#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 0.06 -0.05 3.69 2.02 -1.26 -5.02 118.70 118.13 2jmj s GLU 25 Ca 0.00 0.56 -0.04 0.00 0.02 0.00 0.00 54.97 55.51 2jmj s GLU 25 Cb 0.00 -0.22 0.02 0.00 0.10 0.00 0.00 34.13 34.03 2jmj s GLU 25 CO 0.00 -0.28 0.13 -1.21 0.02 0.00 0.00 175.26 173.92 2jmj s GLU 26 N 2.12 0.12 0.68 1.61 2.02 -1.26 -5.04 118.70 118.94 2jmj s GLU 26 Ca 0.01 0.26 -0.11 0.00 0.02 0.00 0.00 54.97 55.14 2jmj s GLU 26 Cb -0.12 -0.05 0.00 0.00 0.10 0.00 0.00 34.13 34.07 2jmj s GLU 26 CO -0.06 -0.09 1.06 0.08 0.02 0.00 0.00 175.26 176.27 2jmj s VAL 27 N 0.58 3.98 0.03 2.63 1.01 -1.26 -2.50 120.40 124.87 2jmj s VAL 27 Ca -0.04 0.68 0.00 0.00 0.00 0.00 0.00 61.98 62.62 2jmj s VAL 27 Cb -0.06 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 32.94 2jmj s VAL 27 CO -0.03 -0.80 0.00 -1.22 0.00 0.00 0.00 175.10 173.05 2jmj n TYR 28 N -3.00 -1.69 0.39 5.22 4.01 -1.23 -4.89 117.16 115.98 2jmj n TYR 28 Ca 0.08 0.09 0.00 0.00 -0.16 0.00 0.00 57.90 57.90 2jmj n TYR 28 Cb 0.53 0.66 0.00 0.00 -0.31 0.00 0.00 39.34 40.22 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 0.74 0.00 0.35 0.00 3.72 -1.26 -4.67 117.46 116.33 2jmj n PHE 30 Ca 0.00 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.44 2jmj n PHE 30 Cb 0.18 -1.41 0.20 0.00 -0.94 0.00 0.00 39.48 37.51 2jmj n PHE 30 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2jmj n ARG 32 N -1.37 -1.05 -4.58 0.00 1.74 -1.26 -4.96 116.66 105.18 2jmj n ARG 32 Ca 0.03 0.26 -0.27 0.00 -0.77 0.00 0.00 57.85 57.11 2jmj n ARG 32 Cb 0.08 -4.13 -0.11 0.00 -1.02 0.00 0.00 32.46 27.28 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 -2.05 3.59 0.46 0.55 6.03 -1.26 -4.95 114.94 117.32 2jmj s ASN 33 Ca 0.00 -1.35 -0.08 0.00 -1.03 0.00 0.00 52.86 50.40 2jmj s ASN 33 Cb 0.00 -0.34 -0.05 0.00 -3.03 0.00 0.00 41.25 37.83 2jmj s ASN 33 CO 0.00 -0.44 0.81 -0.69 -2.03 0.00 0.00 177.10 174.74 2jmj s VAL 34 N -2.80 4.83 -0.32 3.54 1.01 -1.26 -3.48 120.40 121.93 2jmj s VAL 34 Ca 0.35 0.46 -0.28 0.00 0.00 0.00 0.00 61.98 62.51 2jmj s VAL 34 Cb 0.09 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 2jmj s VAL 34 CO 0.17 -0.74 2.15 -0.55 0.00 0.00 0.00 175.10 176.13 2jmj s SER 35 N -3.71 5.33 0.00 3.32 0.15 -1.04 -4.89 113.70 112.86 2jmj s SER 35 Ca 0.50 1.53 0.00 0.00 0.70 0.00 0.00 55.95 58.68 2jmj s SER 35 Cb -0.10 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2jmj s SER 35 CO 0.40 -2.12 0.14 -1.22 1.20 0.00 0.00 173.24 171.65 2jmj n TYR 36 N 12.30 0.00 0.00 3.44 4.01 -1.26 -4.96 117.16 130.69 2jmj n TYR 36 Ca 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.03 2jmj n TYR 36 Cb 0.48 -0.33 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 2jmj n TYR 36 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jmj n GLY 37 N 1.65 5.25 0.90 2.72 0.00 -1.26 -5.08 105.19 109.37 2jmj n GLY 37 Ca 0.00 -1.20 -0.16 0.00 0.00 0.00 0.00 46.02 44.66 2jmj n GLY 37 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jmj n PRO 38 N 0.00 0.00 -4.46 1.61 -0.02 -1.26 -4.62 135.00 126.25 2jmj n PRO 38 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.24 2jmj n PRO 38 Cb 0.00 -0.37 -0.09 0.00 -0.02 0.00 0.00 33.50 33.02 2jmj n PRO 38 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2jmj s MET 39 N 0.32 1.83 -0.04 -0.52 -1.94 -1.26 0.00 119.30 117.70 2jmj s MET 39 Ca 0.24 -2.10 -0.29 0.00 -1.71 0.00 0.00 55.69 51.83 2jmj s MET 39 Cb -0.34 -0.48 0.09 0.00 2.01 0.00 0.00 34.83 36.11 2jmj s MET 39 CO 0.17 -0.46 0.79 0.54 -0.01 0.00 0.00 175.02 176.05 2jmj s VAL 40 N -3.30 0.00 -0.14 -6.03 0.11 0.14 -4.79 120.40 106.38 2jmj s VAL 40 Ca 0.28 0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 59.28 2jmj s VAL 40 Cb 0.03 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.85 2jmj s VAL 40 CO 0.16 0.00 0.03 0.00 -3.33 0.00 0.00 175.10 171.96 2jmj s ALA 41 N -1.88 3.35 -0.54 1.54 0.00 -1.26 0.14 121.76 123.11 2jmj s ALA 41 Ca -0.04 -0.76 -0.34 0.00 0.00 0.00 0.00 51.96 50.81 2jmj s ALA 41 Cb -0.00 -1.73 -0.14 0.00 0.00 0.00 0.00 23.12 21.24 2jmj s ALA 41 CO 0.01 0.35 2.33 0.00 0.00 0.00 0.00 175.76 178.45 2jmj n ASP 43 N 10.56 5.14 -4.24 0.00 2.03 -1.21 -4.80 116.55 124.03 2jmj n ASP 43 Ca 0.48 -2.92 -0.33 0.00 0.52 0.00 0.00 54.79 52.55 2jmj n ASP 43 Cb 0.19 -0.89 -0.16 0.00 -0.72 0.00 0.00 41.12 39.54 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 0.11 3.44 0.63 1.67 3.04 -1.26 -4.98 114.94 117.59 2jmj s ASN 44 Ca 0.28 -0.51 0.18 0.00 0.04 0.00 0.00 52.86 52.85 2jmj s ASN 44 Cb 0.23 -1.51 0.69 0.00 -1.54 0.00 0.00 41.25 39.12 2jmj s ASN 44 CO 0.02 0.10 1.29 -0.65 -3.04 0.00 0.00 177.10 174.82 2jmj h PRO 45 N 7.15 0.00 0.00 0.43 0.11 -1.90 -2.76 132.00 135.04 2jmj h PRO 45 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2jmj h PRO 45 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2jmj h PRO 45 CO 0.55 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.34 2jmj n ALA 46 N -1.97 0.06 -0.14 -0.75 0.00 -1.26 -5.04 120.51 111.41 2jmj n ALA 46 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2jmj n ALA 46 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.65 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 1.64 0.04 0.00 0.00 0.11 -1.96 -3.41 132.00 128.42 2jmj h PRO 48 Ca 0.00 -0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.63 2jmj h PRO 48 Cb 0.00 -0.01 -0.10 0.00 0.11 0.00 0.00 31.00 31.01 2jmj h PRO 48 CO 0.00 0.02 -0.36 1.19 -0.21 0.00 0.00 178.00 178.64 2jmj n PHE 49 N -4.50 0.55 -2.71 0.65 3.72 -1.26 -5.08 117.46 108.83 2jmj n PHE 49 Ca 0.40 -1.97 0.01 0.00 -0.05 0.00 0.00 57.45 55.84 2jmj n PHE 49 Cb 1.61 -0.15 0.04 0.00 -0.94 0.00 0.00 39.48 40.05 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 -0.86 1.15 -3.51 -1.08 1.02 -1.26 -4.25 120.64 111.85 2jmj n GLU 50 Ca -0.11 -2.87 0.00 0.00 -0.02 0.00 0.00 57.16 54.17 2jmj n GLU 50 Cb 0.48 -0.96 -0.04 0.00 -0.02 0.00 0.00 31.44 30.91 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 -2.36 -1.16 0.01 -0.32 0.23 -1.26 -3.96 118.94 110.13 2jmj s TRP 51 Ca 0.27 1.90 -0.03 0.00 -2.03 0.00 0.00 56.10 56.20 2jmj s TRP 51 Cb 0.34 0.65 -0.01 0.00 0.03 0.00 0.00 33.47 34.48 2jmj s TRP 51 CO -0.08 -0.58 0.05 -0.06 0.96 0.00 0.00 176.95 177.23 2jmj s PHE 52 N 2.77 0.17 0.30 -1.98 0.40 0.37 -3.02 117.98 116.98 2jmj s PHE 52 Ca -0.02 -0.38 0.03 0.00 -0.60 0.00 0.00 56.93 55.96 2jmj s PHE 52 Cb -0.11 -0.13 -0.03 0.00 0.51 0.00 0.00 43.02 43.26 2jmj s PHE 52 CO -0.19 -0.25 0.45 -1.01 0.70 0.00 0.00 175.22 174.93 2jmj s HIS 53 N -1.57 3.43 0.16 0.36 3.76 -1.26 0.24 115.29 120.41 2jmj s HIS 53 Ca -0.14 0.11 0.06 0.00 -0.15 0.00 0.00 55.06 54.93 2jmj s HIS 53 Cb -0.08 -1.76 -0.04 0.00 1.11 0.00 0.00 32.58 31.81 2jmj s HIS 53 CO -0.00 0.24 1.37 1.88 -0.85 0.00 0.00 174.74 177.38 2jmj h TYR 54 N 0.95 0.12 0.00 1.40 -1.99 -0.68 0.19 116.97 116.97 2jmj h TYR 54 Ca -0.50 -0.07 -0.06 0.00 2.00 0.00 0.00 58.73 60.10 2jmj h TYR 54 Cb 1.23 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 39.94 2jmj h TYR 54 CO 0.47 0.93 -0.26 0.78 -0.00 0.00 0.00 178.16 180.08 2jmj h GLY 55 N 2.32 0.00 0.20 3.88 0.00 -1.92 -2.98 103.07 104.57 2jmj h GLY 55 Ca -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 2jmj h GLY 55 CO 0.13 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.66 2jmj n VAL 57 N -4.73 0.00 -3.36 0.00 0.24 0.03 -5.00 118.33 105.50 2jmj n VAL 57 Ca -0.09 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.08 2jmj n VAL 57 Cb 0.36 0.00 -0.08 0.00 -1.47 0.00 0.00 33.84 32.65 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 -0.33 0.00 7.63 0.00 -1.25 -4.87 107.32 108.50 2jmj s GLY 58 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 44.72 44.79 2jmj s GLY 58 CO 0.00 2.78 0.00 1.47 0.00 0.00 0.00 173.10 177.35 2jmj n LEU 59 N 5.33 0.00 -4.45 0.66 -0.00 -1.26 -5.10 117.00 112.18 2jmj n LEU 59 Ca -0.01 0.00 -0.43 0.00 -0.00 0.00 0.00 56.01 55.56 2jmj n LEU 59 Cb 0.48 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.86 2jmj n LEU 59 CO 0.01 0.00 0.76 -0.54 -0.00 0.00 0.00 177.39 177.61 2jmj s LYS 60 N 0.00 3.18 0.18 1.47 1.02 -1.26 -4.80 119.74 119.53 2jmj s LYS 60 Ca 0.00 -1.02 0.00 0.00 0.02 0.00 0.00 55.97 54.97 2jmj s LYS 60 Cb 0.00 -4.34 0.00 0.00 -0.52 0.00 0.00 37.83 32.97 2jmj s LYS 60 CO 0.00 -1.79 0.00 1.04 -0.92 0.00 0.00 175.35 173.68 2jmj n GLN 61 N 7.41 -1.55 -1.76 1.68 6.02 -1.26 -4.90 117.38 123.02 2jmj n GLN 61 Ca -0.00 1.16 -0.40 0.00 -0.01 0.00 0.00 57.00 57.75 2jmj n GLN 61 Cb 0.46 -1.32 0.02 0.00 1.02 0.00 0.00 30.24 30.41 2jmj n GLN 61 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jmj n ALA 62 N -1.05 2.09 -1.56 -1.58 0.00 -1.26 -4.97 120.51 112.18 2jmj n ALA 62 Ca 0.00 0.26 -0.33 0.00 0.00 0.00 0.00 53.44 53.37 2jmj n ALA 62 Cb 0.02 -2.40 0.04 0.00 0.00 0.00 0.00 19.45 17.10 2jmj n ALA 62 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2jmj s PRO 63 N -2.41 2.96 0.42 0.00 0.04 -1.26 -4.92 135.00 129.83 2jmj s PRO 63 Ca 0.60 1.28 0.16 0.00 0.04 0.00 0.00 61.00 63.08 2jmj s PRO 63 Cb -0.45 -1.98 1.05 0.00 0.04 0.00 0.00 34.50 33.16 2jmj s PRO 63 CO 0.58 -1.11 1.91 0.87 0.04 0.00 0.00 177.00 179.30 2jmj h LYS 64 N 0.04 0.41 0.00 4.56 1.57 -2.02 -3.36 116.57 117.78 2jmj h LYS 64 Ca -0.46 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 2jmj h LYS 64 Cb 1.23 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.45 2jmj h LYS 64 CO 0.55 0.27 0.00 0.41 -0.57 0.00 0.00 179.45 180.11 2jmj n GLY 65 N -1.52 1.02 3.49 3.86 0.00 -1.26 -5.10 105.19 105.68 2jmj n GLY 65 Ca 0.15 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.01 2jmj n GLY 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jmj s LYS 66 N 0.14 0.87 0.33 1.61 0.00 -1.26 -5.17 119.74 116.26 2jmj s LYS 66 Ca 0.00 0.45 0.08 0.00 0.00 0.00 0.00 55.97 56.49 2jmj s LYS 66 Cb 0.00 0.41 -0.03 0.00 0.00 0.00 0.00 37.83 38.21 2jmj s LYS 66 CO 0.00 -0.21 0.27 -0.46 0.00 0.00 0.00 175.35 174.95 2jmj s TRP 67 N -0.59 2.89 -0.22 1.78 -0.11 -1.26 -4.86 118.94 116.57 2jmj s TRP 67 Ca -0.07 -0.30 -0.04 0.00 1.22 0.00 0.00 56.10 56.91 2jmj s TRP 67 Cb -0.03 -1.75 -0.01 0.00 -1.50 0.00 0.00 33.47 30.18 2jmj s TRP 67 CO 0.05 0.23 -0.03 0.71 -4.62 0.00 0.00 176.95 173.29 2jmj s TYR 68 N -2.31 2.97 0.10 5.86 2.02 -1.26 -3.32 117.35 121.41 2jmj s TYR 68 Ca 0.40 -0.86 0.06 0.00 -0.37 0.00 0.00 57.07 56.30 2jmj s TYR 68 Cb -0.05 -2.12 0.37 0.00 -0.40 0.00 0.00 41.96 39.76 2jmj s TYR 68 CO 0.26 -0.51 0.43 0.00 -1.57 0.00 0.00 175.55 174.16 2jmj s SER 70 N -4.86 -0.16 0.56 0.00 0.01 -1.26 -4.83 113.70 103.16 2jmj s SER 70 Ca -0.02 -0.56 0.31 0.00 1.31 0.00 0.00 55.95 56.98 2jmj s SER 70 Cb 0.09 0.59 1.47 0.00 0.21 0.00 0.00 66.02 68.38 2jmj s SER 70 CO 0.21 -1.11 1.87 0.50 0.41 0.00 0.00 173.24 175.13 2jmj h LYS 71 N 2.00 0.00 0.00 12.44 3.64 -2.01 -1.23 116.57 131.41 2jmj h LYS 71 Ca -0.24 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.14 2jmj h LYS 71 Cb 1.24 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.06 2jmj h LYS 71 CO 0.27 0.00 -0.01 -0.44 -2.27 0.00 0.00 179.45 177.01 2jmj h ASP 72 N 0.00 0.00 -0.56 4.20 3.32 -1.94 -3.11 116.42 118.33 2jmj h ASP 72 Ca 0.36 -0.27 0.10 0.00 0.02 0.00 0.00 57.03 57.24 2jmj h ASP 72 Cb 1.59 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 41.04 2jmj h ASP 72 CO -0.00 0.64 -0.18 0.00 -1.72 0.00 0.00 179.24 177.97 2jmj h LYS 74 N 0.00 0.69 -0.65 0.00 2.10 -1.64 -1.90 116.57 115.18 2jmj h LYS 74 Ca 0.23 -0.31 -0.05 0.00 -2.00 0.00 0.00 60.65 58.52 2jmj h LYS 74 Cb 0.37 -0.01 -0.03 0.00 -0.90 0.00 0.00 32.23 31.66 2jmj h LYS 74 CO -0.56 0.91 0.20 1.49 -2.00 0.00 0.00 179.45 179.48 2jmj h GLU 75 N 0.45 1.01 -0.21 0.07 4.81 0.28 -2.12 114.58 118.87 2jmj h GLU 75 Ca 0.07 -0.22 -0.04 0.00 -0.13 0.00 0.00 59.36 59.04 2jmj h GLU 75 Cb 0.71 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 2jmj h GLU 75 CO 0.05 0.89 -0.03 0.82 -0.73 0.00 0.00 179.01 180.00 2jmj h ILE 76 N 0.94 1.15 -0.49 2.32 2.04 0.23 -1.77 117.51 121.92 2jmj h ILE 76 Ca 0.21 -0.62 -0.08 0.00 1.00 0.00 0.00 64.86 65.36 2jmj h ILE 76 Cb 0.30 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 2jmj h ILE 76 CO -0.01 0.20 -0.02 0.00 0.00 0.00 0.00 178.15 178.32 2jmj h ALA 77 N 1.67 1.03 -0.35 1.87 0.00 -0.69 -2.63 119.26 120.15 2jmj h ALA 77 Ca 0.07 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 2jmj h ALA 77 Cb 0.27 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2jmj h ALA 77 CO 0.01 0.60 -0.15 -0.91 0.00 0.00 0.00 179.25 178.79 2jmj h ASN 78 N 0.78 0.63 0.00 0.00 2.35 -0.87 -3.46 115.58 115.00 2jmj h ASN 78 Ca 0.14 -0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 2jmj h ASN 78 Cb 0.50 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.70 2jmj h ASN 78 CO 0.03 0.80 0.00 1.67 -1.65 0.00 0.00 177.43 178.27 2jmj n GLN 79 N -4.16 0.00 -4.92 0.81 7.27 -0.93 -4.86 117.38 110.59 2jmj n GLN 79 Ca 0.01 0.00 -0.27 0.00 0.07 0.00 0.00 57.00 56.81 2jmj n GLN 79 Cb 0.37 -1.21 -0.16 0.00 2.41 0.00 0.00 30.24 31.64 2jmj n GLN 79 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 2jmj s ARG 80 N 0.00 1.81 0.42 3.69 0.52 -1.26 -5.01 118.95 119.11 2jmj s ARG 80 Ca 0.00 -0.67 0.17 0.00 -0.52 0.00 0.00 55.73 54.71 2jmj s ARG 80 Cb 0.00 -1.61 0.94 0.00 0.52 0.00 0.00 34.95 34.80 2jmj s ARG 80 CO 0.00 0.31 1.91 0.66 0.02 0.00 0.00 175.30 178.20 2jmj h SER 81 N 6.05 0.00 -2.86 0.23 4.64 -1.92 -3.42 113.55 116.27 2jmj h SER 81 Ca -0.34 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.35 2jmj h SER 81 Cb 1.16 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.20 2jmj h SER 81 CO 0.48 0.28 -0.35 -0.54 -0.87 0.00 0.00 176.83 175.82 2jmj s LYS 82 N -4.22 3.65 0.00 4.77 1.02 -1.26 -5.19 119.74 118.50 2jmj s LYS 82 Ca -0.03 0.07 0.00 0.00 0.02 0.00 0.00 55.97 56.04 2jmj s LYS 82 Cb 0.14 -3.15 0.00 0.00 -0.52 0.00 0.00 37.83 34.30 2jmj s LYS 82 CO 0.68 0.70 0.00 0.45 -0.92 0.00 0.00 175.35 176.26