#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ikm n LEU 5 N 0.00 -0.68 0.00 4.31 0.00 -1.26 -4.21 117.00 115.16 1ikm n LEU 5 Ca 0.00 1.59 0.00 0.00 0.00 0.00 0.00 56.01 57.60 1ikm n LEU 5 Cb 0.00 -1.99 0.00 0.00 0.00 0.00 0.00 43.42 41.43 1ikm n LEU 5 CO 0.00 -1.39 0.00 -1.14 0.00 0.00 0.00 177.39 174.86 1ikm n ARG 6 N -3.53 0.00 -2.28 1.96 3.00 -1.26 -4.46 116.66 110.10 1ikm n ARG 6 Ca -0.06 0.00 -0.42 0.00 -0.00 0.00 0.00 57.85 57.37 1ikm n ARG 6 Cb 0.45 0.00 -0.03 0.00 0.00 0.00 0.00 32.46 32.88 1ikm n ARG 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ikm h GLN 8 N 7.49 0.00 -4.40 0.00 5.75 -1.99 -3.34 115.11 118.62 1ikm h GLN 8 Ca -0.38 0.00 -0.71 0.00 -0.15 0.00 0.00 58.65 57.41 1ikm h GLN 8 Cb 1.18 0.00 -0.32 0.00 1.07 0.00 0.00 27.48 29.42 1ikm h GLN 8 CO 0.88 0.01 -0.47 0.00 -2.65 0.00 0.00 178.83 176.60 1ikm h ILE 10 N 6.24 1.23 -4.21 0.00 5.03 -2.01 -3.42 117.51 120.38 1ikm h ILE 10 Ca -0.17 -1.09 -0.69 0.00 -0.12 0.00 0.00 64.86 62.78 1ikm h ILE 10 Cb 1.06 1.53 -0.25 0.00 -3.03 0.00 0.00 36.82 36.13 1ikm h ILE 10 CO 0.78 0.32 -0.82 -0.54 -0.68 0.00 0.00 178.15 177.20 1ikm s LYS 11 N -4.37 2.20 0.00 2.37 1.02 -1.26 -5.13 119.74 114.56 1ikm s LYS 11 Ca -0.04 -0.88 0.00 0.00 0.02 0.00 0.00 55.97 55.07 1ikm s LYS 11 Cb 0.15 -2.19 0.00 0.00 -0.52 0.00 0.00 37.83 35.27 1ikm s LYS 11 CO 0.73 0.57 0.00 0.25 -0.92 0.00 0.00 175.35 175.98 1ikm n THR 12 N 2.08 0.00 -3.90 2.17 -2.24 -1.26 -4.58 114.28 106.54 1ikm n THR 12 Ca -0.16 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.26 1ikm n THR 12 Cb 0.52 -0.08 -0.14 0.00 -2.10 0.00 0.00 70.33 68.53 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 -0.57 2.96 -0.15 4.78 5.04 0.27 -4.86 117.35 124.84 1ikm s TYR 13 Ca 0.00 -0.95 0.10 0.00 -2.44 0.00 0.00 57.07 53.77 1ikm s TYR 13 Cb 0.00 -2.11 -0.23 0.00 0.35 0.00 0.00 41.96 39.97 1ikm s TYR 13 CO 0.00 -0.55 0.26 0.45 -1.34 0.00 0.00 175.55 174.37 1ikm n SER 14 N 4.80 0.96 -4.75 4.32 2.88 -1.26 -2.77 113.62 117.80 1ikm n SER 14 Ca -0.18 0.15 -0.40 0.00 -1.33 0.00 0.00 58.87 57.10 1ikm n SER 14 Cb 0.51 0.11 -0.05 0.00 -0.75 0.00 0.00 64.21 64.03 1ikm n SER 14 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1ikm s LYS 15 N -2.54 4.71 0.60 -1.46 -0.14 -1.26 -5.02 119.74 114.62 1ikm s LYS 15 Ca -0.14 1.68 -0.09 0.00 -1.36 0.00 0.00 55.97 56.06 1ikm s LYS 15 Cb 0.07 -3.23 -0.02 0.00 -1.68 0.00 0.00 37.83 32.97 1ikm s LYS 15 CO 0.78 0.30 0.95 -1.25 -0.76 0.00 0.00 175.35 175.37 1ikm s PRO 16 N -1.19 3.30 0.11 -1.68 0.04 -1.26 -5.06 135.00 129.25 1ikm s PRO 16 Ca 0.44 0.40 -0.25 0.00 0.04 0.00 0.00 61.00 61.63 1ikm s PRO 16 Cb -0.29 -2.18 0.08 0.00 0.04 0.00 0.00 34.50 32.14 1ikm s PRO 16 CO 0.37 -0.60 0.68 -0.59 0.04 0.00 0.00 177.00 176.91 1ikm s PHE 17 N -3.07 -0.49 0.31 0.56 -0.71 -1.26 -5.15 117.98 108.18 1ikm s PHE 17 Ca 0.53 0.32 -0.29 0.00 -1.04 0.00 0.00 56.93 56.45 1ikm s PHE 17 Cb -0.11 0.55 -0.10 0.00 -1.21 0.00 0.00 43.02 42.15 1ikm s PHE 17 CO 0.49 -0.76 1.30 -1.58 -1.34 0.00 0.00 175.22 173.34 1ikm s HIS 18 N -3.50 3.10 0.00 3.49 5.65 -1.26 -4.97 115.29 117.80 1ikm s HIS 18 Ca 0.02 1.39 -0.20 0.00 0.25 0.00 0.00 55.06 56.52 1ikm s HIS 18 Cb -0.01 -3.66 -0.24 0.00 -1.18 0.00 0.00 32.58 27.49 1ikm s HIS 18 CO -0.11 -1.82 1.09 -1.00 -0.65 0.00 0.00 174.74 172.24 1ikm h PRO 19 N 3.69 0.41 -0.17 2.88 0.13 -1.98 -3.32 132.00 133.65 1ikm h PRO 19 Ca -0.48 -0.46 0.05 0.00 -0.87 0.00 0.00 66.00 64.24 1ikm h PRO 19 Cb 1.22 0.13 -0.01 0.00 0.13 0.00 0.00 31.00 32.48 1ikm h PRO 19 CO 0.67 1.12 0.40 -0.22 -0.23 0.00 0.00 178.00 179.75 1ikm h LYS 20 N -0.10 0.00 -0.75 0.86 3.64 -1.97 0.19 116.57 118.44 1ikm h LYS 20 Ca -0.08 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.26 1ikm h LYS 20 Cb 1.35 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.14 1ikm h LYS 20 CO 0.12 0.00 0.33 0.74 -2.27 0.00 0.00 179.45 178.37 1ikm h PHE 21 N 0.00 1.09 -2.39 1.91 0.04 -1.98 -3.42 116.94 112.20 1ikm h PHE 21 Ca 0.08 -0.06 -0.53 0.00 2.80 0.00 0.00 57.97 60.26 1ikm h PHE 21 Cb 0.89 -0.33 0.02 0.00 2.20 0.00 0.00 35.95 38.72 1ikm h PHE 21 CO 0.00 0.81 1.22 0.42 -0.60 0.00 0.00 178.31 180.16 1ikm s ILE 22 N -5.56 3.07 -0.05 -0.55 1.01 0.68 -2.11 121.20 117.68 1ikm s ILE 22 Ca -0.12 0.08 0.13 0.00 0.00 0.00 0.00 60.65 60.74 1ikm s ILE 22 Cb 0.16 -3.05 -0.08 0.00 0.01 0.00 0.00 42.46 39.50 1ikm s ILE 22 CO 0.82 -0.01 1.23 0.11 0.00 0.00 0.00 174.94 177.09 1ikm h LYS 23 N 10.55 0.00 -4.41 2.79 1.79 -1.14 -3.47 116.57 122.68 1ikm h LYS 23 Ca -0.49 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 57.65 1ikm h LYS 23 Cb 1.23 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 31.78 1ikm h LYS 23 CO 0.94 0.63 -0.32 -1.21 -1.08 0.00 0.00 179.45 178.41 1ikm s GLU 24 N -2.85 1.79 0.00 3.15 2.02 -1.24 -4.99 118.70 116.59 1ikm s GLU 24 Ca 0.01 -1.82 0.00 0.00 0.02 0.00 0.00 54.97 53.18 1ikm s GLU 24 Cb 0.09 0.39 0.00 0.00 0.10 0.00 0.00 34.13 34.71 1ikm s GLU 24 CO 0.79 -0.71 0.00 -2.13 0.02 0.00 0.00 175.26 173.23 1ikm n ARG 26 N -0.56 0.00 -4.11 1.61 0.63 0.11 -1.25 116.66 113.09 1ikm n ARG 26 Ca 0.03 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.66 1ikm n ARG 26 Cb 0.62 0.00 -0.08 0.00 0.45 0.00 0.00 32.46 33.45 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 -0.16 4.13 0.00 5.15 -7.23 -1.26 -1.10 120.40 119.93 1ikm s VAL 27 Ca 0.00 -0.93 -0.01 0.00 -1.81 0.00 0.00 61.98 59.23 1ikm s VAL 27 Cb 0.00 -2.97 -0.04 0.00 0.56 0.00 0.00 36.38 33.93 1ikm s VAL 27 CO 0.00 0.13 0.11 -0.63 -0.31 0.00 0.00 175.10 174.40 1ikm s ILE 28 N -1.32 4.89 1.03 -0.62 1.01 0.31 -4.94 121.20 121.56 1ikm s ILE 28 Ca 0.26 -0.39 -0.14 0.00 0.00 0.00 0.00 60.65 60.38 1ikm s ILE 28 Cb -0.12 -3.27 0.20 0.00 0.01 0.00 0.00 42.46 39.29 1ikm s ILE 28 CO 0.19 0.32 1.13 -1.83 0.00 0.00 0.00 174.94 174.74 1ikm s GLU 29 N -1.87 0.18 0.37 2.79 -1.05 -1.26 -3.45 118.70 114.42 1ikm s GLU 29 Ca 0.25 0.21 0.08 0.00 -0.15 0.00 0.00 54.97 55.35 1ikm s GLU 29 Cb -0.12 -1.74 -0.04 0.00 -0.44 0.00 0.00 34.13 31.80 1ikm s GLU 29 CO 0.16 -2.83 0.23 -1.54 0.95 0.00 0.00 175.26 172.23 1ikm s SER 30 N -3.86 4.80 0.00 0.83 1.04 -1.26 -4.64 113.70 110.61 1ikm s SER 30 Ca 0.67 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 56.31 1ikm s SER 30 Cb -0.14 -0.68 0.00 0.00 0.10 0.00 0.00 66.02 65.30 1ikm s SER 30 CO 0.56 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 174.94 1ikm n GLY 31 N -1.29 1.98 0.19 7.32 0.00 -0.62 -4.98 105.19 107.78 1ikm n GLY 31 Ca -0.01 -0.53 -0.11 0.00 0.00 0.00 0.00 46.02 45.37 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 0.49 -0.82 1.61 0.13 -1.96 -2.80 132.00 128.64 1ikm h PRO 32 Ca 0.00 -0.39 0.04 0.00 -0.87 0.00 0.00 66.00 64.79 1ikm h PRO 32 Cb 0.00 0.08 -0.05 0.00 0.13 0.00 0.00 31.00 31.16 1ikm h PRO 32 CO 0.00 1.02 0.54 1.12 -0.23 0.00 0.00 178.00 180.45 1ikm h HIS 33 N 0.34 0.96 -1.67 1.56 2.07 -1.78 -3.39 115.15 113.24 1ikm h HIS 33 Ca -0.03 0.02 -0.12 0.00 -2.85 0.00 0.00 60.37 57.39 1ikm h HIS 33 Cb 1.29 -0.32 -0.28 0.00 2.57 0.00 0.00 27.41 30.67 1ikm h HIS 33 CO 0.05 0.54 -0.47 0.00 -3.07 0.00 0.00 177.93 174.99 1ikm h ALA 35 N 8.14 0.86 -2.80 0.00 0.00 -1.71 -1.65 119.26 122.10 1ikm h ALA 35 Ca -0.16 -0.21 -0.50 0.00 0.00 0.00 0.00 54.91 54.04 1ikm h ALA 35 Cb 1.15 -0.25 0.02 0.00 0.00 0.00 0.00 17.79 18.70 1ikm h ALA 35 CO 0.26 0.53 0.48 -0.80 0.00 0.00 0.00 179.25 179.72 1ikm s ASN 36 N -6.28 7.26 0.67 0.00 0.01 -1.26 -4.58 114.94 110.76 1ikm s ASN 36 Ca -0.12 2.27 -0.13 0.00 -0.71 0.00 0.00 52.86 54.16 1ikm s ASN 36 Cb 0.14 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 39.17 1ikm s ASN 36 CO 0.82 -0.15 1.07 -0.89 -1.51 0.00 0.00 177.10 176.45 1ikm s THR 37 N -1.12 3.70 -0.15 1.60 2.01 -1.26 -4.80 115.64 115.62 1ikm s THR 37 Ca 0.45 0.67 0.00 0.00 0.31 0.00 0.00 61.69 63.11 1ikm s THR 37 Cb -0.32 -3.25 0.03 0.00 0.01 0.00 0.00 72.50 68.96 1ikm s THR 37 CO 0.41 -0.61 -0.12 -1.61 -0.69 0.00 0.00 174.62 172.00 1ikm s GLU 38 N -4.56 2.07 0.35 4.92 0.41 -1.22 -4.59 118.70 116.07 1ikm s GLU 38 Ca 0.62 -0.53 -0.03 0.00 -0.41 0.00 0.00 54.97 54.61 1ikm s GLU 38 Cb -0.16 -2.04 -0.04 0.00 -1.78 0.00 0.00 34.13 30.11 1ikm s GLU 38 CO 0.47 -0.28 0.61 0.42 -0.49 0.00 0.00 175.26 175.99 1ikm s ILE 39 N 1.53 5.02 -0.11 -1.63 1.09 -1.13 -0.53 121.20 125.44 1ikm s ILE 39 Ca 0.04 -0.06 -0.09 0.00 -1.10 0.00 0.00 60.65 59.45 1ikm s ILE 39 Cb -0.13 -3.80 0.04 0.00 -1.06 0.00 0.00 42.46 37.50 1ikm s ILE 39 CO -0.10 -0.51 0.28 -0.63 -0.10 0.00 0.00 174.94 173.88 1ikm s ILE 40 N -2.30 -0.01 0.16 2.92 1.01 -0.26 -1.77 121.20 120.94 1ikm s ILE 40 Ca 0.44 0.05 -0.01 0.00 0.00 0.00 0.00 60.65 61.12 1ikm s ILE 40 Cb -0.10 -0.41 -0.04 0.00 0.01 0.00 0.00 42.46 41.92 1ikm s ILE 40 CO 0.35 0.02 0.09 0.68 0.00 0.00 0.00 174.94 176.08 1ikm s VAL 41 N 0.55 0.07 -0.31 2.92 -7.23 -0.90 0.09 120.40 115.59 1ikm s VAL 41 Ca -0.03 -1.93 -0.01 0.00 -1.81 0.00 0.00 61.98 58.20 1ikm s VAL 41 Cb -0.05 -2.20 0.10 0.00 0.56 0.00 0.00 36.38 34.79 1ikm s VAL 41 CO -0.03 -0.30 0.10 -0.54 -0.31 0.00 0.00 175.10 174.02 1ikm s LYS 42 N -4.09 0.64 0.46 4.82 1.02 -0.38 -2.52 119.74 119.70 1ikm s LYS 42 Ca 0.29 -1.00 -0.24 0.00 0.02 0.00 0.00 55.97 55.04 1ikm s LYS 42 Cb 0.07 -1.87 -0.08 0.00 -0.52 0.00 0.00 37.83 35.43 1ikm s LYS 42 CO 0.05 -0.99 1.33 1.28 -0.92 0.00 0.00 175.35 176.10 1ikm n LEU 43 N 4.90 4.65 0.19 3.17 4.77 -0.52 -0.66 117.00 133.51 1ikm n LEU 43 Ca -0.03 1.07 0.17 0.00 -0.03 0.00 0.00 56.01 57.19 1ikm n LEU 43 Cb 0.42 -1.54 0.80 0.00 -2.33 0.00 0.00 43.42 40.77 1ikm n LEU 43 CO 0.10 -0.54 1.14 -1.28 -1.33 0.00 0.00 177.39 175.49 1ikm h SER 44 N 1.95 0.00 0.34 -1.43 0.87 -1.75 0.13 113.55 113.66 1ikm h SER 44 Ca -0.49 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 1ikm h SER 44 Cb 1.29 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.25 1ikm h SER 44 CO 0.59 0.00 0.00 0.47 -0.53 0.00 0.00 176.83 177.36 1ikm n ASP 45 N -3.93 0.41 0.00 6.23 8.00 -1.26 -4.80 116.55 121.20 1ikm n ASP 45 Ca 0.02 0.64 0.00 0.00 0.71 0.00 0.00 54.79 56.16 1ikm n ASP 45 Cb 0.32 -0.71 0.00 0.00 -0.02 0.00 0.00 41.12 40.71 1ikm n ASP 45 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ikm n GLY 46 N -0.67 1.71 3.73 0.44 0.00 0.45 -5.11 105.19 105.75 1ikm n GLY 46 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.69 2.38 -0.14 1.61 3.52 -1.11 -4.95 118.95 119.58 1ikm s ARG 47 Ca 0.00 -1.53 -0.01 0.00 -0.13 0.00 0.00 55.73 54.06 1ikm s ARG 47 Cb 0.00 -2.19 0.04 0.00 -1.56 0.00 0.00 34.95 31.24 1ikm s ARG 47 CO 0.00 0.13 -0.03 -1.21 -0.81 0.00 0.00 175.30 173.38 1ikm s GLU 48 N -3.84 1.11 -0.09 5.12 2.02 -1.26 -1.43 118.70 120.33 1ikm s GLU 48 Ca 0.37 -0.30 0.01 0.00 0.02 0.00 0.00 54.97 55.07 1ikm s GLU 48 Cb -0.03 -1.69 0.02 0.00 0.10 0.00 0.00 34.13 32.53 1ikm s GLU 48 CO 0.23 -0.41 -0.10 -0.51 0.02 0.00 0.00 175.26 174.49 1ikm s LEU 49 N 1.77 1.43 -0.02 1.80 1.02 -1.05 -4.99 118.68 118.64 1ikm s LEU 49 Ca 0.02 -0.31 -0.23 0.00 0.02 0.00 0.00 54.13 53.64 1ikm s LEU 49 Cb -0.14 -0.85 -0.05 0.00 0.02 0.00 0.00 46.19 45.17 1ikm s LEU 49 CO -0.07 -0.04 0.67 0.00 0.02 0.00 0.00 176.35 176.92 1ikm s LEU 51 N 0.24 4.08 -0.28 0.00 1.43 -0.73 0.97 118.68 124.39 1ikm s LEU 51 Ca 0.35 0.66 -0.10 0.00 -1.03 0.00 0.00 54.13 54.01 1ikm s LEU 51 Cb -0.18 -3.47 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 1ikm s LEU 51 CO 0.19 -0.17 0.17 -0.62 0.23 0.00 0.00 176.35 176.14 1ikm s ASP 52 N -3.17 5.80 0.00 2.29 -1.08 -1.11 -2.82 116.67 116.57 1ikm s ASP 52 Ca 0.43 -0.12 0.15 0.00 -0.52 0.00 0.00 52.55 52.49 1ikm s ASP 52 Cb -0.11 -2.07 0.72 0.00 -1.46 0.00 0.00 42.92 40.00 1ikm s ASP 52 CO 0.30 -0.07 1.42 -0.81 0.52 0.00 0.00 175.17 176.53 1ikm n PRO 53 N 5.03 0.16 0.24 4.34 -0.04 -1.26 -2.93 135.00 140.54 1ikm n PRO 53 Ca -0.14 0.17 0.07 0.00 -0.04 0.00 0.00 63.50 63.56 1ikm n PRO 53 Cb 0.51 -1.50 0.57 0.00 -0.04 0.00 0.00 33.50 33.04 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 -7.18 0.54 1.57 -1.94 -3.43 116.57 106.13 1ikm h LYS 54 Ca 0.00 0.00 -0.48 0.00 -1.87 0.00 0.00 60.65 58.30 1ikm h LYS 54 Cb 0.17 0.00 0.06 0.00 0.08 0.00 0.00 32.23 32.54 1ikm h LYS 54 CO 0.00 0.14 0.22 -1.21 -0.57 0.00 0.00 179.45 178.03 1ikm s GLU 55 N -4.64 2.94 0.10 3.15 8.01 -1.15 -4.98 118.70 122.13 1ikm s GLU 55 Ca -0.04 0.10 0.23 0.00 0.01 0.00 0.00 54.97 55.27 1ikm s GLU 55 Cb 0.16 -2.23 0.10 0.00 -4.31 0.00 0.00 34.13 27.85 1ikm s GLU 55 CO 0.67 -0.74 1.08 0.09 0.01 0.00 0.00 175.26 176.37 1ikm n ASN 56 N -2.65 0.66 0.12 -0.19 3.02 -1.26 -3.83 115.26 111.13 1ikm n ASN 56 Ca 0.05 0.02 -0.20 0.00 -0.03 0.00 0.00 54.58 54.42 1ikm n ASN 56 Cb 0.57 0.60 -0.14 0.00 -0.61 0.00 0.00 39.78 40.20 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 0.74 -0.48 3.10 5.08 -1.93 -1.42 115.95 121.04 1ikm h TRP 57 Ca 0.00 -0.53 -0.05 0.00 1.08 0.00 0.00 58.89 59.39 1ikm h TRP 57 Cb 0.81 -0.03 -0.02 0.00 -3.00 0.00 0.00 29.16 26.92 1ikm h TRP 57 CO 0.00 1.41 0.12 0.28 -1.28 0.00 0.00 178.44 178.97 1ikm h VAL 58 N 0.12 1.24 0.00 0.12 2.07 -1.81 0.91 116.25 118.90 1ikm h VAL 58 Ca -0.19 -0.83 -0.08 0.00 0.82 0.00 0.00 66.70 66.42 1ikm h VAL 58 Cb 2.04 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 32.67 1ikm h VAL 58 CO 0.24 0.30 -0.37 0.06 0.02 0.00 0.00 177.57 177.81 1ikm h GLN 59 N 0.65 0.00 0.19 1.57 3.07 -1.66 -1.13 115.11 117.79 1ikm h GLN 59 Ca 0.15 0.00 -0.34 0.00 0.09 0.00 0.00 58.65 58.55 1ikm h GLN 59 Cb 0.33 0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.90 1ikm h GLN 59 CO 0.00 0.37 -1.66 0.00 0.09 0.00 0.00 178.83 177.63 1ikm h ARG 60 N 0.00 0.39 -0.49 0.06 3.08 -0.89 -2.56 114.38 113.97 1ikm h ARG 60 Ca -0.00 -0.67 -0.13 0.00 0.07 0.00 0.00 59.98 59.24 1ikm h ARG 60 Cb 1.08 0.25 -0.01 0.00 0.08 0.00 0.00 29.97 31.37 1ikm h ARG 60 CO 0.05 1.30 -0.21 0.28 -1.07 0.00 0.00 179.97 180.32 1ikm h VAL 61 N 0.11 1.27 -0.25 2.04 2.07 0.85 0.96 116.25 123.30 1ikm h VAL 61 Ca -0.31 -1.37 -0.17 0.00 0.82 0.00 0.00 66.70 65.66 1ikm h VAL 61 Cb 2.10 1.10 -0.00 0.00 -1.52 0.00 0.00 31.29 32.96 1ikm h VAL 61 CO 0.19 0.48 -0.53 1.62 0.02 0.00 0.00 177.57 179.35 1ikm h VAL 62 N 0.87 1.29 -0.11 2.57 3.04 -1.31 -1.28 116.25 121.32 1ikm h VAL 62 Ca 0.11 -1.74 -0.18 0.00 -1.01 0.00 0.00 66.70 63.89 1ikm h VAL 62 Cb 0.79 1.67 -0.00 0.00 -2.01 0.00 0.00 31.29 31.73 1ikm h VAL 62 CO 0.07 0.56 -0.67 -0.33 -1.01 0.00 0.00 177.57 176.18 1ikm h GLU 63 N 0.57 0.46 -0.03 4.17 4.39 -1.34 -1.88 114.58 120.92 1ikm h GLU 63 Ca 0.02 -0.35 -0.14 0.00 0.34 0.00 0.00 59.36 59.23 1ikm h GLU 63 Cb 1.11 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.81 1ikm h GLU 63 CO 0.11 0.97 -0.63 -0.22 -1.16 0.00 0.00 179.01 178.08 1ikm h LYS 64 N 0.33 0.10 -0.03 2.33 3.64 -0.76 0.73 116.57 122.92 1ikm h LYS 64 Ca -0.02 -0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.26 1ikm h LYS 64 Cb 1.23 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1ikm h LYS 64 CO 0.12 0.70 -0.08 0.35 -2.27 0.00 0.00 179.45 178.27 1ikm h PHE 65 N 0.07 0.13 0.00 1.91 3.57 -1.11 -3.30 116.94 118.21 1ikm h PHE 65 Ca -0.01 -0.05 -0.10 0.00 3.53 0.00 0.00 57.97 61.34 1ikm h PHE 65 Cb 1.13 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.84 1ikm h PHE 65 CO 0.01 0.69 -0.88 1.25 -2.23 0.00 0.00 178.31 177.15 1ikm h LEU 66 N -0.47 0.00 0.31 0.59 7.12 -1.38 -3.48 115.31 118.00 1ikm h LEU 66 Ca -0.00 0.00 -0.13 0.00 0.13 0.00 0.00 57.88 57.88 1ikm h LEU 66 Cb 0.69 0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 40.77 1ikm h LEU 66 CO 0.02 0.38 -0.12 1.17 -0.13 0.00 0.00 178.44 179.76 1ikm n LYS 67 N -2.99 -0.96 -4.01 1.25 3.00 0.25 -4.96 118.16 109.75 1ikm n LYS 67 Ca -0.02 0.63 -0.12 0.00 -0.00 0.00 0.00 58.31 58.80 1ikm n LYS 67 Cb 0.72 -4.56 -0.04 0.00 0.00 0.00 0.00 35.03 31.15 1ikm n LYS 67 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1ikm s ARG 68 N -2.15 1.81 -0.11 1.64 0.52 -1.23 -5.02 118.95 114.40 1ikm s ARG 68 Ca 0.00 -1.51 -0.31 0.00 -0.52 0.00 0.00 55.73 53.38 1ikm s ARG 68 Cb 0.00 0.48 0.12 0.00 0.52 0.00 0.00 34.95 36.07 1ikm s ARG 68 CO 0.00 -0.77 1.04 0.00 0.02 0.00 0.00 175.30 175.59 1ikm s ALA 69 N -3.33 -1.94 0.36 2.13 0.00 -1.26 -4.71 121.76 113.01 1ikm s ALA 69 Ca 0.25 1.37 0.03 0.00 0.00 0.00 0.00 51.96 53.61 1ikm s ALA 69 Cb -0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 1ikm s ALA 69 CO 0.14 -0.56 0.09 -1.83 0.00 0.00 0.00 175.76 173.60 1ikm s GLU 70 N -2.41 1.77 0.13 0.00 4.04 -1.26 -5.16 118.70 115.81 1ikm s GLU 70 Ca 0.05 -2.03 0.11 0.00 0.04 0.00 0.00 54.97 53.14 1ikm s GLU 70 Cb -0.01 -0.76 -0.04 0.00 0.02 0.00 0.00 34.13 33.35 1ikm s GLU 70 CO -0.05 -0.32 -0.26 -0.80 -1.84 0.00 0.00 175.26 171.99 1ikm s ASN 71 N -3.54 3.19 0.00 0.83 -0.87 -1.26 -5.21 114.94 108.08 1ikm s ASN 71 Ca 0.30 -0.75 0.00 0.00 -1.57 0.00 0.00 52.86 50.84 1ikm s ASN 71 Cb 0.06 -0.21 0.00 0.00 -0.02 0.00 0.00 41.25 41.08 1ikm s ASN 71 CO 0.14 0.15 0.45 -1.20 -2.57 0.00 0.00 177.10 174.08