#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 1.30 -0.02 3.69 2.02 -1.26 -4.98 118.70 119.45 2jmj s GLU 25 Ca 0.00 -0.17 0.01 0.00 0.02 0.00 0.00 54.97 54.83 2jmj s GLU 25 Cb 0.00 -1.42 0.02 0.00 0.10 0.00 0.00 34.13 32.82 2jmj s GLU 25 CO 0.00 -0.27 -0.01 -2.00 0.02 0.00 0.00 175.26 173.00 2jmj s GLU 26 N 1.74 0.28 0.46 1.61 2.12 -1.26 -5.02 118.70 118.63 2jmj s GLU 26 Ca 0.04 0.00 -0.21 0.00 0.36 0.00 0.00 54.97 55.16 2jmj s GLU 26 Cb -0.13 -0.38 -0.09 0.00 0.26 0.00 0.00 34.13 33.79 2jmj s GLU 26 CO -0.07 -0.06 1.04 0.08 -0.54 0.00 0.00 175.26 175.71 2jmj s VAL 27 N 0.59 3.77 0.00 3.70 1.01 -1.26 -2.00 120.40 126.21 2jmj s VAL 27 Ca -0.06 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.09 2jmj s VAL 27 Cb -0.09 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.78 2jmj s VAL 27 CO -0.01 -0.18 0.00 -1.22 0.00 0.00 0.00 175.10 173.69 2jmj n TYR 28 N -0.73 0.00 -0.76 5.22 4.01 -1.12 -4.90 117.16 118.88 2jmj n TYR 28 Ca 0.08 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.50 2jmj n TYR 28 Cb 0.52 0.00 0.14 0.00 -0.31 0.00 0.00 39.34 39.68 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 -3.79 0.00 0.47 0.00 3.72 -1.26 -1.70 117.46 114.89 2jmj n PHE 30 Ca 0.07 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.59 2jmj n PHE 30 Cb 0.54 0.00 0.47 0.00 -0.94 0.00 0.00 39.48 39.55 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 -2.22 -1.38 -4.28 0.00 5.12 -0.69 -4.97 116.66 108.25 2jmj n ARG 32 Ca 0.03 0.61 -0.29 0.00 -1.93 0.00 0.00 57.85 56.27 2jmj n ARG 32 Cb 0.28 -4.76 -0.04 0.00 -1.16 0.00 0.00 32.46 26.78 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 -2.28 4.40 0.43 0.55 6.03 -1.26 -4.94 114.94 117.88 2jmj s ASN 33 Ca 0.00 -1.41 -0.09 0.00 -1.03 0.00 0.00 52.86 50.33 2jmj s ASN 33 Cb 0.00 0.40 -0.05 0.00 -3.03 0.00 0.00 41.25 38.57 2jmj s ASN 33 CO 0.00 -0.96 0.78 -0.69 -2.03 0.00 0.00 177.10 174.20 2jmj s VAL 34 N -2.81 4.83 -0.41 3.54 1.01 -1.26 -2.78 120.40 122.52 2jmj s VAL 34 Ca 0.22 0.48 -0.28 0.00 0.00 0.00 0.00 61.98 62.41 2jmj s VAL 34 Cb -0.00 -3.78 -0.07 0.00 0.00 0.00 0.00 36.38 32.53 2jmj s VAL 34 CO 0.13 -0.65 2.35 -0.24 0.00 0.00 0.00 175.10 176.70 2jmj n SER 35 N -1.66 2.54 0.00 3.32 2.88 -0.85 -4.88 113.62 114.97 2jmj n SER 35 Ca 0.02 -0.18 0.00 0.00 -1.33 0.00 0.00 58.87 57.38 2jmj n SER 35 Cb 0.54 -1.53 0.00 0.00 -0.75 0.00 0.00 64.21 62.48 2jmj n SER 35 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2jmj n TYR 36 N 13.90 0.00 0.00 0.66 4.01 -1.26 -4.92 117.16 129.54 2jmj n TYR 36 Ca 0.36 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.10 2jmj n TYR 36 Cb 0.47 -0.36 0.00 0.00 -0.31 0.00 0.00 39.34 39.14 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 -0.06 -0.70 3.61 2.72 0.00 -1.26 -5.08 105.19 104.43 2jmj n GLY 37 Ca 0.00 0.29 -0.43 0.00 0.00 0.00 0.00 46.02 45.88 2jmj n GLY 37 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2jmj s PRO 38 N 0.00 3.33 0.14 1.61 0.02 -1.26 -4.95 135.00 133.88 2jmj s PRO 38 Ca 0.00 2.13 -0.00 0.00 0.02 0.00 0.00 61.00 63.15 2jmj s PRO 38 Cb 0.00 -4.33 -0.04 0.00 0.02 0.00 0.00 34.50 30.15 2jmj s PRO 38 CO 0.00 -1.88 0.04 -1.64 -0.33 0.00 0.00 177.00 173.19 2jmj s MET 39 N 5.98 0.96 0.05 5.54 -1.94 -1.26 -0.06 119.30 128.57 2jmj s MET 39 Ca 0.98 -1.46 -0.10 0.00 -1.71 0.00 0.00 55.69 53.40 2jmj s MET 39 Cb -0.35 0.12 0.00 0.00 2.01 0.00 0.00 34.83 36.62 2jmj s MET 39 CO 0.36 -0.23 0.21 0.54 -0.01 0.00 0.00 175.02 175.90 2jmj s VAL 40 N -3.96 0.11 -0.12 -6.03 0.11 0.19 -4.92 120.40 105.78 2jmj s VAL 40 Ca 0.24 -0.93 -0.07 0.00 -2.93 0.00 0.00 61.98 58.29 2jmj s VAL 40 Cb 0.07 -1.03 -0.04 0.00 -1.53 0.00 0.00 36.38 33.85 2jmj s VAL 40 CO 0.02 -0.52 0.12 0.00 -3.33 0.00 0.00 175.10 171.40 2jmj s ALA 41 N -2.93 3.79 -0.15 1.54 0.00 -1.26 0.12 121.76 122.87 2jmj s ALA 41 Ca -0.02 -0.67 -0.33 0.00 0.00 0.00 0.00 51.96 50.94 2jmj s ALA 41 Cb 0.01 -1.93 -0.10 0.00 0.00 0.00 0.00 23.12 21.10 2jmj s ALA 41 CO -0.06 0.57 2.02 0.00 0.00 0.00 0.00 175.76 178.29 2jmj n ASP 43 N 8.33 7.29 -4.08 0.00 9.92 -1.24 -4.81 116.55 131.96 2jmj n ASP 43 Ca 0.27 -3.81 -0.30 0.00 -0.53 0.00 0.00 54.79 50.43 2jmj n ASP 43 Cb 0.32 -0.95 -0.17 0.00 -0.64 0.00 0.00 41.12 39.69 2jmj n ASP 43 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 2jmj s ASN 44 N -1.71 2.64 0.63 -2.24 3.04 -1.26 -4.97 114.94 111.06 2jmj s ASN 44 Ca 0.57 -0.48 0.10 0.00 0.04 0.00 0.00 52.86 53.10 2jmj s ASN 44 Cb 0.47 -1.19 0.35 0.00 -1.54 0.00 0.00 41.25 39.34 2jmj s ASN 44 CO -0.20 0.02 1.09 -2.65 -3.04 0.00 0.00 177.10 172.32 2jmj n PRO 45 N 4.27 0.02 0.00 0.43 -0.02 -1.26 -2.49 135.00 135.95 2jmj n PRO 45 Ca -0.19 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 2jmj n PRO 45 Cb 0.51 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 2jmj n PRO 45 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jmj n ALA 46 N -1.77 0.25 -1.15 3.55 0.00 -1.26 -5.04 120.51 115.09 2jmj n ALA 46 Ca 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2jmj n ALA 46 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.64 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 2.01 0.01 -5.07 0.00 0.11 -1.96 -3.41 132.00 123.69 2jmj h PRO 48 Ca 0.00 -0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.51 2jmj h PRO 48 Cb 0.21 -0.00 -0.13 0.00 0.11 0.00 0.00 31.00 31.19 2jmj h PRO 48 CO 0.00 0.00 -0.51 -0.06 -0.21 0.00 0.00 178.00 177.23 2jmj s PHE 49 N -4.93 1.80 -0.19 0.65 0.08 -1.26 -5.08 117.98 109.05 2jmj s PHE 49 Ca -0.05 -1.21 0.24 0.00 0.12 0.00 0.00 56.93 56.02 2jmj s PHE 49 Cb 0.27 -1.28 0.49 0.00 -0.57 0.00 0.00 43.02 41.92 2jmj s PHE 49 CO 0.88 -0.17 1.13 0.39 -0.10 0.00 0.00 175.22 177.35 2jmj n GLU 50 N -1.03 1.25 -3.56 0.44 1.02 -1.26 -4.25 120.64 113.25 2jmj n GLU 50 Ca -0.10 -3.09 -0.00 0.00 -0.02 0.00 0.00 57.16 53.95 2jmj n GLU 50 Cb 0.65 -1.16 -0.04 0.00 -0.02 0.00 0.00 31.44 30.87 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 -2.75 -1.11 0.03 -0.32 0.23 -1.26 -3.86 118.94 109.90 2jmj s TRP 51 Ca 0.29 1.93 -0.05 0.00 -2.03 0.00 0.00 56.10 56.23 2jmj s TRP 51 Cb 0.34 0.67 -0.01 0.00 0.03 0.00 0.00 33.47 34.50 2jmj s TRP 51 CO -0.08 -0.55 0.09 -0.06 0.96 0.00 0.00 176.95 177.31 2jmj s PHE 52 N 2.74 0.17 0.20 -1.98 0.40 0.33 -2.74 117.98 117.11 2jmj s PHE 52 Ca -0.05 -0.42 0.00 0.00 -0.60 0.00 0.00 56.93 55.86 2jmj s PHE 52 Cb -0.10 -0.13 -0.04 0.00 0.51 0.00 0.00 43.02 43.26 2jmj s PHE 52 CO -0.18 -0.32 0.38 -1.01 0.70 0.00 0.00 175.22 174.78 2jmj s HIS 53 N -2.16 3.48 0.21 0.36 3.76 -1.26 0.54 115.29 120.21 2jmj s HIS 53 Ca -0.09 0.27 0.01 0.00 -0.15 0.00 0.00 55.06 55.10 2jmj s HIS 53 Cb -0.04 -1.80 0.16 0.00 1.11 0.00 0.00 32.58 32.02 2jmj s HIS 53 CO -0.03 0.39 1.51 1.88 -0.85 0.00 0.00 174.74 177.65 2jmj h TYR 54 N 1.87 0.47 0.00 1.40 -1.99 -0.82 0.41 116.97 118.31 2jmj h TYR 54 Ca -0.49 -0.18 0.00 0.00 2.00 0.00 0.00 58.73 60.06 2jmj h TYR 54 Cb 1.20 -0.08 0.00 0.00 2.00 0.00 0.00 36.73 39.85 2jmj h TYR 54 CO 0.54 0.89 0.00 0.78 -0.00 0.00 0.00 178.16 180.36 2jmj h GLY 55 N 1.32 0.00 0.00 3.88 0.00 -1.90 -3.11 103.07 103.26 2jmj h GLY 55 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 2jmj h GLY 55 CO 0.10 0.00 -0.07 0.00 0.00 0.00 0.00 176.54 176.57 2jmj n VAL 57 N -4.60 0.00 -3.09 0.00 0.24 0.14 -4.88 118.33 106.14 2jmj n VAL 57 Ca -0.11 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.21 2jmj n VAL 57 Cb 0.49 0.00 -0.00 0.00 -1.47 0.00 0.00 33.84 32.85 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 -1.32 0.13 7.63 0.00 -1.22 -4.94 107.32 107.60 2jmj s GLY 58 Ca 0.00 0.70 -0.25 0.00 0.00 0.00 0.00 44.72 45.17 2jmj s GLY 58 CO 0.00 3.85 1.06 0.48 0.00 0.00 0.00 173.10 178.49 2jmj s LEU 59 N 2.07 -0.08 -0.32 0.66 0.05 -1.26 -5.10 118.68 114.71 2jmj s LEU 59 Ca 0.16 -0.46 -0.01 0.00 0.05 0.00 0.00 54.13 53.87 2jmj s LEU 59 Cb -0.03 1.96 0.10 0.00 -2.05 0.00 0.00 46.19 46.18 2jmj s LEU 59 CO -0.12 -0.81 0.11 -0.54 -0.55 0.00 0.00 176.35 174.44 2jmj s LYS 60 N -2.66 0.68 0.30 1.48 1.02 -1.26 -4.88 119.74 114.42 2jmj s LYS 60 Ca 0.17 -1.07 0.00 0.00 0.02 0.00 0.00 55.97 55.09 2jmj s LYS 60 Cb -0.01 -1.88 0.00 0.00 -0.52 0.00 0.00 37.83 35.42 2jmj s LYS 60 CO 0.02 -1.01 0.00 1.04 -0.92 0.00 0.00 175.35 174.48 2jmj n GLN 61 N 4.79 -4.97 -1.62 1.68 6.02 -1.26 -4.76 117.38 117.26 2jmj n GLN 61 Ca -0.01 3.58 -0.56 0.00 -0.01 0.00 0.00 57.00 60.00 2jmj n GLN 61 Cb 0.41 -3.89 -0.07 0.00 1.02 0.00 0.00 30.24 27.72 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 0.90 -1.16 -1.31 -1.58 0.00 -1.26 -4.93 120.51 111.17 2jmj n ALA 62 Ca 0.00 0.49 -0.30 0.00 0.00 0.00 0.00 53.44 53.63 2jmj n ALA 62 Cb 0.00 -2.06 0.12 0.00 0.00 0.00 0.00 19.45 17.51 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 1.42 1.52 0.39 0.00 0.04 -1.26 -4.91 135.00 132.20 2jmj s PRO 63 Ca 0.91 0.77 0.15 0.00 0.04 0.00 0.00 61.00 62.87 2jmj s PRO 63 Cb -1.07 -1.84 1.00 0.00 0.04 0.00 0.00 34.50 32.63 2jmj s PRO 63 CO 0.56 -2.05 1.84 -0.22 0.04 0.00 0.00 177.00 177.17 2jmj h LYS 64 N -1.40 0.48 0.00 4.56 3.64 -2.01 -3.38 116.57 118.46 2jmj h LYS 64 Ca -0.49 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 2jmj h LYS 64 Cb 1.28 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2jmj h LYS 64 CO 0.56 0.32 0.00 0.41 -2.27 0.00 0.00 179.45 178.47 2jmj n GLY 65 N -1.48 0.87 2.93 5.01 0.00 -1.26 -5.09 105.19 106.18 2jmj n GLY 65 Ca 0.20 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.11 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 0.09 0.18 0.26 1.61 1.02 -1.26 -5.14 119.74 116.49 2jmj s LYS 66 Ca 0.00 -0.34 0.06 0.00 0.02 0.00 0.00 55.97 55.72 2jmj s LYS 66 Cb 0.00 0.04 -0.03 0.00 -0.52 0.00 0.00 37.83 37.32 2jmj s LYS 66 CO 0.00 -0.02 0.28 -0.46 -0.92 0.00 0.00 175.35 174.23 2jmj s TRP 67 N -0.78 3.24 -0.24 3.18 -0.11 -1.26 -4.93 118.94 118.04 2jmj s TRP 67 Ca -0.08 -0.09 -0.04 0.00 1.22 0.00 0.00 56.10 57.10 2jmj s TRP 67 Cb -0.05 -1.52 -0.00 0.00 -1.50 0.00 0.00 33.47 30.39 2jmj s TRP 67 CO -0.01 0.44 -0.02 0.71 -4.62 0.00 0.00 176.95 173.46 2jmj s TYR 68 N -2.08 3.01 0.11 5.86 2.02 -1.26 -3.70 117.35 121.30 2jmj s TYR 68 Ca 0.34 -0.98 0.08 0.00 -0.37 0.00 0.00 57.07 56.14 2jmj s TYR 68 Cb -0.08 -2.13 0.36 0.00 -0.40 0.00 0.00 41.96 39.70 2jmj s TYR 68 CO 0.27 -0.56 0.36 0.00 -1.57 0.00 0.00 175.55 174.05 2jmj s SER 70 N -4.42 -0.27 0.57 0.00 0.15 -1.26 -4.80 113.70 103.67 2jmj s SER 70 Ca -0.02 -0.16 0.34 0.00 0.70 0.00 0.00 55.95 56.82 2jmj s SER 70 Cb 0.07 0.41 1.43 0.00 -1.71 0.00 0.00 66.02 66.22 2jmj s SER 70 CO 0.19 -0.70 1.71 0.11 1.20 0.00 0.00 173.24 175.75 2jmj h LYS 71 N 2.00 0.00 0.00 5.44 1.57 -2.00 0.19 116.57 123.77 2jmj h LYS 71 Ca -0.23 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.50 2jmj h LYS 71 Cb 1.23 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 2jmj h LYS 71 CO 0.28 0.00 -0.34 0.38 -0.57 0.00 0.00 179.45 179.20 2jmj h ASP 72 N 0.00 0.00 -0.68 0.86 2.03 -1.94 -3.17 116.42 113.52 2jmj h ASP 72 Ca 0.49 -0.52 0.16 0.00 -0.73 0.00 0.00 57.03 56.43 2jmj h ASP 72 Cb 2.25 0.00 -0.13 0.00 -0.83 0.00 0.00 39.33 40.62 2jmj h ASP 72 CO -0.01 0.95 -0.08 0.00 -1.03 0.00 0.00 179.24 179.08 2jmj h LYS 74 N 0.00 -0.16 -0.70 0.00 3.64 -1.57 -1.88 116.57 115.90 2jmj h LYS 74 Ca 0.37 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.79 2jmj h LYS 74 Cb 0.67 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.48 2jmj h LYS 74 CO -0.67 0.16 0.43 1.49 -2.27 0.00 0.00 179.45 178.60 2jmj h GLU 75 N -0.49 0.82 -0.65 1.90 4.81 0.19 -1.28 114.58 119.88 2jmj h GLU 75 Ca -0.02 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.17 2jmj h GLU 75 Cb 0.39 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 2jmj h GLU 75 CO 0.03 0.54 0.43 0.82 -0.73 0.00 0.00 179.01 180.10 2jmj h ILE 76 N 0.84 1.16 -0.34 2.32 2.04 0.29 0.80 117.51 124.63 2jmj h ILE 76 Ca 0.28 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 2jmj h ILE 76 Cb 0.04 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 2jmj h ILE 76 CO -0.12 0.16 0.18 0.00 0.00 0.00 0.00 178.15 178.38 2jmj h ALA 77 N 1.59 0.44 -0.33 1.87 0.00 -0.40 -2.72 119.26 119.72 2jmj h ALA 77 Ca 0.24 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 2jmj h ALA 77 Cb -0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2jmj h ALA 77 CO -0.05 -0.02 -0.24 -0.91 0.00 0.00 0.00 179.25 178.02 2jmj h ASN 78 N 0.43 0.78 0.00 0.00 2.35 -0.63 -3.45 115.58 115.05 2jmj h ASN 78 Ca 0.12 -0.44 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 2jmj h ASN 78 Cb 0.08 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.23 2jmj h ASN 78 CO -0.02 1.05 0.00 1.67 -1.65 0.00 0.00 177.43 178.49 2jmj n GLN 79 N -4.27 0.00 -1.62 0.81 -0.06 0.27 -4.67 117.38 107.84 2jmj n GLN 79 Ca -0.03 0.00 -0.52 0.00 -2.00 0.00 0.00 57.00 54.46 2jmj n GLN 79 Cb 0.45 0.00 -0.06 0.00 -4.06 0.00 0.00 30.24 26.57 2jmj n GLN 79 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 2jmj n ARG 80 N 0.00 1.33 -4.71 3.69 0.63 -1.26 -4.97 116.66 111.37 2jmj n ARG 80 Ca 0.00 0.48 -0.30 0.00 -0.92 0.00 0.00 57.85 57.11 2jmj n ARG 80 Cb 0.00 -2.15 -0.14 0.00 0.45 0.00 0.00 32.46 30.62 2jmj n ARG 80 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 2jmj s SER 81 N 0.93 3.44 -0.23 6.15 1.04 -1.26 -5.04 113.70 118.72 2jmj s SER 81 Ca 0.85 -0.56 -0.04 0.00 0.48 0.00 0.00 55.95 56.68 2jmj s SER 81 Cb -0.92 -0.40 -0.18 0.00 0.10 0.00 0.00 66.02 64.63 2jmj s SER 81 CO 0.47 0.24 -0.10 1.17 0.98 0.00 0.00 173.24 176.00 2jmj n LYS 82 N 1.50 0.66 0.00 4.02 4.81 -1.26 -5.29 118.16 122.60 2jmj n LYS 82 Ca -0.17 0.22 0.00 0.00 -0.87 0.00 0.00 58.31 57.49 2jmj n LYS 82 Cb 0.52 -1.57 0.00 0.00 0.02 0.00 0.00 35.03 34.00 2jmj n LYS 82 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44