#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmj s GLU 25 N 0.00 3.16 -0.08 3.69 2.02 -1.26 -5.06 118.70 121.16 2jmj s GLU 25 Ca 0.00 -0.79 0.02 0.00 0.02 0.00 0.00 54.97 54.23 2jmj s GLU 25 Cb 0.00 -2.55 0.01 0.00 0.10 0.00 0.00 34.13 31.69 2jmj s GLU 25 CO 0.00 0.03 -0.15 -1.21 0.02 0.00 0.00 175.26 173.95 2jmj s GLU 26 N 0.76 2.04 0.27 1.61 0.41 -1.26 -5.03 118.70 117.50 2jmj s GLU 26 Ca -0.07 -0.52 -0.29 0.00 -0.41 0.00 0.00 54.97 53.68 2jmj s GLU 26 Cb -0.16 -1.66 -0.09 0.00 -1.78 0.00 0.00 34.13 30.44 2jmj s GLU 26 CO 0.00 0.04 0.96 0.08 -0.49 0.00 0.00 175.26 175.85 2jmj s VAL 27 N 0.68 4.02 0.00 2.63 1.01 -1.26 -2.83 120.40 124.65 2jmj s VAL 27 Ca -0.14 1.94 0.00 0.00 0.00 0.00 0.00 61.98 63.78 2jmj s VAL 27 Cb -0.16 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.02 2jmj s VAL 27 CO 0.04 0.39 0.00 -1.22 0.00 0.00 0.00 175.10 174.31 2jmj n TYR 28 N 1.22 0.00 -1.53 5.22 4.01 -0.97 -4.95 117.16 120.15 2jmj n TYR 28 Ca -0.01 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.36 2jmj n TYR 28 Cb 0.47 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.56 2jmj n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2jmj h PHE 30 N 0.24 0.00 0.00 0.00 3.57 -1.95 0.11 116.94 118.91 2jmj h PHE 30 Ca -0.48 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.02 2jmj h PHE 30 Cb 1.37 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.11 2jmj h PHE 30 CO 0.36 0.00 0.17 0.00 -2.23 0.00 0.00 178.31 176.61 2jmj n ARG 32 N -1.70 -1.01 -4.49 0.00 5.12 0.39 -5.02 116.66 109.94 2jmj n ARG 32 Ca -0.00 0.74 -0.24 0.00 -1.93 0.00 0.00 57.85 56.42 2jmj n ARG 32 Cb 0.18 -4.92 -0.11 0.00 -1.16 0.00 0.00 32.46 26.45 2jmj n ARG 32 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2jmj s ASN 33 N -2.54 3.11 0.74 0.55 6.03 -1.26 -4.94 114.94 116.63 2jmj s ASN 33 Ca 0.00 -1.26 -0.11 0.00 -1.03 0.00 0.00 52.86 50.46 2jmj s ASN 33 Cb 0.00 -0.24 0.03 0.00 -3.03 0.00 0.00 41.25 38.02 2jmj s ASN 33 CO 0.00 -0.38 1.09 -0.69 -2.03 0.00 0.00 177.10 175.09 2jmj s VAL 34 N -2.92 3.42 -0.81 3.54 1.01 -1.26 -2.30 120.40 121.09 2jmj s VAL 34 Ca 0.32 0.46 -0.25 0.00 0.00 0.00 0.00 61.98 62.52 2jmj s VAL 34 Cb 0.05 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 2jmj s VAL 34 CO 0.15 -0.60 1.90 -0.55 0.00 0.00 0.00 175.10 176.00 2jmj s SER 35 N -4.11 5.22 0.15 3.32 0.15 -1.13 -4.83 113.70 112.47 2jmj s SER 35 Ca 0.59 -0.38 -0.17 0.00 0.70 0.00 0.00 55.95 56.69 2jmj s SER 35 Cb -0.13 -2.55 0.06 0.00 -1.71 0.00 0.00 66.02 61.69 2jmj s SER 35 CO 0.53 -2.60 1.73 1.88 1.20 0.00 0.00 173.24 175.98 2jmj h TYR 36 N 12.38 0.10 0.00 3.44 0.05 -1.94 -3.47 116.97 127.53 2jmj h TYR 36 Ca -0.01 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2jmj h TYR 36 Cb 1.05 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.80 2jmj h TYR 36 CO 1.17 0.02 0.00 0.41 -1.05 0.00 0.00 178.16 178.70 2jmj n GLY 37 N -1.23 -2.11 3.58 3.88 0.00 -1.26 -5.10 105.19 102.95 2jmj n GLY 37 Ca 0.01 0.68 -0.41 0.00 0.00 0.00 0.00 46.02 46.30 2jmj n GLY 37 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jmj s PRO 38 N -0.96 3.01 0.26 1.61 0.04 -1.26 -4.96 135.00 132.74 2jmj s PRO 38 Ca 0.00 1.23 0.01 0.00 0.04 0.00 0.00 61.00 62.29 2jmj s PRO 38 Cb 0.00 -4.30 -0.05 0.00 0.04 0.00 0.00 34.50 30.19 2jmj s PRO 38 CO 0.00 -2.25 0.09 -1.64 0.04 0.00 0.00 177.00 173.24 2jmj s MET 39 N 6.33 1.42 -0.08 4.56 -1.94 -1.26 0.82 119.30 129.15 2jmj s MET 39 Ca 0.79 -1.77 -0.31 0.00 -1.71 0.00 0.00 55.69 52.70 2jmj s MET 39 Cb -0.20 -0.30 0.08 0.00 2.01 0.00 0.00 34.83 36.42 2jmj s MET 39 CO 0.29 -0.28 0.74 0.54 -0.01 0.00 0.00 175.02 176.30 2jmj s VAL 40 N -3.72 0.00 -0.09 -6.03 0.11 0.67 -4.90 120.40 106.44 2jmj s VAL 40 Ca 0.37 0.00 -0.09 0.00 -2.93 0.00 0.00 61.98 59.33 2jmj s VAL 40 Cb 0.08 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.88 2jmj s VAL 40 CO 0.14 0.00 0.21 0.00 -3.33 0.00 0.00 175.10 172.12 2jmj s ALA 41 N -1.12 3.82 -0.51 1.54 0.00 -1.26 0.14 121.76 124.38 2jmj s ALA 41 Ca -0.09 -0.53 -0.27 0.00 0.00 0.00 0.00 51.96 51.07 2jmj s ALA 41 Cb -0.00 -2.09 -0.09 0.00 0.00 0.00 0.00 23.12 20.94 2jmj s ALA 41 CO 0.08 0.56 2.42 0.00 0.00 0.00 0.00 175.76 178.83 2jmj n ASP 43 N 14.75 5.47 -4.02 0.00 2.03 -1.25 -4.78 116.55 128.75 2jmj n ASP 43 Ca 0.39 -2.51 -0.20 0.00 0.52 0.00 0.00 54.79 52.99 2jmj n ASP 43 Cb 0.47 -1.19 -0.15 0.00 -0.72 0.00 0.00 41.12 39.53 2jmj n ASP 43 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2jmj s ASN 44 N 1.77 1.23 0.30 1.67 3.84 -1.26 -4.99 114.94 117.50 2jmj s ASN 44 Ca 0.19 -0.19 0.06 0.00 0.21 0.00 0.00 52.86 53.13 2jmj s ASN 44 Cb 0.10 -0.24 0.79 0.00 -0.55 0.00 0.00 41.25 41.35 2jmj s ASN 44 CO -0.01 0.10 1.70 -0.65 -2.79 0.00 0.00 177.10 175.45 2jmj h PRO 45 N 6.15 0.43 0.00 0.43 0.11 -1.91 -3.32 132.00 133.90 2jmj h PRO 45 Ca -0.32 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.76 2jmj h PRO 45 Cb 1.17 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2jmj h PRO 45 CO 0.49 0.29 0.00 0.00 -0.21 0.00 0.00 178.00 178.57 2jmj n ALA 46 N -2.44 0.00 -2.88 -0.75 0.00 -1.26 -4.97 120.51 108.21 2jmj n ALA 46 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2jmj n ALA 46 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.14 2jmj n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jmj h PRO 48 N 3.45 0.00 0.00 0.00 0.11 -1.93 -3.41 132.00 130.22 2jmj h PRO 48 Ca 0.00 0.00 -0.40 0.00 0.11 0.00 0.00 66.00 65.71 2jmj h PRO 48 Cb 0.80 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.82 2jmj h PRO 48 CO 0.00 0.00 -0.34 1.19 -0.21 0.00 0.00 178.00 178.64 2jmj n PHE 49 N -3.31 0.07 -2.68 0.65 3.72 -1.26 -5.08 117.46 109.56 2jmj n PHE 49 Ca 0.21 -1.90 0.01 0.00 -0.05 0.00 0.00 57.45 55.72 2jmj n PHE 49 Cb 1.39 0.01 0.04 0.00 -0.94 0.00 0.00 39.48 39.98 2jmj n PHE 49 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2jmj n GLU 50 N -0.65 1.08 -3.53 -1.08 1.02 -1.26 -4.28 120.64 111.93 2jmj n GLU 50 Ca -0.04 -2.72 0.00 0.00 -0.02 0.00 0.00 57.16 54.38 2jmj n GLU 50 Cb 0.44 -0.83 -0.04 0.00 -0.02 0.00 0.00 31.44 30.99 2jmj n GLU 50 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2jmj s TRP 51 N -2.10 -1.07 -0.08 -0.32 0.23 -1.24 -3.85 118.94 110.51 2jmj s TRP 51 Ca 0.26 1.84 -0.05 0.00 -2.03 0.00 0.00 56.10 56.13 2jmj s TRP 51 Cb 0.34 0.64 0.03 0.00 0.03 0.00 0.00 33.47 34.51 2jmj s TRP 51 CO -0.09 -0.54 0.19 -0.06 0.96 0.00 0.00 176.95 177.42 2jmj s PHE 52 N 2.72 -0.23 0.75 -1.98 0.40 0.37 -2.05 117.98 117.95 2jmj s PHE 52 Ca -0.04 0.58 -0.11 0.00 -0.60 0.00 0.00 56.93 56.76 2jmj s PHE 52 Cb -0.10 0.01 0.04 0.00 0.51 0.00 0.00 43.02 43.48 2jmj s PHE 52 CO -0.18 -0.17 1.08 -1.01 0.70 0.00 0.00 175.22 175.64 2jmj s HIS 53 N 0.86 2.92 -0.08 0.36 3.76 -1.26 -0.24 115.29 121.61 2jmj s HIS 53 Ca -0.06 1.35 0.13 0.00 -0.15 0.00 0.00 55.06 56.33 2jmj s HIS 53 Cb -0.08 -2.99 -0.03 0.00 1.11 0.00 0.00 32.58 30.60 2jmj s HIS 53 CO -0.05 -1.52 1.35 1.88 -0.85 0.00 0.00 174.74 175.55 2jmj h TYR 54 N -0.92 0.00 0.00 1.40 -1.99 0.08 -1.17 116.97 114.37 2jmj h TYR 54 Ca -0.45 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.22 2jmj h TYR 54 Cb 1.23 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.95 2jmj h TYR 54 CO 0.56 0.65 -0.30 0.78 -0.00 0.00 0.00 178.16 179.85 2jmj h GLY 55 N 3.38 0.00 0.31 3.88 0.00 -1.93 -3.04 103.07 105.66 2jmj h GLY 55 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.31 2jmj h GLY 55 CO 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 176.54 176.59 2jmj n VAL 57 N -4.82 0.00 -3.38 0.00 0.24 -0.47 -4.91 118.33 105.00 2jmj n VAL 57 Ca -0.08 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.07 2jmj n VAL 57 Cb 0.31 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.59 2jmj n VAL 57 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2jmj s GLY 58 N 0.00 -0.27 0.01 7.63 0.00 -1.25 -4.87 107.32 108.58 2jmj s GLY 58 Ca 0.00 -0.05 -0.20 0.00 0.00 0.00 0.00 44.72 44.47 2jmj s GLY 58 CO 0.00 2.73 0.90 1.47 0.00 0.00 0.00 173.10 178.20 2jmj n LEU 59 N 5.33 0.00 -3.52 0.66 -0.00 -1.26 -5.09 117.00 113.12 2jmj n LEU 59 Ca -0.02 -0.46 -0.15 0.00 -0.00 0.00 0.00 56.01 55.39 2jmj n LEU 59 Cb 0.48 1.50 -0.12 0.00 -0.00 0.00 0.00 43.42 45.28 2jmj n LEU 59 CO 0.01 -0.15 -0.15 -0.54 -0.00 0.00 0.00 177.39 176.55 2jmj s LYS 60 N -2.02 0.21 0.00 1.47 1.02 -1.26 -4.87 119.74 114.29 2jmj s LYS 60 Ca 0.21 0.43 0.00 0.00 0.02 0.00 0.00 55.97 56.63 2jmj s LYS 60 Cb -0.01 -0.72 0.00 0.00 -0.52 0.00 0.00 37.83 36.59 2jmj s LYS 60 CO 0.00 -0.54 0.00 1.04 -0.92 0.00 0.00 175.35 174.93 2jmj n GLN 61 N 5.34 0.00 -2.47 1.68 1.13 -1.26 -4.20 117.38 117.60 2jmj n GLN 61 Ca -0.05 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 54.98 2jmj n GLN 61 Cb 0.50 -3.91 -0.02 0.00 0.11 0.00 0.00 30.24 26.91 2jmj n GLN 61 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jmj n ALA 62 N 0.96 -2.47 -0.92 -1.58 0.00 -1.26 -4.90 120.51 110.34 2jmj n ALA 62 Ca 0.00 1.16 -0.35 0.00 0.00 0.00 0.00 53.44 54.25 2jmj n ALA 62 Cb 0.00 -2.59 0.07 0.00 0.00 0.00 0.00 19.45 16.93 2jmj n ALA 62 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2jmj n PRO 63 N 1.88 -0.16 -0.20 0.00 -0.02 -1.26 -4.75 135.00 130.49 2jmj n PRO 63 Ca -0.16 -0.03 0.30 0.00 -2.02 0.00 0.00 63.50 61.59 2jmj n PRO 63 Cb 0.25 -1.33 0.69 0.00 -0.02 0.00 0.00 33.50 33.09 2jmj n PRO 63 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2jmj h LYS 64 N -1.24 0.00 0.00 -0.52 1.57 -1.98 -3.37 116.57 111.03 2jmj h LYS 64 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2jmj h LYS 64 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 2jmj h LYS 64 CO 0.27 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.56 2jmj n GLY 65 N -1.68 -1.66 2.82 3.86 0.00 -1.26 -5.04 105.19 102.23 2jmj n GLY 65 Ca 0.21 -0.36 -0.16 0.00 0.00 0.00 0.00 46.02 45.71 2jmj n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jmj s LYS 66 N 0.00 0.17 0.26 1.61 1.02 -1.26 -5.15 119.74 116.39 2jmj s LYS 66 Ca 0.00 0.07 0.02 0.00 0.02 0.00 0.00 55.97 56.08 2jmj s LYS 66 Cb 0.00 -0.34 -0.03 0.00 -0.52 0.00 0.00 37.83 36.94 2jmj s LYS 66 CO 0.00 -0.10 0.42 -0.46 -0.92 0.00 0.00 175.35 174.29 2jmj s TRP 67 N 0.79 3.48 -0.21 3.18 -0.11 -1.26 -5.01 118.94 119.80 2jmj s TRP 67 Ca -0.07 0.20 -0.03 0.00 1.22 0.00 0.00 56.10 57.42 2jmj s TRP 67 Cb -0.11 -1.75 -0.00 0.00 -1.50 0.00 0.00 33.47 30.11 2jmj s TRP 67 CO -0.02 0.33 -0.07 0.71 -4.62 0.00 0.00 176.95 173.28 2jmj s TYR 68 N -2.04 2.92 0.09 5.86 2.02 -1.26 -3.74 117.35 121.20 2jmj s TYR 68 Ca 0.37 -1.01 0.06 0.00 -0.37 0.00 0.00 57.07 56.13 2jmj s TYR 68 Cb -0.10 -2.05 0.32 0.00 -0.40 0.00 0.00 41.96 39.73 2jmj s TYR 68 CO 0.31 -0.55 0.34 0.00 -1.57 0.00 0.00 175.55 174.08 2jmj s SER 70 N -4.62 -0.47 0.56 0.00 0.01 -1.26 -4.79 113.70 103.12 2jmj s SER 70 Ca -0.02 -0.12 0.33 0.00 1.31 0.00 0.00 55.95 57.45 2jmj s SER 70 Cb 0.07 0.59 1.47 0.00 0.21 0.00 0.00 66.02 68.36 2jmj s SER 70 CO 0.18 -0.98 1.80 0.50 0.41 0.00 0.00 173.24 175.15 2jmj h LYS 71 N 2.07 0.00 0.04 12.44 3.64 -1.99 0.32 116.57 133.09 2jmj h LYS 71 Ca -0.33 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 58.92 2jmj h LYS 71 Cb 1.29 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.11 2jmj h LYS 71 CO 0.38 0.00 -0.71 -0.44 -2.27 0.00 0.00 179.45 176.41 2jmj h ASP 72 N 0.00 0.13 -0.31 4.20 3.32 -1.94 -3.17 116.42 118.65 2jmj h ASP 72 Ca 0.45 -0.84 0.09 0.00 0.02 0.00 0.00 57.03 56.75 2jmj h ASP 72 Cb 1.96 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 41.45 2jmj h ASP 72 CO -0.00 1.30 0.97 0.00 -1.72 0.00 0.00 179.24 179.78 2jmj h LYS 74 N 0.00 0.00 -0.30 0.00 3.64 -1.45 -3.32 116.57 115.14 2jmj h LYS 74 Ca 0.15 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 2jmj h LYS 74 Cb 2.08 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.88 2jmj h LYS 74 CO -0.00 0.73 -0.03 0.93 -2.27 0.00 0.00 179.45 178.81 2jmj h GLU 75 N -1.00 0.47 -0.35 1.90 4.39 0.52 -2.02 114.58 118.49 2jmj h GLU 75 Ca -0.23 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.36 2jmj h GLU 75 Cb 1.06 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.62 2jmj h GLU 75 CO -0.14 0.53 0.21 0.82 -1.16 0.00 0.00 179.01 179.27 2jmj h ILE 76 N 0.45 1.10 -0.08 3.13 2.04 0.16 1.00 117.51 125.31 2jmj h ILE 76 Ca 0.10 -0.21 -0.04 0.00 1.00 0.00 0.00 64.86 65.71 2jmj h ILE 76 Cb 0.35 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 37.03 2jmj h ILE 76 CO 0.01 0.10 -0.10 0.00 0.00 0.00 0.00 178.15 178.16 2jmj h ALA 77 N 1.76 0.12 0.00 1.87 0.00 -1.47 -2.96 119.26 118.58 2jmj h ALA 77 Ca 0.13 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2jmj h ALA 77 Cb -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2jmj h ALA 77 CO -0.03 -0.03 0.00 -0.91 0.00 0.00 0.00 179.25 178.29 2jmj h ASN 78 N -0.23 0.00 -6.35 0.00 2.35 -1.12 -3.47 115.58 106.77 2jmj h ASN 78 Ca 0.01 0.00 -0.48 0.00 -0.55 0.00 0.00 56.30 55.28 2jmj h ASN 78 Cb 0.64 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.96 2jmj h ASN 78 CO 0.02 0.00 -0.79 1.67 -1.65 0.00 0.00 177.43 176.69 2jmj n GLN 79 N -2.83 -4.98 -2.75 0.81 7.27 0.34 -4.89 117.38 110.35 2jmj n GLN 79 Ca 0.02 0.56 -0.43 0.00 0.07 0.00 0.00 57.00 57.22 2jmj n GLN 79 Cb 0.34 -5.33 -0.03 0.00 2.41 0.00 0.00 30.24 27.63 2jmj n GLN 79 CO 0.00 0.00 0.00 0.50 0.07 0.00 0.00 177.06 177.63 2jmj s ARG 80 N -6.57 3.67 -0.38 3.69 3.52 -1.18 -4.82 118.95 116.89 2jmj s ARG 80 Ca 0.54 0.40 0.05 0.00 -0.13 0.00 0.00 55.73 56.59 2jmj s ARG 80 Cb -0.28 -3.89 0.28 0.00 -1.56 0.00 0.00 34.95 29.51 2jmj s ARG 80 CO 0.85 -1.19 1.24 0.43 -0.81 0.00 0.00 175.30 175.81 2jmj n SER 81 N 7.25 -1.68 -0.32 -2.12 7.64 -1.26 -5.00 113.62 118.14 2jmj n SER 81 Ca 0.08 -2.45 0.06 0.00 1.01 0.00 0.00 58.87 57.57 2jmj n SER 81 Cb 0.48 1.28 0.26 0.00 -1.01 0.00 0.00 64.21 65.23 2jmj n SER 81 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2jmj h LYS 82 N 2.10 0.94 -0.00 1.43 1.63 -2.02 -3.57 116.57 117.07 2jmj h LYS 82 Ca -0.31 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.43 2jmj h LYS 82 Cb 1.21 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 32.63 2jmj h LYS 82 CO -0.04 0.62 0.00 0.43 -3.45 0.00 0.00 179.45 177.01