#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1irh n PHE 2 N 0.00 0.00 -0.06 -0.32 3.01 -1.26 -5.12 117.46 113.71 1irh n PHE 2 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.40 1irh n PHE 2 Cb 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.45 1irh n PHE 2 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 1irh n HIS 3 N 0.00 0.00 0.00 1.38 8.25 -1.26 -5.09 115.22 118.50 1irh n HIS 3 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1irh n HIS 3 Cb 0.00 -0.36 0.00 0.00 1.12 0.00 0.00 29.99 30.75 1irh n HIS 3 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1irh n GLY 4 N 1.56 -1.76 3.71 -1.41 0.00 -1.26 -5.10 105.19 100.93 1irh n GLY 4 Ca -0.10 0.51 -0.43 0.00 0.00 0.00 0.00 46.02 46.01 1irh n GLY 4 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1irh n PRO 5 N -1.03 2.73 -1.14 1.61 -0.01 -1.26 -4.88 135.00 131.03 1irh n PRO 5 Ca 0.00 0.99 -0.18 0.00 -0.01 0.00 0.00 63.50 64.30 1irh n PRO 5 Cb 0.00 -2.84 0.21 0.00 -0.01 0.00 0.00 33.50 30.86 1irh n PRO 5 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 175.50 175.94 1irh n SER 6 N 4.36 4.05 -0.44 2.55 2.88 -1.26 -4.17 113.62 121.60 1irh n SER 6 Ca 0.17 -3.45 0.01 0.00 -1.33 0.00 0.00 58.87 54.28 1irh n SER 6 Cb 0.35 -0.80 0.02 0.00 -0.75 0.00 0.00 64.21 63.03 1irh n SER 6 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1irh n TRP 7 N -0.81 0.00 -0.10 0.66 4.27 -1.26 -4.81 117.44 115.40 1irh n TRP 7 Ca 0.53 -0.14 -0.14 0.00 -3.89 0.00 0.00 57.50 53.85 1irh n TRP 7 Cb 1.56 -0.06 -0.09 0.00 -1.36 0.00 0.00 31.31 31.36 1irh n TRP 7 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1irh n LEU 9 N -3.14 2.71 -4.86 0.00 4.77 -1.26 -4.81 117.00 110.41 1irh n LEU 9 Ca -0.36 -1.37 -0.32 0.00 -0.03 0.00 0.00 56.01 53.93 1irh n LEU 9 Cb 0.87 -0.44 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 1irh n LEU 9 CO 0.19 0.46 0.28 0.28 -1.33 0.00 0.00 177.39 177.26 1irh s THR 10 N -1.71 4.85 0.60 -5.08 -1.32 -1.26 -4.98 115.64 106.74 1irh s THR 10 Ca 0.26 0.65 -0.19 0.00 -1.21 0.00 0.00 61.69 61.20 1irh s THR 10 Cb 0.17 -3.63 -0.03 0.00 -1.51 0.00 0.00 72.50 67.50 1irh s THR 10 CO 0.12 -0.06 1.27 -2.16 -2.21 0.00 0.00 174.62 171.57 1irh s PRO 11 N -2.76 2.88 0.09 7.08 0.05 -1.26 -4.96 135.00 136.13 1irh s PRO 11 Ca 0.48 1.99 -0.30 0.00 0.05 0.00 0.00 61.00 63.22 1irh s PRO 11 Cb -0.11 -1.98 -0.05 0.00 0.05 0.00 0.00 34.50 32.40 1irh s PRO 11 CO 0.20 -1.32 0.95 0.00 0.05 0.00 0.00 177.00 176.88 1irh s ALA 12 N -1.46 3.24 -0.33 8.56 0.00 -1.26 -5.00 121.76 125.51 1irh s ALA 12 Ca 0.78 0.56 -0.29 0.00 0.00 0.00 0.00 51.96 53.00 1irh s ALA 12 Cb -0.35 -3.27 0.02 0.00 0.00 0.00 0.00 23.12 19.51 1irh s ALA 12 CO 0.38 -0.05 1.08 0.34 0.00 0.00 0.00 175.76 177.52 1irh s ASP 13 N 0.14 6.91 -0.05 0.00 -1.08 -1.26 -4.86 116.67 116.46 1irh s ASP 13 Ca 0.47 1.01 0.09 0.00 -0.52 0.00 0.00 52.55 53.60 1irh s ASP 13 Cb -0.23 -2.54 0.15 0.00 -1.46 0.00 0.00 42.92 38.84 1irh s ASP 13 CO 0.29 -0.91 1.07 -2.11 0.52 0.00 0.00 175.17 174.03 1irh n ARG 14 N 6.95 0.51 -3.82 4.34 1.85 -1.26 -4.19 116.66 121.04 1irh n ARG 14 Ca 0.12 -1.72 -0.30 0.00 -1.00 0.00 0.00 57.85 54.95 1irh n ARG 14 Cb 0.47 -0.85 -0.15 0.00 -1.05 0.00 0.00 32.46 30.88 1irh n ARG 14 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1irh s GLY 15 N -1.82 1.47 0.00 2.89 0.00 -1.26 -4.40 107.32 104.20 1irh s GLY 15 Ca 0.15 -2.13 0.00 0.00 0.00 0.00 0.00 44.72 42.74 1irh s GLY 15 CO -0.01 1.39 0.00 1.04 0.00 0.00 0.00 173.10 175.52 1irh n LEU 16 N 4.40 0.00 0.00 0.66 4.77 -1.26 -5.03 117.00 120.53 1irh n LEU 16 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1irh n LEU 16 Cb 0.40 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1irh n LEU 16 CO 0.17 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.23 1irh n ARG 18 N 0.00 0.00 -3.65 0.00 3.00 -1.26 0.09 116.66 114.84 1irh n ARG 18 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.85 57.82 1irh n ARG 18 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.39 1irh n ARG 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1irh s ALA 19 N -0.69 -2.30 -1.10 5.13 0.00 -1.26 -4.86 121.76 116.68 1irh s ALA 19 Ca 0.00 1.87 -0.20 0.00 0.00 0.00 0.00 51.96 53.63 1irh s ALA 19 Cb 0.00 -1.76 0.08 0.00 0.00 0.00 0.00 23.12 21.44 1irh s ALA 19 CO 0.00 -0.22 1.47 -0.80 0.00 0.00 0.00 175.76 176.22 1irh s ASN 20 N 0.51 6.68 0.00 0.00 0.01 -1.26 -3.53 114.94 117.35 1irh s ASN 20 Ca 0.00 -2.00 0.00 0.00 -0.71 0.00 0.00 52.86 50.15 1irh s ASN 20 Cb -0.04 -2.52 0.00 0.00 0.41 0.00 0.00 41.25 39.10 1irh s ASN 20 CO -0.12 -1.25 0.00 -0.62 -1.51 0.00 0.00 177.10 173.59 1irh n GLU 21 N 7.98 3.45 -3.25 -0.60 -0.58 -0.67 -4.66 120.64 122.32 1irh n GLU 21 Ca 0.36 0.00 -0.23 0.00 -0.42 0.00 0.00 57.16 56.88 1irh n GLU 21 Cb 0.48 0.00 -0.07 0.00 -0.57 0.00 0.00 31.44 31.28 1irh n GLU 21 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1irh n ASN 22 N 0.00 -0.92 -4.92 1.62 5.03 -1.25 -3.79 115.26 111.03 1irh n ASN 22 Ca 0.00 -2.53 -0.27 0.00 0.87 0.00 0.00 54.58 52.66 1irh n ASN 22 Cb 0.00 -0.14 -0.01 0.00 -1.02 0.00 0.00 39.78 38.61 1irh n ASN 22 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1irh s ARG 23 N 0.02 3.56 -0.39 3.52 1.81 0.03 -4.73 118.95 122.76 1irh s ARG 23 Ca 0.33 0.02 -0.21 0.00 -1.72 0.00 0.00 55.73 54.15 1irh s ARG 23 Cb 0.06 -2.51 0.01 0.00 -0.45 0.00 0.00 34.95 32.06 1irh s ARG 23 CO -0.17 -0.01 0.64 -0.06 -0.68 0.00 0.00 175.30 175.02 1irh s PHE 24 N -2.47 3.11 -0.24 -0.53 0.40 0.45 0.88 117.98 119.58 1irh s PHE 24 Ca 0.45 0.17 -0.19 0.00 -0.60 0.00 0.00 56.93 56.75 1irh s PHE 24 Cb -0.10 -3.24 -0.03 0.00 0.51 0.00 0.00 43.02 40.17 1irh s PHE 24 CO 0.39 -0.74 0.56 -0.47 0.70 0.00 0.00 175.22 175.66 1irh s TYR 25 N 2.76 3.31 -0.42 0.36 5.04 -0.29 -3.35 117.35 124.76 1irh s TYR 25 Ca 0.24 0.75 -0.28 0.00 -2.44 0.00 0.00 57.07 55.33 1irh s TYR 25 Cb -0.14 -2.75 -0.02 0.00 0.35 0.00 0.00 41.96 39.40 1irh s TYR 25 CO 0.17 -0.24 1.80 -0.47 -1.34 0.00 0.00 175.55 175.47 1irh s TYR 26 N 2.16 1.79 -0.09 4.97 5.04 -1.26 -0.54 117.35 129.43 1irh s TYR 26 Ca 0.24 0.70 -0.28 0.00 -2.44 0.00 0.00 57.07 55.29 1irh s TYR 26 Cb -0.16 -4.12 -0.02 0.00 0.35 0.00 0.00 41.96 38.02 1irh s TYR 26 CO 0.09 -2.68 0.93 -0.80 -1.34 0.00 0.00 175.55 171.75 1irh s ASN 27 N 6.65 7.18 0.00 4.32 -0.87 -1.06 -4.88 114.94 126.29 1irh s ASN 27 Ca 0.75 1.45 0.30 0.00 -1.57 0.00 0.00 52.86 53.79 1irh s ASN 27 Cb -0.19 -2.52 1.57 0.00 -0.02 0.00 0.00 41.25 40.09 1irh s ASN 27 CO 0.30 -0.35 2.04 -1.20 -2.57 0.00 0.00 177.10 175.31 1irh n SER 28 N 4.65 0.47 -0.12 -1.22 7.64 -1.26 -1.82 113.62 121.96 1irh n SER 28 Ca 0.06 -1.04 -0.25 0.00 1.01 0.00 0.00 58.87 58.66 1irh n SER 28 Cb 0.50 -0.02 -0.09 0.00 -1.01 0.00 0.00 64.21 63.58 1irh n SER 28 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1irh n VAL 29 N -0.69 1.52 0.05 0.44 0.31 -1.26 -4.63 118.33 114.07 1irh n VAL 29 Ca 0.21 -0.22 -0.17 0.00 -0.01 0.00 0.00 64.34 64.14 1irh n VAL 29 Cb 0.20 -1.99 -0.14 0.00 -0.91 0.00 0.00 33.84 31.00 1irh n VAL 29 CO 0.00 0.00 0.00 0.16 -1.32 0.00 0.00 176.83 175.67 1irh h ILE 30 N -1.00 1.00 0.00 2.52 3.07 -2.00 -3.49 117.51 117.62 1irh h ILE 30 Ca -0.52 -2.67 0.00 0.00 1.55 0.00 0.00 64.86 63.22 1irh h ILE 30 Cb 1.43 2.68 0.00 0.00 -0.27 0.00 0.00 36.82 40.66 1irh h ILE 30 CO -0.31 0.80 0.00 0.61 -1.05 0.00 0.00 178.15 178.20 1irh n GLY 31 N 1.74 3.16 3.88 0.16 0.00 -0.75 -5.07 105.19 108.30 1irh n GLY 31 Ca -0.20 -0.99 -0.30 0.00 0.00 0.00 0.00 46.02 44.52 1irh n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1irh s LYS 32 N 0.00 3.09 -0.31 1.61 0.00 -1.26 -4.54 119.74 118.32 1irh s LYS 32 Ca 0.00 0.50 -0.23 0.00 0.00 0.00 0.00 55.97 56.25 1irh s LYS 32 Cb 0.00 -2.06 -0.00 0.00 0.00 0.00 0.00 37.83 35.77 1irh s LYS 32 CO 0.00 -0.86 0.75 0.00 0.00 0.00 0.00 175.35 175.24 1irh s ARG 34 N 2.88 4.23 0.09 0.00 1.81 0.30 -4.64 118.95 123.62 1irh s ARG 34 Ca 0.31 0.63 -0.31 0.00 -1.72 0.00 0.00 55.73 54.64 1irh s ARG 34 Cb -0.14 -3.57 -0.09 0.00 -0.45 0.00 0.00 34.95 30.70 1irh s ARG 34 CO 0.13 -0.21 1.78 -2.14 -0.68 0.00 0.00 175.30 174.18 1irh s PRO 35 N 1.81 4.16 0.45 3.54 0.02 -1.26 -1.13 135.00 142.59 1irh s PRO 35 Ca 0.29 2.50 0.03 0.00 0.02 0.00 0.00 61.00 63.84 1irh s PRO 35 Cb -0.16 -3.68 -0.04 0.00 0.02 0.00 0.00 34.50 30.64 1irh s PRO 35 CO 0.11 -0.82 0.03 -0.59 -0.33 0.00 0.00 177.00 175.39 1irh s PHE 36 N 2.98 2.03 -0.57 6.54 -0.71 0.25 -4.89 117.98 123.61 1irh s PHE 36 Ca 0.79 -0.93 -0.19 0.00 -1.04 0.00 0.00 56.93 55.56 1irh s PHE 36 Cb -0.43 -1.56 0.09 0.00 -1.21 0.00 0.00 43.02 39.91 1irh s PHE 36 CO 0.35 0.19 0.68 0.15 -1.34 0.00 0.00 175.22 175.26 1irh s LYS 37 N -3.81 3.06 -0.17 1.99 1.02 -1.26 -0.79 119.74 119.78 1irh s LYS 37 Ca 0.18 -1.24 -0.20 0.00 0.02 0.00 0.00 55.97 54.73 1irh s LYS 37 Cb 0.04 -4.23 -0.03 0.00 -0.52 0.00 0.00 37.83 33.09 1irh s LYS 37 CO 0.09 -1.47 0.60 -0.47 -0.92 0.00 0.00 175.35 173.18 1irh s TYR 38 N 2.66 3.42 1.13 3.18 5.04 -1.25 -4.58 117.35 126.95 1irh s TYR 38 Ca 0.12 0.94 -0.19 0.00 -2.44 0.00 0.00 57.07 55.50 1irh s TYR 38 Cb -0.23 -2.75 0.27 0.00 0.35 0.00 0.00 41.96 39.60 1irh s TYR 38 CO 0.07 -0.08 1.22 -1.12 -1.34 0.00 0.00 175.55 174.29 1irh s SER 39 N 1.06 1.57 0.00 4.32 0.01 -1.25 -1.67 113.70 117.75 1irh s SER 39 Ca 0.29 0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.92 1irh s SER 39 Cb -0.16 -0.45 0.00 0.00 0.21 0.00 0.00 66.02 65.63 1irh s SER 39 CO 0.11 -3.70 0.00 0.61 0.41 0.00 0.00 173.24 170.68 1irh n GLY 40 N -2.19 0.39 6.01 3.44 0.00 0.11 -4.82 105.19 108.14 1irh n GLY 40 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1irh n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1irh n GLY 42 N 0.00 3.75 0.00 0.00 0.00 -1.26 -5.11 105.19 102.57 1irh n GLY 42 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1irh n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1irh n GLY 43 N 0.95 -1.29 0.67 -0.02 0.00 -1.26 -4.98 105.19 99.26 1irh n GLY 43 Ca 0.00 -2.09 -0.05 0.00 0.00 0.00 0.00 46.02 43.89 1irh n GLY 43 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1irh n ASN 44 N 0.00 0.11 -1.59 1.61 4.13 -1.26 -5.02 115.26 113.23 1irh n ASN 44 Ca 0.00 -1.13 -0.11 0.00 1.68 0.00 0.00 54.58 55.02 1irh n ASN 44 Cb 0.00 -0.15 0.09 0.00 -1.54 0.00 0.00 39.78 38.18 1irh n ASN 44 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1irh n GLU 45 N -1.42 2.60 -1.35 3.52 -0.58 -1.26 -4.73 120.64 117.43 1irh n GLU 45 Ca 0.03 -3.72 -0.05 0.00 -0.42 0.00 0.00 57.16 53.00 1irh n GLU 45 Cb 0.10 -1.89 0.11 0.00 -0.57 0.00 0.00 31.44 29.19 1irh n GLU 45 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 1irh n ASN 46 N -0.77 2.68 -4.55 1.62 6.94 -1.26 -5.01 115.26 114.91 1irh n ASN 46 Ca 0.31 -3.48 -0.43 0.00 -0.02 0.00 0.00 54.58 50.96 1irh n ASN 46 Cb 0.87 -0.44 -0.06 0.00 -2.36 0.00 0.00 39.78 37.79 1irh n ASN 46 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 1irh s ASN 47 N -3.26 6.40 -0.08 0.53 0.02 -1.26 -4.84 114.94 112.44 1irh s ASN 47 Ca 0.41 -0.07 -0.21 0.00 -1.02 0.00 0.00 52.86 51.97 1irh s ASN 47 Cb 0.38 -2.35 -0.04 0.00 0.02 0.00 0.00 41.25 39.27 1irh s ASN 47 CO -0.04 -0.76 0.60 -0.36 0.02 0.00 0.00 177.10 176.56 1irh s PHE 48 N 2.94 3.56 -1.91 2.20 0.08 -1.21 -4.93 117.98 118.70 1irh s PHE 48 Ca 0.26 1.10 0.22 0.00 0.12 0.00 0.00 56.93 58.63 1irh s PHE 48 Cb -0.14 -2.69 0.64 0.00 -0.57 0.00 0.00 43.02 40.27 1irh s PHE 48 CO 0.19 0.14 1.53 -2.37 -0.10 0.00 0.00 175.22 174.61 1irh n THR 49 N 3.67 1.02 -3.62 0.64 5.66 -1.26 -0.41 114.28 119.98 1irh n THR 49 Ca -0.04 -1.00 -0.13 0.00 -3.05 0.00 0.00 64.05 59.83 1irh n THR 49 Cb 0.51 0.49 -0.06 0.00 -1.55 0.00 0.00 70.33 69.73 1irh n THR 49 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1irh s SER 50 N -1.00 -0.35 0.20 1.09 0.15 -1.26 -4.93 113.70 107.60 1irh s SER 50 Ca 0.48 0.04 0.04 0.00 0.70 0.00 0.00 55.95 57.21 1irh s SER 50 Cb 0.25 0.46 0.12 0.00 -1.71 0.00 0.00 66.02 65.15 1irh s SER 50 CO 0.33 -0.71 1.47 0.50 1.20 0.00 0.00 173.24 176.02 1irh h LYS 51 N 2.83 0.20 -0.05 5.44 3.64 -1.99 -2.03 116.57 124.62 1irh h LYS 51 Ca -0.31 -0.18 -0.11 0.00 -1.27 0.00 0.00 60.65 58.78 1irh h LYS 51 Cb 1.22 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.06 1irh h LYS 51 CO 0.43 0.85 -0.49 1.96 -2.27 0.00 0.00 179.45 179.93 1irh h GLN 52 N 0.13 0.12 0.11 1.90 1.08 -1.99 -2.61 115.11 113.85 1irh h GLN 52 Ca -0.02 -0.06 -0.28 0.00 -1.45 0.00 0.00 58.65 56.83 1irh h GLN 52 Cb 1.31 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.74 1irh h GLN 52 CO 0.11 0.58 -1.32 1.49 -0.95 0.00 0.00 178.83 178.75 1irh h GLU 53 N 0.10 0.24 -0.58 1.46 4.81 -1.96 -1.87 114.58 116.78 1irh h GLU 53 Ca 0.00 -0.41 -0.08 0.00 -0.13 0.00 0.00 59.36 58.75 1irh h GLU 53 Cb 0.90 0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.41 1irh h GLU 53 CO 0.07 1.16 0.05 0.00 -0.73 0.00 0.00 179.01 179.56 1irh h LEU 55 N 0.89 0.06 -2.70 0.00 3.38 -1.56 -2.65 115.31 112.73 1irh h LEU 55 Ca 0.17 -0.81 0.00 0.00 0.09 0.00 0.00 57.88 57.34 1irh h LEU 55 Cb 0.45 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 1irh h LEU 55 CO 0.02 1.25 0.04 -0.09 0.09 0.00 0.00 178.44 179.75 1irh h ARG 56 N -0.90 0.00 0.00 1.13 2.43 -1.39 0.19 114.38 115.84 1irh h ARG 56 Ca -0.16 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 58.83 1irh h ARG 56 Cb 1.21 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.73 1irh h ARG 56 CO -0.06 0.00 -1.30 0.00 -1.51 0.00 0.00 179.97 177.10 1irh n ALA 57 N -2.16 0.80 -0.07 2.80 0.00 -0.72 -3.94 120.51 117.22 1irh n ALA 57 Ca -0.03 -0.66 -0.11 0.00 0.00 0.00 0.00 53.44 52.65 1irh n ALA 57 Cb 0.12 -0.16 -0.08 0.00 0.00 0.00 0.00 19.45 19.34 1irh n ALA 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1irh h LYS 59 N -1.00 0.63 -6.24 0.00 1.63 -0.79 -3.46 116.57 107.34 1irh h LYS 59 Ca -0.08 -0.04 -0.45 0.00 -0.85 0.00 0.00 60.65 59.24 1irh h LYS 59 Cb 0.73 -0.14 0.02 0.00 -0.60 0.00 0.00 32.23 32.24 1irh h LYS 59 CO -0.05 0.42 -0.85 1.17 -3.45 0.00 0.00 179.45 176.69 1irh n LYS 60 N -4.47 -4.24 0.00 1.90 4.81 -0.47 -5.00 118.16 110.69 1irh n LYS 60 Ca 0.07 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 58.05 1irh n LYS 60 Cb 0.17 -4.92 0.00 0.00 0.02 0.00 0.00 35.03 30.30 1irh n LYS 60 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98