00 0.00 54.79 55.13 2jna n ASP 93 Cb 0.42 0.00 0.26 0.00 -0.72 0.00 0.00 41.12 41.08 2jna n ASP 93 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jna n ALA 94 N -3.00 2.42 -2.66 -1.67 0.00 -1.26 -1.62 120.51 112.72 2jna n ALA 94 Ca 0.00 -1.04 -0.23 0.00 0.00 0.00 0.00 53.44 52.17 2jna n ALA 94 Cb 0.00 -0.92 -0.07 0.00 0.00 0.00 0.00 19.45 18.46 2jna n ALA 94 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2jna s THR 95 N -1.36 3.52 0.00 0.00 -1.32 -1.26 -4.93 115.64 110.30 2jna s THR 95 Ca 0.41 -1.87 0.00 0.00 -1.21 0.00 0.00 61.69 59.02 2jna s THR 95 Cb 0.23 -2.88 0.00 0.00 -1.51 0.00 0.00 72.50 68.33 2jna s THR 95 CO 0.31 -0.37 0.66 0.29 -2.21 0.00 0.00 174.62 173.30 2jna n LYS 96 N -0.91 1.09 -3.41 7.08 5.02 -1.26 -4.97 118.16 120.81 2jna n LYS 96 Ca -0.07 -0.85 -0.44 0.00 -2.02 0.00 0.00 58.31 54.93 2jna n LYS 96 Cb 0.59 -0.71 -0.07 0.00 -0.02 0.00 0.00 35.03 34.82 2jna n LYS 96 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2jna s LEU 97 N -0.38 5.83 0.00 -0.35 1.43 -1.26 -4.91 118.68 119.05 2jna s LEU 97 Ca 0.00 -1.65 0.00 0.00 -1.03 0.00 0.00 54.13 51.45 2jna s LEU 97 Cb 0.00 -2.14 0.00 0.00 0.03 0.00 0.00 46.19 44.08 2jna s LEU 97 CO 0.00 -0.74 0.00 1.21 0.23 0.00 0.00 176.35 177.05 2jna n GLU 98 N 5.14 0.00 0.00 1.70 0.00 -1.26 -5.10 120.64 121.12 2jna n GLU 98 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.04 2jna n GLU 98 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.85 2jna n GLU 98 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2jna n HIS 99 N 0.00 -1.44 -3.76 4.31 8.25 -1.26 -5.04 115.22 116.28 2jna n HIS 99 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 2jna n HIS 99 Cb 0.00 0.37 -0.14 0.00 1.12 0.00 0.00 29.99 31.34 2jna n HIS 99 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2jna s HIS 100 N -1.75 2.10 -0.27 4.41 5.65 -1.26 -4.98 115.29 119.20 2jna s HIS 100 Ca 0.00 -2.23 0.11 0.00 0.25 0.00 0.00 55.06 53.20 2jna s HIS 100 Cb 0.00 -1.96 0.47 0.00 -1.18 0.00 0.00 32.58 29.91 2jna s HIS 100 CO 0.00 -0.84 1.18 -2.39 -0.65 0.00 0.00 174.74 172.04 2jna n HIS 101 N 4.15 2.07 -4.13 3.88 1.44 -1.26 -5.10 115.22 116.28 2jna n HIS 101 Ca 0.04 -2.07 0.01 0.00 -2.01 0.00 0.00 57.72 53.68 2jna n HIS 101 Cb 0.38 -0.30 -0.00 0.00 0.12 0.00 0.00 29.99 30.19 2jna n HIS 101 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2jna n HIS 102 N -0.69 -1.61 -4.39 -1.40 8.25 -1.26 -4.94 115.22 109.18 2jna n HIS 102 Ca 0.33 0.08 -0.24 0.00 -0.26 0.00 0.00 57.72 57.63 2jna n HIS 102 Cb 0.91 -0.02 -0.09 0.00 1.12 0.00 0.00 29.99 31.91 2jna n HIS 102 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2jna s HIS 103 N -0.15 2.48 0.00 4.41 -3.43 -1.26 -5.17 115.29 112.17 2jna s HIS 103 Ca 0.00 -0.28 0.00 0.00 -0.80 0.00 0.00 55.06 53.98 2jna s HIS 103 Cb 0.00 -1.09 0.00 0.00 -1.43 0.00 0.00 32.58 30.06 2jna s HIS 103 CO 0.00 0.67 0.00 1.58 -2.00 0.00 0.00 174.74 174.99