#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ikm s LEU 5 N 0.00 0.98 0.00 -4.62 0.05 -1.26 -5.15 118.68 108.68 1ikm s LEU 5 Ca 0.00 0.05 -0.21 0.00 0.05 0.00 0.00 54.13 54.02 1ikm s LEU 5 Cb 0.00 -0.06 0.32 0.00 -2.05 0.00 0.00 46.19 44.40 1ikm s LEU 5 CO 0.00 -0.14 0.89 -2.11 -0.55 0.00 0.00 176.35 174.44 1ikm n ARG 6 N 4.29 -3.95 -2.18 1.48 -4.01 -1.26 -4.67 116.66 106.35 1ikm n ARG 6 Ca -0.26 -1.46 -0.39 0.00 -1.04 0.00 0.00 57.85 54.70 1ikm n ARG 6 Cb 0.50 -1.65 -0.03 0.00 -3.04 0.00 0.00 32.46 28.24 1ikm n ARG 6 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 1ikm h GLN 8 N 13.51 0.00 -4.20 0.00 4.20 -1.97 -3.38 115.11 123.28 1ikm h GLN 8 Ca -0.25 0.00 -0.71 0.00 0.06 0.00 0.00 58.65 57.75 1ikm h GLN 8 Cb 1.13 0.00 -0.33 0.00 0.30 0.00 0.00 27.48 28.58 1ikm h GLN 8 CO 1.24 0.00 -0.43 0.00 -0.67 0.00 0.00 178.83 178.97 1ikm h ILE 10 N 5.99 1.37 -3.32 0.00 2.04 -2.02 -3.42 117.51 118.15 1ikm h ILE 10 Ca -0.12 -1.84 -0.64 0.00 1.00 0.00 0.00 64.86 63.26 1ikm h ILE 10 Cb 1.03 1.94 -0.33 0.00 -0.74 0.00 0.00 36.82 38.72 1ikm h ILE 10 CO 0.76 0.54 -0.86 -0.54 0.00 0.00 0.00 178.15 178.04 1ikm s LYS 11 N -3.85 2.74 0.02 2.37 1.02 -1.26 -5.13 119.74 115.65 1ikm s LYS 11 Ca -0.03 -0.77 0.00 0.00 0.02 0.00 0.00 55.97 55.19 1ikm s LYS 11 Cb 0.13 -2.14 0.00 0.00 -0.52 0.00 0.00 37.83 35.30 1ikm s LYS 11 CO 0.77 0.10 0.02 0.25 -0.92 0.00 0.00 175.35 175.57 1ikm n THR 12 N 3.73 0.00 -3.61 2.17 -2.24 -1.26 -4.71 114.28 108.35 1ikm n THR 12 Ca -0.20 -0.06 -0.38 0.00 -2.27 0.00 0.00 64.05 61.14 1ikm n THR 12 Cb 0.52 -0.86 -0.11 0.00 -2.10 0.00 0.00 70.33 67.78 1ikm n THR 12 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1ikm s TYR 13 N 0.64 3.20 -0.12 4.78 5.04 0.29 -4.84 117.35 126.34 1ikm s TYR 13 Ca 0.02 -0.06 0.16 0.00 -2.44 0.00 0.00 57.07 54.75 1ikm s TYR 13 Cb -0.00 -2.37 -0.23 0.00 0.35 0.00 0.00 41.96 39.71 1ikm s TYR 13 CO 0.01 -0.24 0.45 0.43 -1.34 0.00 0.00 175.55 174.86 1ikm n SER 14 N 5.04 0.46 -4.74 4.32 7.64 -1.26 -2.55 113.62 122.53 1ikm n SER 14 Ca -0.14 0.21 -0.41 0.00 1.01 0.00 0.00 58.87 59.55 1ikm n SER 14 Cb 0.51 0.56 -0.05 0.00 -1.01 0.00 0.00 64.21 64.22 1ikm n SER 14 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1ikm s LYS 15 N -2.69 4.74 0.56 1.43 -0.14 -1.26 -5.04 119.74 117.34 1ikm s LYS 15 Ca -0.07 1.52 -0.08 0.00 -1.36 0.00 0.00 55.97 55.98 1ikm s LYS 15 Cb 0.08 -3.32 -0.03 0.00 -1.68 0.00 0.00 37.83 32.87 1ikm s LYS 15 CO 0.83 0.30 0.92 -1.25 -0.76 0.00 0.00 175.35 175.39 1ikm s PRO 16 N -0.52 3.47 0.04 -1.68 0.04 -1.26 -5.05 135.00 130.05 1ikm s PRO 16 Ca 0.45 0.43 -0.27 0.00 0.04 0.00 0.00 61.00 61.65 1ikm s PRO 16 Cb -0.25 -2.22 0.08 0.00 0.04 0.00 0.00 34.50 32.15 1ikm s PRO 16 CO 0.32 -0.45 0.72 -0.59 0.04 0.00 0.00 177.00 177.04 1ikm s PHE 17 N -2.98 -0.51 0.35 0.56 -0.71 -1.26 -5.15 117.98 108.28 1ikm s PHE 17 Ca 0.52 0.52 -0.28 0.00 -1.04 0.00 0.00 56.93 56.65 1ikm s PHE 17 Cb -0.11 0.51 -0.10 0.00 -1.21 0.00 0.00 43.02 42.11 1ikm s PHE 17 CO 0.49 -0.68 1.36 -1.58 -1.34 0.00 0.00 175.22 173.48 1ikm s HIS 18 N -2.75 2.88 -0.02 3.49 5.65 -1.26 -4.97 115.29 118.30 1ikm s HIS 18 Ca -0.01 1.34 -0.22 0.00 0.25 0.00 0.00 55.06 56.42 1ikm s HIS 18 Cb -0.01 -3.79 -0.24 0.00 -1.18 0.00 0.00 32.58 27.37 1ikm s HIS 18 CO -0.05 -2.24 1.06 -1.00 -0.65 0.00 0.00 174.74 171.86 1ikm h PRO 19 N 3.19 0.29 -0.33 2.88 0.13 -1.98 -3.32 132.00 132.86 1ikm h PRO 19 Ca -0.50 -0.32 0.10 0.00 -0.87 0.00 0.00 66.00 64.41 1ikm h PRO 19 Cb 1.23 0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.44 1ikm h PRO 19 CO 0.65 1.02 0.53 -0.22 -0.23 0.00 0.00 178.00 179.75 1ikm h LYS 20 N -0.31 0.00 -0.70 0.86 1.63 -1.95 0.29 116.57 116.39 1ikm h LYS 20 Ca -0.05 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 1ikm h LYS 20 Cb 1.17 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.77 1ikm h LYS 20 CO 0.09 0.00 0.39 0.74 -3.45 0.00 0.00 179.45 177.22 1ikm h PHE 21 N 0.00 0.94 -2.64 1.91 0.04 -1.98 -3.41 116.94 111.80 1ikm h PHE 21 Ca 0.16 -0.01 -0.53 0.00 2.80 0.00 0.00 57.97 60.38 1ikm h PHE 21 Cb 1.21 -0.31 0.03 0.00 2.20 0.00 0.00 35.95 39.09 1ikm h PHE 21 CO 0.00 0.65 1.03 0.42 -0.60 0.00 0.00 178.31 179.81 1ikm s ILE 22 N -5.66 2.81 -0.22 -0.55 1.01 0.10 -2.53 121.20 116.16 1ikm s ILE 22 Ca -0.11 0.32 0.21 0.00 0.00 0.00 0.00 60.65 61.07 1ikm s ILE 22 Cb 0.17 -3.20 -0.01 0.00 0.01 0.00 0.00 42.46 39.43 1ikm s ILE 22 CO 0.79 0.00 1.04 0.11 0.00 0.00 0.00 174.94 176.88 1ikm h LYS 23 N 8.30 0.00 -4.14 2.79 1.57 -1.40 -3.47 116.57 120.22 1ikm h LYS 23 Ca -0.44 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.11 1ikm h LYS 23 Cb 1.21 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 33.42 1ikm h LYS 23 CO 0.94 0.06 -0.26 -1.21 -0.57 0.00 0.00 179.45 178.41 1ikm s GLU 24 N -3.27 1.72 0.00 3.15 2.02 -1.24 -4.99 118.70 116.10 1ikm s GLU 24 Ca -0.00 -1.65 0.00 0.00 0.02 0.00 0.00 54.97 53.34 1ikm s GLU 24 Cb 0.09 0.42 0.00 0.00 0.10 0.00 0.00 34.13 34.74 1ikm s GLU 24 CO 0.79 -0.69 0.00 -2.13 0.02 0.00 0.00 175.26 173.24 1ikm n ARG 26 N -0.49 0.00 -4.03 1.61 0.63 0.85 -1.38 116.66 113.86 1ikm n ARG 26 Ca 0.01 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.65 1ikm n ARG 26 Cb 0.62 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.48 1ikm n ARG 26 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 1ikm s VAL 27 N 0.00 4.73 -0.05 5.15 -7.23 -1.26 -1.30 120.40 120.44 1ikm s VAL 27 Ca 0.00 -0.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.40 1ikm s VAL 27 Cb 0.00 -3.33 -0.03 0.00 0.56 0.00 0.00 36.38 33.57 1ikm s VAL 27 CO 0.00 0.05 -0.02 -0.63 -0.31 0.00 0.00 175.10 174.19 1ikm s ILE 28 N -1.53 4.04 1.20 -0.62 1.01 0.05 -4.93 121.20 120.42 1ikm s ILE 28 Ca 0.31 -0.45 -0.20 0.00 0.00 0.00 0.00 60.65 60.31 1ikm s ILE 28 Cb -0.12 -2.72 0.29 0.00 0.01 0.00 0.00 42.46 39.92 1ikm s ILE 28 CO 0.24 0.52 1.17 -1.61 0.00 0.00 0.00 174.94 175.26 1ikm s GLU 29 N -1.09 -1.19 0.35 2.79 2.02 -1.26 -3.29 118.70 117.03 1ikm s GLU 29 Ca 0.15 -0.28 0.08 0.00 0.02 0.00 0.00 54.97 54.94 1ikm s GLU 29 Cb -0.11 -1.62 -0.03 0.00 0.10 0.00 0.00 34.13 32.47 1ikm s GLU 29 CO 0.05 -3.66 0.24 -1.54 0.02 0.00 0.00 175.26 170.37 1ikm s SER 30 N -4.21 4.97 0.00 -0.19 1.04 -1.26 -4.59 113.70 109.46 1ikm s SER 30 Ca 0.73 -0.67 0.00 0.00 0.48 0.00 0.00 55.95 56.49 1ikm s SER 30 Cb -0.06 -0.79 0.00 0.00 0.10 0.00 0.00 66.02 65.27 1ikm s SER 30 CO 0.55 -0.39 0.00 0.61 0.98 0.00 0.00 173.24 175.00 1ikm n GLY 31 N -1.30 0.86 0.17 7.32 0.00 -0.36 -4.96 105.19 106.92 1ikm n GLY 31 Ca -0.01 -0.42 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 1ikm n GLY 31 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ikm h PRO 32 N 0.00 0.37 -0.29 1.61 0.13 -1.99 -2.60 132.00 129.23 1ikm h PRO 32 Ca 0.00 -0.31 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1ikm h PRO 32 Cb 0.00 0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.18 1ikm h PRO 32 CO 0.00 0.96 0.19 1.12 -0.23 0.00 0.00 178.00 180.04 1ikm h HIS 33 N 0.25 0.36 -0.92 1.56 2.07 -1.94 -3.40 115.15 113.13 1ikm h HIS 33 Ca -0.03 0.01 0.09 0.00 -2.85 0.00 0.00 60.37 57.59 1ikm h HIS 33 Cb 1.32 -0.12 -0.21 0.00 2.57 0.00 0.00 27.41 30.97 1ikm h HIS 33 CO 0.04 0.23 -0.26 0.00 -3.07 0.00 0.00 177.93 174.87 1ikm h ALA 35 N 7.97 0.79 -2.62 0.00 0.00 -1.69 -0.95 119.26 122.76 1ikm h ALA 35 Ca -0.16 -0.11 -0.51 0.00 0.00 0.00 0.00 54.91 54.14 1ikm h ALA 35 Cb 1.17 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1ikm h ALA 35 CO 0.19 0.31 0.35 -0.80 0.00 0.00 0.00 179.25 179.29 1ikm s ASN 36 N -5.93 7.52 0.64 0.00 -0.87 -1.26 -4.49 114.94 110.55 1ikm s ASN 36 Ca -0.13 1.82 -0.16 0.00 -1.57 0.00 0.00 52.86 52.81 1ikm s ASN 36 Cb 0.13 -2.59 -0.01 0.00 -0.02 0.00 0.00 41.25 38.76 1ikm s ASN 36 CO 0.78 -0.00 1.14 -0.89 -2.57 0.00 0.00 177.10 175.55 1ikm s THR 37 N -0.32 3.02 -0.07 1.60 2.01 -1.26 -4.82 115.64 115.79 1ikm s THR 37 Ca 0.45 0.53 0.00 0.00 0.31 0.00 0.00 61.69 62.98 1ikm s THR 37 Cb -0.24 -3.09 0.02 0.00 0.01 0.00 0.00 72.50 69.21 1ikm s THR 37 CO 0.30 -0.24 -0.05 -0.70 -0.69 0.00 0.00 174.62 173.24 1ikm s GLU 38 N -3.81 1.10 0.37 4.92 2.56 -1.21 -4.63 118.70 117.99 1ikm s GLU 38 Ca 0.70 -0.13 -0.03 0.00 0.00 0.00 0.00 54.97 55.51 1ikm s GLU 38 Cb -0.24 -1.17 -0.04 0.00 2.00 0.00 0.00 34.13 34.68 1ikm s GLU 38 CO 0.38 -0.18 0.62 0.42 -0.56 0.00 0.00 175.26 175.95 1ikm s ILE 39 N 1.39 5.01 -0.10 -3.70 1.09 -1.11 -0.77 121.20 123.01 1ikm s ILE 39 Ca -0.03 -0.08 -0.08 0.00 -1.10 0.00 0.00 60.65 59.37 1ikm s ILE 39 Cb -0.13 -3.82 0.03 0.00 -1.06 0.00 0.00 42.46 37.48 1ikm s ILE 39 CO -0.03 -0.56 0.25 -0.63 -0.10 0.00 0.00 174.94 173.87 1ikm s ILE 40 N -2.36 -0.01 0.13 2.92 1.01 -0.42 -1.65 121.20 120.81 1ikm s ILE 40 Ca 0.44 0.05 -0.01 0.00 0.00 0.00 0.00 60.65 61.13 1ikm s ILE 40 Cb -0.10 -0.37 -0.04 0.00 0.01 0.00 0.00 42.46 41.96 1ikm s ILE 40 CO 0.36 0.02 0.04 0.68 0.00 0.00 0.00 174.94 176.05 1ikm s VAL 41 N 0.53 0.20 -0.34 2.92 -7.23 -0.92 -0.11 120.40 115.45 1ikm s VAL 41 Ca -0.03 -1.92 0.00 0.00 -1.81 0.00 0.00 61.98 58.22 1ikm s VAL 41 Cb -0.05 -2.03 0.11 0.00 0.56 0.00 0.00 36.38 34.97 1ikm s VAL 41 CO -0.03 -0.49 0.13 -0.54 -0.31 0.00 0.00 175.10 173.86 1ikm s LYS 42 N -4.02 0.87 0.50 4.82 1.02 -0.48 -2.44 119.74 120.01 1ikm s LYS 42 Ca 0.23 -1.33 -0.22 0.00 0.02 0.00 0.00 55.97 54.68 1ikm s LYS 42 Cb 0.07 -2.11 -0.08 0.00 -0.52 0.00 0.00 37.83 35.20 1ikm s LYS 42 CO 0.02 -1.03 1.08 1.28 -0.92 0.00 0.00 175.35 175.78 1ikm n LEU 43 N 4.51 3.61 0.22 3.17 4.77 -0.40 -1.18 117.00 131.70 1ikm n LEU 43 Ca 0.01 0.96 0.18 0.00 -0.03 0.00 0.00 56.01 57.13 1ikm n LEU 43 Cb 0.40 -1.42 0.85 0.00 -2.33 0.00 0.00 43.42 40.92 1ikm n LEU 43 CO 0.15 -1.35 1.15 0.77 -1.33 0.00 0.00 177.39 176.78 1ikm h SER 44 N 1.26 0.00 0.00 -1.43 4.64 -1.82 0.46 113.55 116.66 1ikm h SER 44 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1ikm h SER 44 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1ikm h SER 44 CO 0.55 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.98 1ikm n ASP 45 N -3.66 0.00 -0.07 4.97 9.92 -1.26 -4.81 116.55 121.64 1ikm n ASP 45 Ca 0.01 -0.76 0.00 0.00 -0.53 0.00 0.00 54.79 53.51 1ikm n ASP 45 Cb 0.34 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.82 1ikm n ASP 45 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ikm n GLY 46 N 0.42 1.09 3.78 0.44 0.00 0.14 -5.08 105.19 105.97 1ikm n GLY 46 Ca 0.16 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 1ikm n GLY 46 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ikm s ARG 47 N -2.60 2.77 -0.20 1.61 6.06 -1.12 -4.94 118.95 120.53 1ikm s ARG 47 Ca 0.00 -1.11 -0.01 0.00 -2.50 0.00 0.00 55.73 52.11 1ikm s ARG 47 Cb 0.00 -2.48 0.05 0.00 0.06 0.00 0.00 34.95 32.59 1ikm s ARG 47 CO 0.00 0.40 -0.02 -2.00 -2.50 0.00 0.00 175.30 171.18 1ikm s GLU 48 N -3.69 1.22 -0.11 5.12 2.12 -1.26 -1.27 118.70 120.82 1ikm s GLU 48 Ca 0.32 -0.64 0.01 0.00 0.36 0.00 0.00 54.97 55.03 1ikm s GLU 48 Cb -0.08 -2.22 0.02 0.00 0.26 0.00 0.00 34.13 32.11 1ikm s GLU 48 CO 0.23 -0.56 -0.14 -0.51 -0.54 0.00 0.00 175.26 173.75 1ikm s LEU 49 N 1.63 1.63 -0.01 2.70 1.02 -1.02 -4.99 118.68 119.64 1ikm s LEU 49 Ca -0.02 -0.41 -0.24 0.00 0.02 0.00 0.00 54.13 53.48 1ikm s LEU 49 Cb -0.17 -1.05 -0.05 0.00 0.02 0.00 0.00 46.19 44.94 1ikm s LEU 49 CO -0.07 -0.02 0.72 0.00 0.02 0.00 0.00 176.35 177.00 1ikm s LEU 51 N 0.33 4.02 -0.29 0.00 1.43 -0.66 0.10 118.68 123.61 1ikm s LEU 51 Ca 0.38 0.70 -0.11 0.00 -1.03 0.00 0.00 54.13 54.07 1ikm s LEU 51 Cb -0.19 -3.53 -0.04 0.00 0.03 0.00 0.00 46.19 42.46 1ikm s LEU 51 CO 0.20 -0.23 0.18 -0.62 0.23 0.00 0.00 176.35 176.11 1ikm s ASP 52 N -3.32 5.87 0.00 2.29 -1.08 -1.06 -2.75 116.67 116.63 1ikm s ASP 52 Ca 0.44 -0.15 0.15 0.00 -0.52 0.00 0.00 52.55 52.47 1ikm s ASP 52 Cb -0.11 -2.09 0.67 0.00 -1.46 0.00 0.00 42.92 39.94 1ikm s ASP 52 CO 0.31 -0.09 1.46 -0.81 0.52 0.00 0.00 175.17 176.56 1ikm n PRO 53 N 5.04 0.06 0.27 4.34 -0.04 -1.26 -2.93 135.00 140.49 1ikm n PRO 53 Ca -0.14 0.22 0.10 0.00 -0.04 0.00 0.00 63.50 63.64 1ikm n PRO 53 Cb 0.51 -1.50 0.72 0.00 -0.04 0.00 0.00 33.50 33.20 1ikm n PRO 53 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1ikm h LYS 54 N 0.00 0.00 -7.14 0.54 1.57 -1.94 -3.43 116.57 106.18 1ikm h LYS 54 Ca 0.00 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.33 1ikm h LYS 54 Cb 0.22 0.00 0.07 0.00 0.08 0.00 0.00 32.23 32.60 1ikm h LYS 54 CO 0.00 0.02 0.13 -1.21 -0.57 0.00 0.00 179.45 177.82 1ikm s GLU 55 N -4.87 2.23 0.03 3.15 0.41 -1.15 -5.00 118.70 113.50 1ikm s GLU 55 Ca -0.05 -0.51 0.22 0.00 -0.41 0.00 0.00 54.97 54.22 1ikm s GLU 55 Cb 0.16 -2.28 -0.14 0.00 -1.78 0.00 0.00 34.13 30.08 1ikm s GLU 55 CO 0.63 -1.11 0.81 0.09 -0.49 0.00 0.00 175.26 175.19 1ikm n ASN 56 N -2.74 0.47 0.06 -0.19 3.02 -1.26 -4.14 115.26 110.48 1ikm n ASN 56 Ca 0.09 -0.19 -0.15 0.00 -0.03 0.00 0.00 54.58 54.29 1ikm n ASN 56 Cb 0.60 1.23 -0.07 0.00 -0.61 0.00 0.00 39.78 40.94 1ikm n ASN 56 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 1ikm h TRP 57 N 0.00 0.73 -0.42 3.10 5.08 -1.94 -1.36 115.95 121.14 1ikm h TRP 57 Ca 0.00 -0.40 -0.05 0.00 1.08 0.00 0.00 58.89 59.52 1ikm h TRP 57 Cb 0.83 -0.08 -0.02 0.00 -3.00 0.00 0.00 29.16 26.89 1ikm h TRP 57 CO 0.00 1.23 0.07 0.28 -1.28 0.00 0.00 178.44 178.74 1ikm h VAL 58 N 0.27 1.24 0.00 0.12 2.07 -1.81 0.79 116.25 118.94 1ikm h VAL 58 Ca -0.10 -0.87 -0.09 0.00 0.82 0.00 0.00 66.70 66.46 1ikm h VAL 58 Cb 1.63 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 1ikm h VAL 58 CO 0.18 0.30 -0.42 0.06 0.02 0.00 0.00 177.57 177.71 1ikm h GLN 59 N 0.54 0.00 0.18 1.57 3.07 -1.72 -1.05 115.11 117.71 1ikm h GLN 59 Ca 0.13 0.00 -0.27 0.00 0.09 0.00 0.00 58.65 58.59 1ikm h GLN 59 Cb 0.37 0.00 0.02 0.00 0.08 0.00 0.00 27.48 27.95 1ikm h GLN 59 CO 0.01 0.42 -1.28 -0.09 0.09 0.00 0.00 178.83 177.98 1ikm h ARG 60 N 0.00 0.38 -0.69 0.06 2.43 -0.92 -2.21 114.38 113.43 1ikm h ARG 60 Ca -0.00 -0.65 -0.06 0.00 -0.81 0.00 0.00 59.98 58.45 1ikm h ARG 60 Cb 1.04 0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 30.81 1ikm h ARG 60 CO 0.05 1.31 0.17 0.28 -1.51 0.00 0.00 179.97 180.28 1ikm h VAL 61 N -0.13 1.26 -0.34 0.20 2.07 0.62 0.88 116.25 120.81 1ikm h VAL 61 Ca -0.24 -0.94 -0.15 0.00 0.82 0.00 0.00 66.70 66.18 1ikm h VAL 61 Cb 1.90 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 1ikm h VAL 61 CO 0.18 0.36 -0.40 0.58 0.02 0.00 0.00 177.57 178.31 1ikm h VAL 62 N 1.03 1.28 -0.31 2.57 2.07 -1.27 -1.40 116.25 120.22 1ikm h VAL 62 Ca 0.22 -1.58 -0.06 0.00 0.82 0.00 0.00 66.70 66.10 1ikm h VAL 62 Cb 0.35 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1ikm h VAL 62 CO 0.00 0.52 -0.05 -0.33 0.02 0.00 0.00 177.57 177.73 1ikm h GLU 63 N 0.67 0.58 -0.35 1.57 5.08 -1.00 -0.21 114.58 120.92 1ikm h GLU 63 Ca 0.05 -0.21 -0.06 0.00 -1.00 0.00 0.00 59.36 58.14 1ikm h GLU 63 Cb 0.97 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 1ikm h GLU 63 CO 0.09 0.75 -0.03 -0.22 -1.00 0.00 0.00 179.01 178.60 1ikm h LYS 64 N 0.35 0.57 -0.08 2.33 3.11 -0.79 0.26 116.57 122.32 1ikm h LYS 64 Ca 0.08 -0.14 -0.04 0.00 -2.81 0.00 0.00 60.65 57.74 1ikm h LYS 64 Cb 0.52 -0.07 -0.00 0.00 -1.00 0.00 0.00 32.23 31.68 1ikm h LYS 64 CO 0.03 0.62 -0.11 0.35 -2.81 0.00 0.00 179.45 177.52 1ikm h PHE 65 N 0.54 0.27 -0.10 1.91 3.57 -1.04 -3.32 116.94 118.78 1ikm h PHE 65 Ca 0.11 -0.09 -0.07 0.00 3.53 0.00 0.00 57.97 61.45 1ikm h PHE 65 Cb 0.40 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.08 1ikm h PHE 65 CO 0.02 0.69 -0.20 1.25 -2.23 0.00 0.00 178.31 177.84 1ikm h LEU 66 N -0.22 0.34 -9.40 0.59 5.85 -0.89 -3.43 115.31 108.15 1ikm h LEU 66 Ca 0.01 -0.56 -0.53 0.00 0.84 0.00 0.00 57.88 57.64 1ikm h LEU 66 Cb 0.66 -0.10 0.02 0.00 0.37 0.00 0.00 40.66 41.61 1ikm h LEU 66 CO 0.03 0.84 1.12 -0.75 -0.34 0.00 0.00 178.44 179.34 1ikm s LYS 67 N -3.99 4.16 0.34 1.25 2.47 0.89 -4.96 119.74 119.90 1ikm s LYS 67 Ca -0.14 2.47 -0.03 0.00 -1.56 0.00 0.00 55.97 56.71 1ikm s LYS 67 Cb 0.04 -3.86 0.01 0.00 -1.46 0.00 0.00 37.83 32.57 1ikm s LYS 67 CO 0.75 -0.86 0.50 0.54 0.16 0.00 0.00 175.35 176.44 1ikm n ARG 68 N 6.55 0.72 -3.15 4.03 1.74 -1.26 -4.84 116.66 120.45 1ikm n ARG 68 Ca 0.18 -2.60 -0.40 0.00 -0.77 0.00 0.00 57.85 54.27 1ikm n ARG 68 Cb 0.40 2.57 -0.06 0.00 -1.02 0.00 0.00 32.46 34.36 1ikm n ARG 68 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ikm s ALA 69 N -2.64 3.49 0.06 7.54 0.00 -1.26 -5.03 121.76 123.92 1ikm s ALA 69 Ca 0.26 -0.19 -0.27 0.00 0.00 0.00 0.00 51.96 51.76 1ikm s ALA 69 Cb -0.01 -2.90 0.09 0.00 0.00 0.00 0.00 23.12 20.29 1ikm s ALA 69 CO 0.19 -0.37 0.85 -1.83 0.00 0.00 0.00 175.76 174.60 1ikm s GLU 70 N 1.46 0.99 0.28 0.00 -1.05 -1.26 -5.15 118.70 113.98 1ikm s GLU 70 Ca 0.30 -0.41 0.00 0.00 -0.15 0.00 0.00 54.97 54.70 1ikm s GLU 70 Cb -0.16 0.42 0.00 0.00 -0.44 0.00 0.00 34.13 33.95 1ikm s GLU 70 CO 0.12 -0.44 0.00 -1.71 0.95 0.00 0.00 175.26 174.18 1ikm n ASN 71 N -0.31 -4.85 0.00 0.83 5.15 -1.26 -5.31 115.26 109.51 1ikm n ASN 71 Ca -0.09 0.71 0.00 0.00 -0.60 0.00 0.00 54.58 54.60 1ikm n ASN 71 Cb 0.62 -2.05 0.00 0.00 -0.53 0.00 0.00 39.78 37.82 1ikm n ASN 71 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42