#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 2.13 -0.06 3.69 0.41 -1.26 -4.98 118.70 118.64 2jmj s GLU 25 Ca 0.00 -0.73 -0.00 0.00 -0.41 0.00 0.00 54.97 53.83 2jmj s GLU 25 Cb 0.00 -2.29 0.03 0.00 -1.78 0.00 0.00 34.13 30.08 2jmj s GLU 25 CO 0.00 -0.35 -0.01 -1.21 -0.49 0.00 0.00 175.26 173.19 2jmj s GLU 26 N 1.43 0.66 0.72 1.61 0.41 -1.26 -5.03 118.70 117.25 2jmj s GLU 26 Ca 0.01 0.03 -0.13 0.00 -0.41 0.00 0.00 54.97 54.47 2jmj s GLU 26 Cb -0.15 -0.89 0.03 0.00 -1.78 0.00 0.00 34.13 31.35 2jmj s GLU 26 CO -0.09 -0.21 1.12 0.08 -0.49 0.00 0.00 175.26 175.67 2jmj s VAL 27 N 1.52 3.01 0.00 2.63 1.01 -1.26 -2.35 120.40 124.96 2jmj s VAL 27 Ca -0.02 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.38 2jmj s VAL 27 Cb -0.13 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.35 2jmj s VAL 27 CO -0.03 -0.34 0.00 -1.22 0.00 0.00 0.00 175.10 173.51 2jmj n TYR 28 N -2.91 0.00 -1.28 5.22 4.01 -0.84 -4.87 117.16 116.50 2jmj n TYR 28 Ca 0.11 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.49 2jmj n TYR 28 Cb 0.52 0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.64 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 -2.60 0.00 0.40 0.00 3.72 -1.26 0.09 117.46 117.82 2jmj n PHE 30 Ca 0.12 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.62 2jmj n PHE 30 Cb 0.50 -0.17 0.43 0.00 -0.94 0.00 0.00 39.48 39.30 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 -2.01 -4.45 -4.23 0.00 1.74 0.11 -5.01 116.66 102.82 2jmj n ARG 32 Ca 0.02 0.76 -0.14 0.00 -0.77 0.00 0.00 57.85 57.73 2jmj n ARG 32 Cb 0.20 -5.34 -0.10 0.00 -1.02 0.00 0.00 32.46 26.20 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 -2.81 1.65 0.88 0.55 6.03 -1.26 -4.92 114.94 115.06 2jmj s ASN 33 Ca 0.28 -0.99 -0.11 0.00 -1.03 0.00 0.00 52.86 51.00 2jmj s ASN 33 Cb -0.12 0.01 0.12 0.00 -3.03 0.00 0.00 41.25 38.22 2jmj s ASN 33 CO 0.35 -0.35 1.09 -0.69 -2.03 0.00 0.00 177.10 175.48 2jmj s VAL 34 N -3.30 2.72 -0.73 3.54 1.01 -1.26 -1.99 120.40 120.40 2jmj s VAL 34 Ca 0.15 0.23 -0.26 0.00 0.00 0.00 0.00 61.98 62.10 2jmj s VAL 34 Cb 0.03 -2.75 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 2jmj s VAL 34 CO -0.00 -0.30 1.87 -0.55 0.00 0.00 0.00 175.10 176.11 2jmj s SER 35 N -3.48 5.27 0.03 3.32 0.15 -0.99 -4.83 113.70 113.16 2jmj s SER 35 Ca 0.63 -0.08 -0.26 0.00 0.70 0.00 0.00 55.95 56.94 2jmj s SER 35 Cb -0.17 -2.54 -0.14 0.00 -1.71 0.00 0.00 66.02 61.45 2jmj s SER 35 CO 0.57 -2.48 1.21 1.88 1.20 0.00 0.00 173.24 175.61 2jmj h TYR 36 N 13.42 -0.85 0.00 3.44 0.05 -1.93 -3.48 116.97 127.62 2jmj h TYR 36 Ca -0.12 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.64 2jmj h TYR 36 Cb 1.10 0.28 0.00 0.00 1.01 0.00 0.00 36.73 39.12 2jmj h TYR 36 CO 1.11 -0.53 0.00 0.41 -1.05 0.00 0.00 178.16 178.10 2jmj n GLY 37 N -0.96 -1.95 3.59 3.88 0.00 -1.26 -5.09 105.19 103.39 2jmj n GLY 37 Ca -0.11 0.58 -0.41 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.12 3.03 0.26 1.61 0.04 -1.26 -4.95 135.00 133.61 2jmj s PRO 38 Ca 0.00 1.39 0.01 0.00 0.04 0.00 0.00 61.00 62.43 2jmj s PRO 38 Cb 0.00 -4.31 -0.03 0.00 0.04 0.00 0.00 34.50 30.21 2jmj s PRO 38 CO 0.00 -2.22 0.25 -1.64 0.04 0.00 0.00 177.00 173.43 2jmj s MET 39 N 6.32 1.50 0.16 4.56 -1.94 -1.26 0.68 119.30 129.32 2jmj s MET 39 Ca 0.83 -1.74 -0.16 0.00 -1.71 0.00 0.00 55.69 52.91 2jmj s MET 39 Cb -0.22 0.33 0.03 0.00 2.01 0.00 0.00 34.83 36.97 2jmj s MET 39 CO 0.31 -0.55 0.43 0.54 -0.01 0.00 0.00 175.02 175.75 2jmj s VAL 40 N -3.78 0.05 -0.09 -6.03 0.11 0.25 -4.89 120.40 106.02 2jmj s VAL 40 Ca 0.37 -0.77 -0.02 0.00 -2.93 0.00 0.00 61.98 58.63 2jmj s VAL 40 Cb 0.04 -1.43 -0.03 0.00 -1.53 0.00 0.00 36.38 33.43 2jmj s VAL 40 CO 0.18 -0.24 0.01 0.00 -3.33 0.00 0.00 175.10 171.72 2jmj s ALA 41 N -3.86 3.30 -0.26 1.54 0.00 -1.26 0.11 121.76 121.34 2jmj s ALA 41 Ca 0.07 -0.80 -0.34 0.00 0.00 0.00 0.00 51.96 50.90 2jmj s ALA 41 Cb 0.01 -1.51 -0.11 0.00 0.00 0.00 0.00 23.12 21.51 2jmj s ALA 41 CO -0.07 0.56 2.09 0.00 0.00 0.00 0.00 175.76 178.35 2jmj n ASP 43 N 9.13 7.18 -4.17 0.00 2.03 -1.22 -4.82 116.55 124.67 2jmj n ASP 43 Ca 0.34 -3.57 -0.29 0.00 0.52 0.00 0.00 54.79 51.79 2jmj n ASP 43 Cb 0.28 -1.09 -0.17 0.00 -0.72 0.00 0.00 41.12 39.43 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 -0.74 2.62 0.60 1.67 2.47 -1.26 -4.93 114.94 115.36 2jmj s ASN 44 Ca 0.54 -0.46 0.27 0.00 0.42 0.00 0.00 52.86 53.64 2jmj s ASN 44 Cb 0.42 -1.05 1.04 0.00 -1.45 0.00 0.00 41.25 40.21 2jmj s ASN 44 CO -0.22 0.14 1.42 -0.65 -3.72 0.00 0.00 177.10 174.08 2jmj h PRO 45 N 6.60 0.00 0.00 0.43 0.11 -1.90 -3.26 132.00 133.98 2jmj h PRO 45 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2jmj h PRO 45 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2jmj h PRO 45 CO 0.47 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.26 2jmj n ALA 46 N -2.27 0.24 -2.99 -0.75 0.00 -1.26 -5.07 120.51 108.42 2jmj n ALA 46 Ca 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.64 2jmj n ALA 46 Cb 1.36 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.81 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 3.63 0.01 -5.08 0.00 0.11 -1.97 -3.40 132.00 125.29 2jmj h PRO 48 Ca -0.04 -0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.46 2jmj h PRO 48 Cb 0.60 -0.00 -0.13 0.00 0.11 0.00 0.00 31.00 31.58 2jmj h PRO 48 CO 0.03 0.01 -0.51 -0.06 -0.21 0.00 0.00 178.00 177.26 2jmj s PHE 49 N -4.98 1.80 -0.10 0.65 0.08 -1.26 -5.08 117.98 109.08 2jmj s PHE 49 Ca -0.06 -1.19 0.24 0.00 0.12 0.00 0.00 56.93 56.05 2jmj s PHE 49 Cb 0.28 -1.32 0.45 0.00 -0.57 0.00 0.00 43.02 41.86 2jmj s PHE 49 CO 0.87 -0.12 1.15 0.39 -0.10 0.00 0.00 175.22 177.41 2jmj n GLU 50 N -1.06 0.66 -3.65 0.44 1.02 -1.26 -4.25 120.64 112.53 2jmj n GLU 50 Ca -0.11 -2.54 -0.02 0.00 -0.02 0.00 0.00 57.16 54.47 2jmj n GLU 50 Cb 0.66 -0.58 -0.05 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 -1.41 -1.29 -0.02 -0.32 0.23 -1.25 -3.69 118.94 111.19 2jmj s TRP 51 Ca 0.31 2.29 -0.12 0.00 -2.03 0.00 0.00 56.10 56.55 2jmj s TRP 51 Cb 0.36 0.77 0.02 0.00 0.03 0.00 0.00 33.47 34.64 2jmj s TRP 51 CO -0.12 -0.64 0.25 -0.06 0.96 0.00 0.00 176.95 177.35 2jmj s PHE 52 N 2.62 -0.13 0.41 -1.98 0.40 0.30 -1.88 117.98 117.73 2jmj s PHE 52 Ca -0.07 0.20 -0.02 0.00 -0.60 0.00 0.00 56.93 56.44 2jmj s PHE 52 Cb -0.10 0.05 -0.03 0.00 0.51 0.00 0.00 43.02 43.45 2jmj s PHE 52 CO -0.19 -0.33 0.66 -1.01 0.70 0.00 0.00 175.22 175.05 2jmj s HIS 53 N -1.18 3.49 0.11 0.36 3.76 -1.26 0.87 115.29 121.44 2jmj s HIS 53 Ca -0.12 0.52 0.16 0.00 -0.15 0.00 0.00 55.06 55.46 2jmj s HIS 53 Cb -0.06 -2.11 0.41 0.00 1.11 0.00 0.00 32.58 31.94 2jmj s HIS 53 CO 0.03 -0.10 1.61 1.88 -0.85 0.00 0.00 174.74 177.31 2jmj h TYR 54 N 0.50 0.00 0.00 1.40 -1.99 -0.07 0.95 116.97 117.75 2jmj h TYR 54 Ca -0.48 0.00 -0.16 0.00 2.00 0.00 0.00 58.73 60.08 2jmj h TYR 54 Cb 1.22 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.92 2jmj h TYR 54 CO 0.53 0.50 -0.78 0.78 -0.00 0.00 0.00 178.16 179.19 2jmj h GLY 55 N 2.44 0.00 0.65 3.88 0.00 -1.90 -3.14 103.07 105.00 2jmj h GLY 55 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.29 2jmj h GLY 55 CO 0.06 0.00 -0.07 0.00 0.00 0.00 0.00 176.54 176.53 2jmj n VAL 57 N -4.70 0.00 -3.39 0.00 0.24 0.27 -4.92 118.33 105.83 2jmj n VAL 57 Ca -0.07 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.06 2jmj n VAL 57 Cb 0.30 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.58 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 -0.14 -0.06 7.63 0.00 -1.24 -4.87 107.32 108.65 2jmj s GLY 58 Ca 0.00 -0.42 -0.31 0.00 0.00 0.00 0.00 44.72 43.99 2jmj s GLY 58 CO 0.00 2.69 1.36 0.48 0.00 0.00 0.00 173.10 177.63 2jmj s LEU 59 N 2.20 -0.02 -0.15 0.66 0.05 -1.26 -5.10 118.68 115.05 2jmj s LEU 59 Ca 0.11 -0.08 -0.04 0.00 0.05 0.00 0.00 54.13 54.17 2jmj s LEU 59 Cb -0.14 1.19 0.05 0.00 -2.05 0.00 0.00 46.19 45.24 2jmj s LEU 59 CO -0.27 -0.16 0.06 -0.54 -0.55 0.00 0.00 176.35 174.89 2jmj s LYS 60 N -2.17 0.27 0.00 1.48 3.01 -1.26 -4.80 119.74 116.27 2jmj s LYS 60 Ca 0.18 -0.10 0.00 0.00 -1.01 0.00 0.00 55.97 55.04 2jmj s LYS 60 Cb 0.05 -1.65 0.00 0.00 -1.01 0.00 0.00 37.83 35.22 2jmj s LYS 60 CO -0.05 -0.58 0.00 0.94 0.51 0.00 0.00 175.35 176.17 2jmj n GLN 61 N 5.20 0.00 -1.30 1.68 7.27 -1.26 -4.52 117.38 124.45 2jmj n GLN 61 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.00 2jmj n GLN 61 Cb 0.49 -3.43 0.00 0.00 2.41 0.00 0.00 30.24 29.71 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 0.82 -2.37 -1.41 1.69 0.00 -1.26 -4.87 120.51 113.11 2jmj n ALA 62 Ca 0.00 0.32 -0.44 0.00 0.00 0.00 0.00 53.44 53.32 2jmj n ALA 62 Cb 0.00 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.31 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 0.42 0.32 -0.36 0.00 -0.02 -1.26 -4.78 135.00 129.31 2jmj n PRO 63 Ca 0.00 0.12 0.29 0.00 -2.02 0.00 0.00 63.50 61.88 2jmj n PRO 63 Cb 0.00 -1.25 0.58 0.00 -0.02 0.00 0.00 33.50 32.81 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 0.85 0.25 0.00 -0.52 1.63 -1.96 -3.32 116.57 113.49 2jmj h LYS 64 Ca -0.36 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.43 2jmj h LYS 64 Cb 1.42 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.99 2jmj h LYS 64 CO 0.53 0.16 0.00 0.41 -3.45 0.00 0.00 179.45 177.10 2jmj n GLY 65 N -1.52 0.74 3.06 5.01 0.00 -1.26 -5.05 105.19 106.17 2jmj n GLY 65 Ca 0.29 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.19 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 0.53 0.33 1.61 1.02 -1.25 -5.16 119.74 116.81 2jmj s LYS 66 Ca 0.00 -0.81 0.09 0.00 0.02 0.00 0.00 55.97 55.27 2jmj s LYS 66 Cb 0.00 -0.21 -0.05 0.00 -0.52 0.00 0.00 37.83 37.05 2jmj s LYS 66 CO 0.00 0.02 0.00 -0.46 -0.92 0.00 0.00 175.35 173.99 2jmj s TRP 67 N -1.71 2.55 -0.18 3.18 -0.11 -1.26 -4.73 118.94 116.68 2jmj s TRP 67 Ca -0.08 -0.40 -0.00 0.00 1.22 0.00 0.00 56.10 56.84 2jmj s TRP 67 Cb -0.08 -1.42 0.00 0.00 -1.50 0.00 0.00 33.47 30.47 2jmj s TRP 67 CO -0.01 0.51 -0.14 0.71 -4.62 0.00 0.00 176.95 173.40 2jmj s TYR 68 N -2.49 2.82 0.18 5.86 2.02 -1.26 -3.45 117.35 121.03 2jmj s TYR 68 Ca 0.34 -1.20 0.14 0.00 -0.37 0.00 0.00 57.07 55.98 2jmj s TYR 68 Cb -0.01 -1.94 0.59 0.00 -0.40 0.00 0.00 41.96 40.19 2jmj s TYR 68 CO 0.19 -0.59 0.60 0.00 -1.57 0.00 0.00 175.55 174.18 2jmj s SER 70 N -4.37 -0.21 0.58 0.00 0.01 -1.26 -4.79 113.70 103.67 2jmj s SER 70 Ca -0.03 -0.30 0.30 0.00 1.31 0.00 0.00 55.95 57.23 2jmj s SER 70 Cb 0.11 0.45 1.40 0.00 0.21 0.00 0.00 66.02 68.19 2jmj s SER 70 CO 0.32 -0.81 1.78 0.11 0.41 0.00 0.00 173.24 175.05 2jmj h LYS 71 N 2.00 0.00 0.00 12.44 1.57 -2.00 0.07 116.57 130.65 2jmj h LYS 71 Ca -0.24 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.53 2jmj h LYS 71 Cb 1.23 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.54 2jmj h LYS 71 CO 0.27 0.00 -0.18 -0.44 -0.57 0.00 0.00 179.45 178.53 2jmj h ASP 72 N 0.00 0.00 -0.69 0.86 3.32 -1.94 -3.19 116.42 114.79 2jmj h ASP 72 Ca 0.33 -0.21 0.26 0.00 0.02 0.00 0.00 57.03 57.42 2jmj h ASP 72 Cb 1.68 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 41.10 2jmj h ASP 72 CO -0.00 0.70 0.25 0.00 -1.72 0.00 0.00 179.24 178.47 2jmj h LYS 74 N 0.00 -0.24 -0.08 0.00 1.63 -1.51 -2.24 116.57 114.13 2jmj h LYS 74 Ca 0.53 0.02 -0.07 0.00 -0.85 0.00 0.00 60.65 60.28 2jmj h LYS 74 Cb 1.32 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.99 2jmj h LYS 74 CO -0.57 0.14 -0.25 0.93 -3.45 0.00 0.00 179.45 176.25 2jmj h GLU 75 N -0.69 0.15 -0.48 1.90 4.39 0.18 -2.39 114.58 117.62 2jmj h GLU 75 Ca -0.03 -0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.55 2jmj h GLU 75 Cb 0.49 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.10 2jmj h GLU 75 CO 0.04 0.39 -0.02 0.82 -1.16 0.00 0.00 179.01 179.08 2jmj h ILE 76 N 0.13 1.25 -0.31 3.13 2.04 0.32 1.24 117.51 125.32 2jmj h ILE 76 Ca 0.02 -1.05 -0.02 0.00 1.00 0.00 0.00 64.86 64.81 2jmj h ILE 76 Cb 0.52 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 2jmj h ILE 76 CO 0.04 0.37 0.11 0.00 0.00 0.00 0.00 178.15 178.67 2jmj h ALA 77 N 1.22 0.40 -0.06 1.87 0.00 -0.90 -2.92 119.26 118.87 2jmj h ALA 77 Ca 0.14 -0.14 -0.21 0.00 0.00 0.00 0.00 54.91 54.71 2jmj h ALA 77 Cb 0.49 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2jmj h ALA 77 CO 0.02 0.01 -0.83 -0.97 0.00 0.00 0.00 179.25 177.49 2jmj h ASN 78 N 0.35 0.58 0.00 0.00 -0.00 -1.22 -3.46 115.58 111.82 2jmj h ASN 78 Ca 0.10 -0.42 0.00 0.00 -0.00 0.00 0.00 56.30 55.99 2jmj h ASN 78 Cb 0.21 -0.17 0.00 0.00 -0.00 0.00 0.00 38.32 38.35 2jmj h ASN 78 CO -0.01 1.19 0.00 1.67 -0.00 0.00 0.00 177.43 180.28 2jmj n GLN 79 N -3.82 0.00 -0.14 6.67 7.27 0.43 -2.78 117.38 125.00 2jmj n GLN 79 Ca -0.06 0.00 0.06 0.00 0.07 0.00 0.00 57.00 57.07 2jmj n GLN 79 Cb 0.77 0.00 0.37 0.00 2.41 0.00 0.00 30.24 33.79 2jmj n GLN 79 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2jmj h ARG 80 N 0.00 0.69 0.00 3.69 3.08 -1.89 -3.48 114.38 116.47 2jmj h ARG 80 Ca 0.00 -0.04 0.18 0.00 0.07 0.00 0.00 59.98 60.19 2jmj h ARG 80 Cb 0.00 -0.16 -0.05 0.00 0.08 0.00 0.00 29.97 29.85 2jmj h ARG 80 CO 0.00 0.46 -0.24 0.45 -1.07 0.00 0.00 179.97 179.57 2jmj n SER 81 N -4.47 -6.34 -3.68 7.04 2.88 -1.12 -4.89 113.62 103.05 2jmj n SER 81 Ca 0.09 0.71 -0.22 0.00 -1.33 0.00 0.00 58.87 58.12 2jmj n SER 81 Cb 0.19 -2.04 0.03 0.00 -0.75 0.00 0.00 64.21 61.64 2jmj n SER 81 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2jmj n LYS 82 N -2.78 -4.47 -0.07 -1.46 3.00 -1.26 -5.13 118.16 105.99 2jmj n LYS 82 Ca 0.00 0.62 0.00 0.00 -0.00 0.00 0.00 58.31 58.93 2jmj n LYS 82 Cb 0.30 -5.12 0.00 0.00 0.00 0.00 0.00 35.03 30.21 2jmj n LYS 82 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27