#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 3.04 -0.18 -1.09 2.12 -1.26 -4.75 118.70 116.58 2jmj s GLU 25 Ca 0.00 -1.09 -0.09 0.00 0.36 0.00 0.00 54.97 54.15 2jmj s GLU 25 Cb 0.00 -4.09 0.07 0.00 0.26 0.00 0.00 34.13 30.37 2jmj s GLU 25 CO 0.00 -1.06 0.42 -2.00 -0.54 0.00 0.00 175.26 172.08 2jmj s GLU 26 N 2.06 0.38 0.92 4.30 2.12 -1.26 -5.04 118.70 122.17 2jmj s GLU 26 Ca 0.09 0.88 -0.11 0.00 0.36 0.00 0.00 54.97 56.19 2jmj s GLU 26 Cb -0.21 0.09 0.14 0.00 0.26 0.00 0.00 34.13 34.41 2jmj s GLU 26 CO 0.10 -0.19 1.10 0.08 -0.54 0.00 0.00 175.26 175.81 2jmj s VAL 27 N 1.80 2.52 0.04 3.70 1.01 -1.26 -2.30 120.40 125.92 2jmj s VAL 27 Ca -0.07 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.08 2jmj s VAL 27 Cb -0.09 -2.44 0.00 0.00 0.00 0.00 0.00 36.38 33.84 2jmj s VAL 27 CO -0.13 -0.22 0.00 -1.22 0.00 0.00 0.00 175.10 173.53 2jmj n TYR 28 N -4.08 -1.93 0.28 5.22 4.01 -1.19 -4.84 117.16 114.64 2jmj n TYR 28 Ca 0.08 0.13 0.00 0.00 -0.16 0.00 0.00 57.90 57.95 2jmj n TYR 28 Cb 0.54 0.75 0.00 0.00 -0.31 0.00 0.00 39.34 40.32 2jmj n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2jmj n PHE 30 N 0.04 0.00 0.48 0.00 7.35 -1.26 -4.69 117.46 119.39 2jmj n PHE 30 Ca 0.00 0.00 0.04 0.00 -0.76 0.00 0.00 57.45 56.73 2jmj n PHE 30 Cb 0.03 -0.90 0.23 0.00 0.35 0.00 0.00 39.48 39.19 2jmj n PHE 30 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2jmj n ARG 32 N -1.03 -1.33 -4.07 0.00 1.74 -1.26 -5.01 116.66 105.70 2jmj n ARG 32 Ca 0.06 0.68 -0.13 0.00 -0.77 0.00 0.00 57.85 57.69 2jmj n ARG 32 Cb 0.03 -4.96 -0.11 0.00 -1.02 0.00 0.00 32.46 26.40 2jmj n ARG 32 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2jmj s ASN 33 N -2.40 0.87 0.79 0.55 6.03 -1.26 -5.01 114.94 114.51 2jmj s ASN 33 Ca 0.02 -0.61 -0.12 0.00 -1.03 0.00 0.00 52.86 51.12 2jmj s ASN 33 Cb -0.01 0.05 0.07 0.00 -3.03 0.00 0.00 41.25 38.33 2jmj s ASN 33 CO 0.02 -0.24 1.10 -0.69 -2.03 0.00 0.00 177.10 175.26 2jmj s VAL 34 N -1.70 3.05 -0.78 3.54 1.01 -1.26 -3.16 120.40 121.10 2jmj s VAL 34 Ca -0.07 0.34 -0.25 0.00 0.00 0.00 0.00 61.98 62.00 2jmj s VAL 34 Cb -0.08 -3.12 -0.08 0.00 0.00 0.00 0.00 36.38 33.10 2jmj s VAL 34 CO -0.00 -0.45 2.16 -0.55 0.00 0.00 0.00 175.10 176.26 2jmj s SER 35 N -3.97 4.61 0.11 3.32 0.15 -0.97 -4.81 113.70 112.15 2jmj s SER 35 Ca 0.61 -0.10 -0.22 0.00 0.70 0.00 0.00 55.95 56.94 2jmj s SER 35 Cb -0.14 -2.55 -0.09 0.00 -1.71 0.00 0.00 66.02 61.54 2jmj s SER 35 CO 0.54 -3.14 1.72 1.88 1.20 0.00 0.00 173.24 175.44 2jmj h TYR 36 N 13.16 -0.07 0.00 3.44 0.05 -1.93 -3.47 116.97 128.15 2jmj h TYR 36 Ca -0.02 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.77 2jmj h TYR 36 Cb 1.05 0.05 0.00 0.00 1.01 0.00 0.00 36.73 38.84 2jmj h TYR 36 CO 1.15 -0.05 0.00 0.41 -1.05 0.00 0.00 178.16 178.62 2jmj n GLY 37 N -1.15 -1.89 3.57 3.88 0.00 -1.26 -5.10 105.19 103.24 2jmj n GLY 37 Ca -0.05 0.68 -0.41 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.37 3.15 0.30 1.61 0.04 -1.26 -4.97 135.00 132.50 2jmj s PRO 38 Ca 0.00 0.64 0.05 0.00 0.04 0.00 0.00 61.00 61.72 2jmj s PRO 38 Cb 0.00 -4.20 -0.03 0.00 0.04 0.00 0.00 34.50 30.31 2jmj s PRO 38 CO 0.00 -2.11 0.22 -1.64 0.04 0.00 0.00 177.00 173.51 2jmj s MET 39 N 5.89 1.63 0.07 4.56 -1.94 -1.26 0.78 119.30 129.03 2jmj s MET 39 Ca 0.60 -1.93 -0.23 0.00 -1.71 0.00 0.00 55.69 52.42 2jmj s MET 39 Cb -0.13 0.19 0.06 0.00 2.01 0.00 0.00 34.83 36.96 2jmj s MET 39 CO 0.25 -0.56 0.55 0.54 -0.01 0.00 0.00 175.02 175.79 2jmj s VAL 40 N -3.60 0.02 -0.15 -6.03 0.11 0.36 -4.87 120.40 106.23 2jmj s VAL 40 Ca 0.38 -0.18 -0.06 0.00 -2.93 0.00 0.00 61.98 59.19 2jmj s VAL 40 Cb 0.04 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.84 2jmj s VAL 40 CO 0.22 -0.10 0.06 0.00 -3.33 0.00 0.00 175.10 171.95 2jmj s ALA 41 N -2.79 3.45 -0.31 1.54 0.00 -1.26 0.17 121.76 122.56 2jmj s ALA 41 Ca -0.03 -0.74 -0.33 0.00 0.00 0.00 0.00 51.96 50.85 2jmj s ALA 41 Cb -0.00 -1.82 -0.10 0.00 0.00 0.00 0.00 23.12 21.20 2jmj s ALA 41 CO -0.04 0.35 2.20 0.00 0.00 0.00 0.00 175.76 178.26 2jmj n ASP 43 N 10.39 6.76 -4.08 0.00 2.03 -1.25 -4.80 116.55 125.60 2jmj n ASP 43 Ca 0.38 -3.29 -0.27 0.00 0.52 0.00 0.00 54.79 52.13 2jmj n ASP 43 Cb 0.29 -1.10 -0.17 0.00 -0.72 0.00 0.00 41.12 39.42 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 -0.19 2.19 0.05 1.67 2.47 -1.26 -4.99 114.94 114.89 2jmj s ASN 44 Ca 0.47 -0.38 0.03 0.00 0.42 0.00 0.00 52.86 53.40 2jmj s ASN 44 Cb 0.35 -1.01 0.14 0.00 -1.45 0.00 0.00 41.25 39.28 2jmj s ASN 44 CO -0.11 0.06 0.93 -0.81 -3.72 0.00 0.00 177.10 173.46 2jmj n PRO 45 N 3.78 0.02 -0.06 0.43 -0.04 -1.26 -2.34 135.00 135.53 2jmj n PRO 45 Ca -0.21 0.38 -0.10 0.00 -0.04 0.00 0.00 63.50 63.53 2jmj n PRO 45 Cb 0.52 -1.73 -0.03 0.00 -0.04 0.00 0.00 33.50 32.22 2jmj n PRO 45 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jmj n ALA 46 N -1.39 1.72 0.00 0.55 0.00 -1.26 -5.04 120.51 115.09 2jmj n ALA 46 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.86 2jmj n ALA 46 Cb 0.17 0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.79 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 0.00 0.00 0.00 0.00 0.13 -1.96 -3.43 132.00 126.74 2jmj h PRO 48 Ca 0.00 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.82 2jmj h PRO 48 Cb 0.00 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.06 2jmj h PRO 48 CO 0.00 0.00 -0.25 1.19 -0.23 0.00 0.00 178.00 178.71 2jmj n PHE 49 N -4.08 0.24 -2.51 1.56 3.01 -1.26 -5.08 117.46 109.33 2jmj n PHE 49 Ca 0.07 -1.36 0.01 0.00 1.01 0.00 0.00 57.45 57.18 2jmj n PHE 49 Cb 0.53 -0.06 0.02 0.00 -0.01 0.00 0.00 39.48 39.97 2jmj n PHE 49 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2jmj n GLU 50 N -0.54 0.48 -3.54 -1.08 1.02 -1.26 -4.20 120.64 111.53 2jmj n GLU 50 Ca -0.06 -2.15 0.00 0.00 -0.02 0.00 0.00 57.16 54.94 2jmj n GLU 50 Cb 0.33 -0.27 -0.04 0.00 -0.02 0.00 0.00 31.44 31.44 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 -0.87 -1.23 -0.03 -0.32 0.23 -1.24 -3.81 118.94 111.67 2jmj s TRP 51 Ca 0.26 2.01 -0.05 0.00 -2.03 0.00 0.00 56.10 56.29 2jmj s TRP 51 Cb 0.32 0.69 0.01 0.00 0.03 0.00 0.00 33.47 34.52 2jmj s TRP 51 CO -0.11 -0.62 0.13 -0.06 0.96 0.00 0.00 176.95 177.24 2jmj s PHE 52 N 2.81 -0.05 0.59 -1.98 0.40 0.45 -0.65 117.98 119.55 2jmj s PHE 52 Ca -0.02 0.11 -0.06 0.00 -0.60 0.00 0.00 56.93 56.36 2jmj s PHE 52 Cb -0.11 -0.00 0.01 0.00 0.51 0.00 0.00 43.02 43.42 2jmj s PHE 52 CO -0.19 -0.17 0.90 -1.01 0.70 0.00 0.00 175.22 175.46 2jmj s HIS 53 N -0.61 3.27 -0.57 0.36 3.76 -1.26 0.14 115.29 120.37 2jmj s HIS 53 Ca -0.07 0.67 0.25 0.00 -0.15 0.00 0.00 55.06 55.76 2jmj s HIS 53 Cb -0.04 -2.73 0.65 0.00 1.11 0.00 0.00 32.58 31.56 2jmj s HIS 53 CO 0.01 -0.82 1.71 1.88 -0.85 0.00 0.00 174.74 176.67 2jmj h TYR 54 N -0.18 0.00 0.03 1.40 -1.99 0.04 0.12 116.97 116.40 2jmj h TYR 54 Ca -0.45 0.00 -0.27 0.00 2.00 0.00 0.00 58.73 60.01 2jmj h TYR 54 Cb 1.25 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.95 2jmj h TYR 54 CO 0.48 0.00 -1.43 0.78 -0.00 0.00 0.00 178.16 177.99 2jmj h GLY 55 N 4.10 0.08 1.04 3.88 0.00 -1.91 -3.28 103.07 106.97 2jmj h GLY 55 Ca 0.00 -0.20 -0.12 0.00 0.00 0.00 0.00 47.33 47.01 2jmj h GLY 55 CO 0.00 0.17 -0.22 0.00 0.00 0.00 0.00 176.54 176.50 2jmj n VAL 57 N -4.21 0.00 -3.41 0.00 0.24 -0.01 -4.95 118.33 105.99 2jmj n VAL 57 Ca -0.02 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.13 2jmj n VAL 57 Cb 0.44 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.71 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 -0.17 0.00 7.63 0.00 -1.25 -4.85 107.32 108.68 2jmj s GLY 58 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.71 2jmj s GLY 58 CO 0.00 2.58 0.00 1.47 0.00 0.00 0.00 173.10 177.15 2jmj n LEU 59 N 5.32 0.00 -3.62 0.66 -0.00 -1.26 -5.09 117.00 113.01 2jmj n LEU 59 Ca -0.03 0.00 -0.23 0.00 -0.00 0.00 0.00 56.01 55.75 2jmj n LEU 59 Cb 0.48 0.00 -0.17 0.00 -0.00 0.00 0.00 43.42 43.73 2jmj n LEU 59 CO 0.03 0.00 -0.31 -0.54 -0.00 0.00 0.00 177.39 176.56 2jmj s LYS 60 N -2.00 0.03 0.00 1.47 1.02 -1.26 -4.82 119.74 114.18 2jmj s LYS 60 Ca 0.00 0.12 0.00 0.00 0.02 0.00 0.00 55.97 56.11 2jmj s LYS 60 Cb 0.00 -1.30 0.00 0.00 -0.52 0.00 0.00 37.83 36.01 2jmj s LYS 60 CO 0.00 -0.55 0.00 0.94 -0.92 0.00 0.00 175.35 174.82 2jmj n GLN 61 N 5.29 0.00 -1.29 1.68 7.27 -1.26 -4.52 117.38 124.55 2jmj n GLN 61 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.01 2jmj n GLN 61 Cb 0.49 -3.78 0.00 0.00 2.41 0.00 0.00 30.24 29.36 2jmj n GLN 61 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2jmj n ALA 62 N 0.91 -2.33 -1.37 1.69 0.00 -1.26 -4.88 120.51 113.26 2jmj n ALA 62 Ca 0.00 0.33 -0.41 0.00 0.00 0.00 0.00 53.44 53.36 2jmj n ALA 62 Cb 0.00 -1.16 0.01 0.00 0.00 0.00 0.00 19.45 18.30 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 0.20 0.28 -0.33 0.00 -0.02 -1.26 -4.80 135.00 129.06 2jmj n PRO 63 Ca 0.00 0.10 0.19 0.00 -2.02 0.00 0.00 63.50 61.77 2jmj n PRO 63 Cb 0.00 -1.28 0.40 0.00 -0.02 0.00 0.00 33.50 32.60 2jmj n PRO 63 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2jmj h LYS 64 N 0.44 0.40 0.00 -0.52 3.64 -1.96 -3.34 116.57 115.23 2jmj h LYS 64 Ca -0.40 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 2jmj h LYS 64 Cb 1.42 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 2jmj h LYS 64 CO 0.48 0.26 0.00 0.41 -2.27 0.00 0.00 179.45 178.33 2jmj n GLY 65 N -1.31 -0.03 2.90 5.01 0.00 -1.26 -5.03 105.19 105.47 2jmj n GLY 65 Ca 0.28 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.18 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 0.09 0.30 1.61 1.02 -1.25 -5.16 119.74 116.35 2jmj s LYS 66 Ca 0.00 -0.16 0.07 0.00 0.02 0.00 0.00 55.97 55.91 2jmj s LYS 66 Cb 0.00 0.01 -0.03 0.00 -0.52 0.00 0.00 37.83 37.29 2jmj s LYS 66 CO 0.00 -0.01 0.26 -0.46 -0.92 0.00 0.00 175.35 174.22 2jmj s TRP 67 N -0.36 3.00 -0.15 3.18 -0.11 -1.26 -4.81 118.94 118.42 2jmj s TRP 67 Ca -0.04 -0.22 0.00 0.00 1.22 0.00 0.00 56.10 57.06 2jmj s TRP 67 Cb -0.03 -1.65 -0.01 0.00 -1.50 0.00 0.00 33.47 30.29 2jmj s TRP 67 CO -0.00 0.31 -0.14 0.71 -4.62 0.00 0.00 176.95 173.20 2jmj s TYR 68 N -2.23 2.79 0.24 5.86 2.02 -1.26 -3.79 117.35 120.98 2jmj s TYR 68 Ca 0.38 -0.93 0.22 0.00 -0.37 0.00 0.00 57.07 56.36 2jmj s TYR 68 Cb -0.07 -1.88 0.76 0.00 -0.40 0.00 0.00 41.96 40.37 2jmj s TYR 68 CO 0.26 -0.41 0.69 0.00 -1.57 0.00 0.00 175.55 174.52 2jmj s SER 70 N -4.00 -0.34 0.59 0.00 0.15 -1.26 -4.79 113.70 104.05 2jmj s SER 70 Ca -0.02 -0.11 0.30 0.00 0.70 0.00 0.00 55.95 56.81 2jmj s SER 70 Cb 0.12 0.44 1.35 0.00 -1.71 0.00 0.00 66.02 66.22 2jmj s SER 70 CO 0.39 -0.74 1.73 0.11 1.20 0.00 0.00 173.24 175.93 2jmj h LYS 71 N 2.00 0.00 0.00 5.44 1.57 -1.99 0.19 116.57 123.78 2jmj h LYS 71 Ca -0.24 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.41 2jmj h LYS 71 Cb 1.25 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.54 2jmj h LYS 71 CO 0.30 0.00 -0.82 -0.44 -0.57 0.00 0.00 179.45 177.93 2jmj h ASP 72 N 0.00 0.00 -1.49 0.86 3.32 -1.94 -3.18 116.42 114.00 2jmj h ASP 72 Ca 0.33 -0.45 0.46 0.00 0.02 0.00 0.00 57.03 57.40 2jmj h ASP 72 Cb 1.78 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 41.24 2jmj h ASP 72 CO -0.00 1.19 1.03 0.00 -1.72 0.00 0.00 179.24 179.74 2jmj h LYS 74 N 0.00 -0.07 -0.44 0.00 3.64 -1.40 -3.11 116.57 115.18 2jmj h LYS 74 Ca 0.79 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 60.25 2jmj h LYS 74 Cb 2.91 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 34.69 2jmj h LYS 74 CO -0.17 -0.05 0.05 0.93 -2.27 0.00 0.00 179.45 177.94 2jmj h GLU 75 N -0.97 0.17 -1.00 1.90 4.39 0.19 0.96 114.58 120.23 2jmj h GLU 75 Ca -0.01 -0.01 0.23 0.00 0.34 0.00 0.00 59.36 59.91 2jmj h GLU 75 Cb 0.06 -0.04 -0.09 0.00 -0.10 0.00 0.00 28.75 28.58 2jmj h GLU 75 CO 0.01 0.11 0.63 0.82 -1.16 0.00 0.00 179.01 179.43 2jmj h ILE 76 N 0.17 0.61 -0.21 3.13 2.04 0.22 1.97 117.51 125.44 2jmj h ILE 76 Ca 0.22 -0.17 -0.07 0.00 1.00 0.00 0.00 64.86 65.84 2jmj h ILE 76 Cb 0.30 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 2jmj h ILE 76 CO -0.32 0.09 -0.18 0.00 0.00 0.00 0.00 178.15 177.74 2jmj h ALA 77 N 1.63 1.31 0.00 1.87 0.00 -0.75 -3.34 119.26 119.98 2jmj h ALA 77 Ca 0.56 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2jmj h ALA 77 Cb 1.27 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2jmj h ALA 77 CO -0.29 0.46 -0.28 -1.71 0.00 0.00 0.00 179.25 177.43 2jmj n ASN 78 N -4.19 0.96 -4.24 0.00 2.85 0.27 -4.94 115.26 105.96 2jmj n ASN 78 Ca -0.00 0.44 -0.21 0.00 -0.11 0.00 0.00 54.58 54.70 2jmj n ASN 78 Cb 0.33 -0.70 -0.12 0.00 1.24 0.00 0.00 39.78 40.54 2jmj n ASN 78 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 2jmj s GLN 79 N -1.67 1.01 0.21 1.20 -1.52 0.60 -5.05 119.66 114.44 2jmj s GLN 79 Ca -0.08 -1.12 -0.09 0.00 -1.95 0.00 0.00 55.36 52.12 2jmj s GLN 79 Cb 0.01 -1.11 0.30 0.00 -0.22 0.00 0.00 33.01 31.99 2jmj s GLN 79 CO 0.12 0.24 1.73 -0.09 -0.25 0.00 0.00 175.29 177.05 2jmj h ARG 80 N 4.00 0.36 -3.13 2.91 2.43 -1.77 -2.92 114.38 116.26 2jmj h ARG 80 Ca -0.43 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 58.71 2jmj h ARG 80 Cb 1.19 -0.08 -0.10 0.00 -0.42 0.00 0.00 29.97 30.55 2jmj h ARG 80 CO 0.42 0.24 0.13 0.45 -1.51 0.00 0.00 179.97 179.71 2jmj s SER 81 N -5.36 -0.40 0.29 -3.80 0.15 -1.26 -4.60 113.70 98.72 2jmj s SER 81 Ca -0.13 -0.27 -0.29 0.00 0.70 0.00 0.00 55.95 55.96 2jmj s SER 81 Cb 0.17 0.60 -0.10 0.00 -1.71 0.00 0.00 66.02 64.99 2jmj s SER 81 CO 0.74 -1.05 1.15 -0.75 1.20 0.00 0.00 173.24 174.54 2jmj s LYS 82 N -3.82 4.57 0.00 5.44 2.20 -1.26 -5.08 119.74 121.78 2jmj s LYS 82 Ca 0.05 1.90 0.00 0.00 -0.36 0.00 0.00 55.97 57.57 2jmj s LYS 82 Cb -0.02 -3.16 0.00 0.00 -1.51 0.00 0.00 37.83 33.14 2jmj s LYS 82 CO -0.07 0.10 0.00 -1.13 -0.36 0.00 0.00 175.35 173.90