#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmi s GLU 25 N 0.00 3.26 -0.25 3.69 2.02 -1.26 -4.90 118.70 121.26 2jmi s GLU 25 Ca 0.00 -0.46 -0.01 0.00 0.02 0.00 0.00 54.97 54.52 2jmi s GLU 25 Cb 0.00 -4.10 0.07 0.00 0.10 0.00 0.00 34.13 30.21 2jmi s GLU 25 CO 0.00 -1.53 0.03 -1.21 0.02 0.00 0.00 175.26 172.56 2jmi s GLU 26 N 3.84 1.01 0.67 1.61 2.02 -1.26 -5.05 118.70 121.54 2jmi s GLU 26 Ca 0.27 -0.85 -0.17 0.00 0.02 0.00 0.00 54.97 54.23 2jmi s GLU 26 Cb -0.14 -2.28 -0.02 0.00 0.10 0.00 0.00 34.13 31.79 2jmi s GLU 26 CO 0.16 -0.74 0.96 0.28 0.02 0.00 0.00 175.26 175.94 2jmi n VAL 27 N 4.84 3.33 0.00 2.63 0.31 -1.26 -4.05 118.33 124.12 2jmi n VAL 27 Ca -0.07 -0.44 0.00 0.00 -0.01 0.00 0.00 64.34 63.82 2jmi n VAL 27 Cb 0.44 -1.12 0.00 0.00 -0.91 0.00 0.00 33.84 32.25 2jmi n VAL 27 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2jmi n TYR 28 N -2.15 0.00 -1.43 3.52 4.01 -0.66 -4.94 117.16 115.51 2jmi n TYR 28 Ca 0.13 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.48 2jmi n TYR 28 Cb 0.49 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.54 2jmi n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2jmi n PHE 30 N -1.28 0.00 0.99 0.00 1.16 -1.26 -0.71 117.46 116.36 2jmi n PHE 30 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.69 2jmi n PHE 30 Cb 0.44 -0.25 0.00 0.00 -1.61 0.00 0.00 39.48 38.06 2jmi n PHE 30 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2jmi n ARG 32 N 0.04 -0.76 -4.14 0.00 1.85 0.12 -4.93 116.66 108.84 2jmi n ARG 32 Ca 0.00 -0.07 -0.10 0.00 -1.00 0.00 0.00 57.85 56.69 2jmi n ARG 32 Cb 0.27 -1.59 -0.10 0.00 -1.05 0.00 0.00 32.46 30.00 2jmi n ARG 32 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2jmi s ASN 33 N -3.97 0.28 0.70 2.89 6.03 -1.26 -4.96 114.94 114.66 2jmi s ASN 33 Ca 0.15 -1.19 -0.09 0.00 -1.03 0.00 0.00 52.86 50.69 2jmi s ASN 33 Cb -0.08 0.31 0.04 0.00 -3.03 0.00 0.00 41.25 38.49 2jmi s ASN 33 CO 0.58 -0.75 1.05 -0.69 -2.03 0.00 0.00 177.10 175.27 2jmi s VAL 34 N -4.05 2.87 -0.68 3.54 1.01 -1.26 -1.65 120.40 120.18 2jmi s VAL 34 Ca 0.24 0.06 -0.26 0.00 0.00 0.00 0.00 61.98 62.02 2jmi s VAL 34 Cb 0.07 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 33.20 2jmi s VAL 34 CO 0.02 -0.28 1.72 -0.55 0.00 0.00 0.00 175.10 176.00 2jmi s SER 35 N -4.44 5.51 0.05 3.32 0.15 -1.26 -4.86 113.70 112.18 2jmi s SER 35 Ca 0.59 -0.01 -0.24 0.00 0.70 0.00 0.00 55.95 56.99 2jmi s SER 35 Cb -0.11 -2.54 -0.17 0.00 -1.71 0.00 0.00 66.02 61.49 2jmi s SER 35 CO 0.48 -2.25 1.56 1.88 1.20 0.00 0.00 173.24 176.10 2jmi h TYR 36 N 13.28 -0.03 0.00 3.44 0.05 -1.98 -3.48 116.97 128.24 2jmi h TYR 36 Ca -0.22 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.56 2jmi h TYR 36 Cb 1.12 0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.87 2jmi h TYR 36 CO 1.09 0.15 0.00 0.41 -1.05 0.00 0.00 178.16 178.76 2jmi n GLY 37 N -0.63 0.50 3.39 3.88 0.00 -1.26 -5.10 105.19 105.97 2jmi n GLY 37 Ca -0.08 0.44 -0.51 0.00 0.00 0.00 0.00 46.02 45.87 2jmi n GLY 37 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jmi n PRO 38 N 0.00 0.44 -4.66 1.61 -0.02 -1.26 -4.92 135.00 126.19 2jmi n PRO 38 Ca 0.00 0.10 -0.30 0.00 -2.02 0.00 0.00 63.50 61.28 2jmi n PRO 38 Cb 0.00 -1.97 -0.09 0.00 -0.02 0.00 0.00 33.50 31.42 2jmi n PRO 38 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2jmi s MET 39 N 6.87 2.04 0.05 -0.52 -1.94 -1.26 -2.16 119.30 122.38 2jmi s MET 39 Ca 1.18 -2.24 -0.27 0.00 -1.71 0.00 0.00 55.69 52.65 2jmi s MET 39 Cb -1.13 -1.41 0.08 0.00 2.01 0.00 0.00 34.83 34.38 2jmi s MET 39 CO 0.54 -0.25 0.72 0.54 -0.01 0.00 0.00 175.02 176.55 2jmi s VAL 40 N -2.89 0.00 -0.09 -6.03 0.11 -0.72 -4.79 120.40 105.98 2jmi s VAL 40 Ca 0.20 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.24 2jmi s VAL 40 Cb 0.05 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.87 2jmi s VAL 40 CO 0.10 0.00 -0.05 0.00 -3.33 0.00 0.00 175.10 171.82 2jmi s ALA 41 N -2.77 3.02 -0.39 1.54 0.00 -1.26 -0.21 121.76 121.69 2jmi s ALA 41 Ca -0.01 -0.86 -0.31 0.00 0.00 0.00 0.00 51.96 50.78 2jmi s ALA 41 Cb -0.01 -1.35 -0.09 0.00 0.00 0.00 0.00 23.12 21.68 2jmi s ALA 41 CO -0.05 0.48 2.29 0.00 0.00 0.00 0.00 175.76 178.47 2jmi n ASP 43 N 11.89 1.75 -4.28 0.00 8.00 -1.26 -4.73 116.55 127.91 2jmi n ASP 43 Ca 0.39 -2.08 -0.35 0.00 0.71 0.00 0.00 54.79 53.46 2jmi n ASP 43 Cb 0.36 -0.52 -0.14 0.00 -0.02 0.00 0.00 41.12 40.80 2jmi n ASP 43 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2jmi s ASN 44 N 0.16 4.14 0.55 -2.24 3.04 -1.26 -4.99 114.94 114.33 2jmi s ASN 44 Ca 0.04 -0.44 0.48 0.00 0.04 0.00 0.00 52.86 52.97 2jmi s ASN 44 Cb 0.03 -1.70 1.70 0.00 -1.54 0.00 0.00 41.25 39.74 2jmi s ASN 44 CO 0.01 -0.02 1.60 -0.65 -3.04 0.00 0.00 177.10 175.00 2jmi h PRO 45 N 8.09 0.00 0.00 0.43 0.11 -1.91 -1.95 132.00 136.77 2jmi h PRO 45 Ca -0.42 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2jmi h PRO 45 Cb 1.16 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2jmi h PRO 45 CO 0.61 0.00 -0.22 0.00 -0.21 0.00 0.00 178.00 178.18 2jmi h ALA 46 N 1.10 0.00 0.00 -0.75 0.00 -1.94 -3.48 119.26 114.19 2jmi h ALA 46 Ca 0.90 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.56 2jmi h ALA 46 Cb 3.54 0.22 0.00 0.00 0.00 0.00 0.00 17.79 21.55 2jmi h ALA 46 CO -0.05 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.42 2jmi h PRO 48 N 0.65 0.03 0.00 0.00 0.11 -1.93 -3.42 132.00 127.44 2jmi h PRO 48 Ca 0.00 -0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.53 2jmi h PRO 48 Cb 0.00 -0.01 -0.12 0.00 0.11 0.00 0.00 31.00 30.98 2jmi h PRO 48 CO 0.00 0.02 -0.47 1.19 -0.21 0.00 0.00 178.00 178.53 2jmi n PHE 49 N -4.17 0.37 -2.27 0.65 3.72 -1.26 -5.08 117.46 109.42 2jmi n PHE 49 Ca 0.35 -2.60 0.04 0.00 -0.05 0.00 0.00 57.45 55.19 2jmi n PHE 49 Cb 1.59 -0.08 0.06 0.00 -0.94 0.00 0.00 39.48 40.11 2jmi n PHE 49 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2jmi n GLU 50 N -1.00 0.38 -3.65 -1.08 1.02 -1.26 -4.30 120.64 110.75 2jmi n GLU 50 Ca -0.09 -2.29 -0.05 0.00 -0.02 0.00 0.00 57.16 54.71 2jmi n GLU 50 Cb 0.62 -0.39 -0.06 0.00 -0.02 0.00 0.00 31.44 31.59 2jmi n GLU 50 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2jmi s TRP 51 N -0.77 -1.16 -0.14 -0.32 0.52 -1.26 -4.01 118.94 111.79 2jmi s TRP 51 Ca 0.34 2.19 -0.10 0.00 0.02 0.00 0.00 56.10 58.55 2jmi s TRP 51 Cb 0.38 0.69 0.05 0.00 -1.15 0.00 0.00 33.47 33.44 2jmi s TRP 51 CO -0.14 -0.58 0.37 -0.06 0.02 0.00 0.00 176.95 176.55 2jmi s PHE 52 N 2.15 -0.46 0.61 -1.98 0.40 0.70 -2.86 117.98 116.54 2jmi s PHE 52 Ca -0.08 1.06 -0.10 0.00 -0.60 0.00 0.00 56.93 57.21 2jmi s PHE 52 Cb -0.08 0.17 -0.03 0.00 0.51 0.00 0.00 43.02 43.59 2jmi s PHE 52 CO -0.19 -0.25 1.00 -1.01 0.70 0.00 0.00 175.22 175.46 2jmi s HIS 53 N 0.78 3.56 -0.32 0.36 3.76 -1.26 -1.75 115.29 120.42 2jmi s HIS 53 Ca -0.05 1.16 0.26 0.00 -0.15 0.00 0.00 55.06 56.29 2jmi s HIS 53 Cb -0.06 -2.71 0.70 0.00 1.11 0.00 0.00 32.58 31.62 2jmi s HIS 53 CO -0.06 -0.71 1.74 1.88 -0.85 0.00 0.00 174.74 176.74 2jmi h TYR 54 N -0.29 0.00 -0.02 1.40 0.05 -1.79 -2.51 116.97 113.82 2jmi h TYR 54 Ca -0.45 0.00 -0.20 0.00 0.05 0.00 0.00 58.73 58.14 2jmi h TYR 54 Cb 1.20 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.94 2jmi h TYR 54 CO 0.62 0.00 -0.84 0.78 -1.05 0.00 0.00 178.16 177.67 2jmi h GLY 55 N 3.43 0.32 0.59 3.88 0.00 -1.92 -3.26 103.07 106.11 2jmi h GLY 55 Ca 0.00 -0.53 -0.01 0.00 0.00 0.00 0.00 47.33 46.79 2jmi h GLY 55 CO 0.00 0.47 -0.09 0.00 0.00 0.00 0.00 176.54 176.93 2jmi n VAL 57 N -5.02 0.00 -3.44 0.00 0.24 -0.96 -5.01 118.33 104.13 2jmi n VAL 57 Ca -0.09 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.04 2jmi n VAL 57 Cb 0.25 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.50 2jmi n VAL 57 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2jmi s GLY 58 N 0.00 -0.08 0.00 7.63 0.00 -1.26 -4.92 107.32 108.70 2jmi s GLY 58 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 44.72 44.80 2jmi s GLY 58 CO 0.00 2.39 0.00 1.47 0.00 0.00 0.00 173.10 176.96 2jmi n LEU 59 N 5.32 0.00 -4.05 0.66 -0.00 -1.26 -5.07 117.00 112.60 2jmi n LEU 59 Ca -0.04 0.00 -0.34 0.00 -0.00 0.00 0.00 56.01 55.63 2jmi n LEU 59 Cb 0.48 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.78 2jmi n LEU 59 CO 0.05 0.00 -0.12 -0.54 -0.00 0.00 0.00 177.39 176.78 2jmi s LYS 60 N -2.00 2.11 0.10 1.47 1.02 -1.26 -4.92 119.74 116.26 2jmi s LYS 60 Ca 0.00 -2.31 0.00 0.00 0.02 0.00 0.00 55.97 53.68 2jmi s LYS 60 Cb 0.00 -3.50 0.00 0.00 -0.52 0.00 0.00 37.83 33.81 2jmi s LYS 60 CO 0.00 -1.10 0.00 1.04 -0.92 0.00 0.00 175.35 174.37 2jmi n GLN 61 N 3.73 -2.12 -1.38 1.68 1.13 -1.26 -4.71 117.38 114.45 2jmi n GLN 61 Ca 0.04 1.73 -0.50 0.00 -1.94 0.00 0.00 57.00 56.33 2jmi n GLN 61 Cb 0.38 -1.63 -0.13 0.00 0.11 0.00 0.00 30.24 28.96 2jmi n GLN 61 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jmi n ALA 62 N 0.50 0.29 -1.61 -1.58 0.00 -1.26 -4.80 120.51 112.05 2jmi n ALA 62 Ca 0.00 -0.07 -0.47 0.00 0.00 0.00 0.00 53.44 52.91 2jmi n ALA 62 Cb 0.00 -2.21 -0.03 0.00 0.00 0.00 0.00 19.45 17.21 2jmi n ALA 62 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2jmi n PRO 63 N 8.03 1.51 0.00 0.00 -0.04 -1.26 -4.53 135.00 138.71 2jmi n PRO 63 Ca 0.60 0.54 0.00 0.00 -0.04 0.00 0.00 63.50 64.59 2jmi n PRO 63 Cb 0.01 -2.08 0.00 0.00 -0.04 0.00 0.00 33.50 31.39 2jmi n PRO 63 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2jmi n LYS 64 N 1.71 0.00 0.00 0.54 5.02 -1.26 -2.95 118.16 121.22 2jmi n LYS 64 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 2jmi n LYS 64 Cb 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.29 2jmi n LYS 64 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jmi n GLY 65 N 0.00 -0.11 3.24 0.72 0.00 -1.26 -5.04 105.19 102.73 2jmi n GLY 65 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2jmi n GLY 65 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jmi n LYS 66 N -1.70 0.50 -4.28 1.61 5.02 -1.15 -4.93 118.16 113.23 2jmi n LYS 66 Ca 0.00 -3.35 -0.19 0.00 -2.02 0.00 0.00 58.31 52.75 2jmi n LYS 66 Cb 0.00 2.23 -0.13 0.00 -0.02 0.00 0.00 35.03 37.11 2jmi n LYS 66 CO 0.00 0.00 0.00 -0.46 -0.52 0.00 0.00 177.40 176.42 2jmi s TRP 67 N -3.19 1.15 -0.12 2.13 -0.11 -1.26 -4.31 118.94 113.24 2jmi s TRP 67 Ca 0.29 -0.38 -0.29 0.00 1.22 0.00 0.00 56.10 56.94 2jmi s TRP 67 Cb 0.01 -0.68 -0.05 0.00 -1.50 0.00 0.00 33.47 31.26 2jmi s TRP 67 CO 0.20 0.03 1.75 0.71 -4.62 0.00 0.00 176.95 175.03 2jmi s TYR 68 N -0.97 1.82 0.08 5.86 2.02 -1.26 -4.12 117.35 120.78 2jmi s TYR 68 Ca -0.00 0.25 0.05 0.00 -0.37 0.00 0.00 57.07 57.00 2jmi s TYR 68 Cb -0.08 -3.99 0.30 0.00 -0.40 0.00 0.00 41.96 37.79 2jmi s TYR 68 CO 0.01 -3.82 0.35 0.00 -1.57 0.00 0.00 175.55 170.53 2jmi s SER 70 N -4.89 -0.14 0.42 0.00 0.01 -1.26 -4.81 113.70 103.03 2jmi s SER 70 Ca -0.02 -0.59 0.24 0.00 1.31 0.00 0.00 55.95 56.89 2jmi s SER 70 Cb 0.08 0.60 1.25 0.00 0.21 0.00 0.00 66.02 68.16 2jmi s SER 70 CO 0.17 -1.13 1.72 0.11 0.41 0.00 0.00 173.24 174.53 2jmi h LYS 71 N 2.00 0.25 0.00 12.44 1.57 -1.98 -0.51 116.57 130.34 2jmi h LYS 71 Ca -0.24 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.49 2jmi h LYS 71 Cb 1.24 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.48 2jmi h LYS 71 CO 0.28 0.16 -0.25 0.38 -0.57 0.00 0.00 179.45 179.46 2jmi h ASP 72 N 0.25 0.00 -0.71 0.86 2.03 -1.95 -2.99 116.42 113.91 2jmi h ASP 72 Ca 0.67 -0.52 0.28 0.00 -0.73 0.00 0.00 57.03 56.74 2jmi h ASP 72 Cb 1.95 0.00 -0.13 0.00 -0.83 0.00 0.00 39.33 40.32 2jmi h ASP 72 CO -0.32 0.90 0.32 0.00 -1.03 0.00 0.00 179.24 179.12 2jmi h LYS 74 N 0.00 -0.32 -1.01 0.00 3.64 -1.38 -2.97 116.57 114.53 2jmi h LYS 74 Ca 0.58 0.02 0.26 0.00 -1.27 0.00 0.00 60.65 60.23 2jmi h LYS 74 Cb 1.48 0.07 -0.13 0.00 -0.41 0.00 0.00 32.23 33.25 2jmi h LYS 74 CO -0.57 -0.22 0.59 1.49 -2.27 0.00 0.00 179.45 178.48 2jmi h GLU 75 N -1.05 0.53 0.15 1.90 4.81 0.19 0.49 114.58 121.60 2jmi h GLU 75 Ca -0.03 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 2jmi h GLU 75 Cb 0.26 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.52 2jmi h GLU 75 CO 0.06 0.35 -0.08 0.82 -0.73 0.00 0.00 179.01 179.43 2jmi h ILE 76 N 0.55 0.84 0.00 2.32 2.04 0.11 0.25 117.51 123.61 2jmi h ILE 76 Ca 0.66 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 66.46 2jmi h ILE 76 Cb 1.29 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 2jmi h ILE 76 CO -0.49 0.00 -0.27 0.00 0.00 0.00 0.00 178.15 177.38 2jmi h ALA 77 N 0.64 1.22 -0.04 1.87 0.00 -0.73 -2.47 119.26 119.74 2jmi h ALA 77 Ca -0.02 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.51 2jmi h ALA 77 Cb 0.17 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2jmi h ALA 77 CO 0.03 0.34 -0.57 -0.91 0.00 0.00 0.00 179.25 178.14 2jmi h ASN 78 N 0.00 0.14 -0.80 0.00 -0.26 0.51 -2.98 115.58 112.19 2jmi h ASN 78 Ca -0.00 -0.08 0.11 0.00 -0.56 0.00 0.00 56.30 55.78 2jmi h ASN 78 Cb 0.62 -0.04 -0.06 0.00 -1.06 0.00 0.00 38.32 37.78 2jmi h ASN 78 CO 0.04 0.68 0.52 -0.61 -1.06 0.00 0.00 177.43 177.00 2jmi h GLN 79 N 0.09 0.64 -2.06 0.81 4.15 -0.47 -3.40 115.11 114.88 2jmi h GLN 79 Ca -0.00 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.38 2jmi h GLN 79 Cb 1.03 -0.14 -0.24 0.00 0.21 0.00 0.00 27.48 28.34 2jmi h GLN 79 CO 0.08 0.42 -0.26 0.50 -1.93 0.00 0.00 178.83 177.64 2jmi s ARG 80 N -5.62 0.47 0.09 1.69 6.06 -1.13 -5.13 118.95 115.38 2jmi s ARG 80 Ca -0.09 1.18 0.02 0.00 -2.50 0.00 0.00 55.73 54.33 2jmi s ARG 80 Cb 0.21 0.54 -0.04 0.00 0.06 0.00 0.00 34.95 35.72 2jmi s ARG 80 CO 0.78 -0.30 -0.06 -1.54 -2.50 0.00 0.00 175.30 171.67 2jmi s SER 81 N 2.77 1.04 0.12 -2.12 1.04 -1.23 -4.76 113.70 110.56 2jmi s SER 81 Ca 0.00 -0.95 -0.12 0.00 0.48 0.00 0.00 55.95 55.36 2jmi s SER 81 Cb -0.13 0.10 -0.06 0.00 0.10 0.00 0.00 66.02 66.03 2jmi s SER 81 CO -0.17 -0.45 0.48 -1.59 0.98 0.00 0.00 173.24 172.50 2jmi s LYS 82 N -3.57 3.88 0.00 4.02 -2.85 -1.26 -5.15 119.74 114.80 2jmi s LYS 82 Ca 0.09 0.34 0.00 0.00 -1.00 0.00 0.00 55.97 55.40 2jmi s LYS 82 Cb 0.04 -2.96 0.00 0.00 -2.06 0.00 0.00 37.83 32.85 2jmi s LYS 82 CO -0.05 0.51 0.00 0.43 0.10 0.00 0.00 175.35 176.35