#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 1.78 0.00 4.31 0.20 -1.26 -5.15 118.68 118.56 1ikm s LEU 5 Ca 0.00 -0.12 0.00 0.00 0.69 0.00 0.00 54.13 54.70 1ikm s LEU 5 Cb 0.00 -0.37 -0.00 0.00 -0.43 0.00 0.00 46.19 45.39 1ikm s LEU 5 CO 0.00 0.03 0.00 0.54 -0.29 0.00 0.00 176.35 176.64 1ikm n ARG 6 N 3.30 0.79 -2.31 1.98 1.74 -1.26 -4.28 116.66 116.61 1ikm n ARG 6 Ca -0.17 -0.02 -0.43 0.00 -0.77 0.00 0.00 57.85 56.45 1ikm n ARG 6 Cb 0.55 0.01 -0.02 0.00 -1.02 0.00 0.00 32.46 31.98 1ikm n ARG 6 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ikm h GLN 8 N 10.52 0.00 -4.16 0.00 4.15 -1.98 -3.39 115.11 120.25 1ikm h GLN 8 Ca -0.28 0.00 -0.59 0.00 0.77 0.00 0.00 58.65 58.55 1ikm h GLN 8 Cb 1.11 0.00 -0.39 0.00 0.21 0.00 0.00 27.48 28.42 1ikm h GLN 8 CO 1.06 0.09 -0.78 0.00 -1.93 0.00 0.00 178.83 177.27 1ikm h ILE 10 N 6.62 1.56 -1.69 0.00 5.03 -2.02 -3.46 117.51 123.55 1ikm h ILE 10 Ca -0.18 -2.72 -0.62 0.00 -0.12 0.00 0.00 64.86 61.23 1ikm h ILE 10 Cb 1.08 2.47 -0.12 0.00 -3.03 0.00 0.00 36.82 37.22 1ikm h ILE 10 CO 0.39 0.77 -0.59 -1.59 -0.68 0.00 0.00 178.15 176.45 1ikm s LYS 11 N -3.19 1.99 0.00 2.37 0.00 -1.26 -5.16 119.74 114.49 1ikm s LYS 11 Ca -0.00 -2.04 0.00 0.00 0.00 0.00 0.00 55.97 53.93 1ikm s LYS 11 Cb 0.11 -1.71 0.00 0.00 0.00 0.00 0.00 37.83 36.24 1ikm s LYS 11 CO 0.79 -0.03 0.00 0.25 0.00 0.00 0.00 175.35 176.35 1ikm n THR 12 N -0.99 0.00 -4.43 3.79 -2.24 -1.26 -4.65 114.28 104.49 1ikm n THR 12 Ca -0.04 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.40 1ikm n THR 12 Cb 0.66 0.00 -0.15 0.00 -2.10 0.00 0.00 70.33 68.75 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 -1.50 2.84 -0.21 4.78 5.04 0.35 -4.83 117.35 123.83 1ikm s TYR 13 Ca 0.00 -0.89 0.09 0.00 -2.44 0.00 0.00 57.07 53.83 1ikm s TYR 13 Cb 0.00 -1.93 -0.22 0.00 0.35 0.00 0.00 41.96 40.16 1ikm s TYR 13 CO 0.00 -0.40 0.02 0.43 -1.34 0.00 0.00 175.55 174.25 1ikm n SER 14 N 4.07 1.10 -4.75 4.32 7.64 -1.26 -2.45 113.62 122.29 1ikm n SER 14 Ca -0.19 -0.01 -0.41 0.00 1.01 0.00 0.00 58.87 59.28 1ikm n SER 14 Cb 0.52 0.15 -0.04 0.00 -1.01 0.00 0.00 64.21 63.83 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 -2.52 4.62 0.55 1.43 1.02 -1.26 -5.02 119.74 118.56 1ikm s LYS 15 Ca -0.21 1.76 -0.09 0.00 0.02 0.00 0.00 55.97 57.45 1ikm s LYS 15 Cb 0.07 -3.23 -0.04 0.00 -0.52 0.00 0.00 37.83 34.12 1ikm s LYS 15 CO 0.73 0.16 0.91 -1.25 -0.92 0.00 0.00 175.35 174.97 1ikm s PRO 16 N -0.96 3.60 0.12 -1.68 0.04 -1.26 -5.05 135.00 129.81 1ikm s PRO 16 Ca 0.47 0.51 -0.24 0.00 0.04 0.00 0.00 61.00 61.77 1ikm s PRO 16 Cb -0.31 -2.22 0.07 0.00 0.04 0.00 0.00 34.50 32.08 1ikm s PRO 16 CO 0.38 -0.37 0.63 -0.59 0.04 0.00 0.00 177.00 177.09 1ikm s PHE 17 N -2.93 -0.54 0.28 0.56 -0.71 -1.26 -5.14 117.98 108.23 1ikm s PHE 17 Ca 0.52 0.43 -0.29 0.00 -1.04 0.00 0.00 56.93 56.55 1ikm s PHE 17 Cb -0.11 0.54 -0.10 0.00 -1.21 0.00 0.00 43.02 42.14 1ikm s PHE 17 CO 0.48 -0.80 1.34 -1.58 -1.34 0.00 0.00 175.22 173.32 1ikm s HIS 18 N -3.35 3.11 0.04 3.49 5.65 -1.26 -4.97 115.29 118.01 1ikm s HIS 18 Ca -0.00 1.27 -0.16 0.00 0.25 0.00 0.00 55.06 56.42 1ikm s HIS 18 Cb -0.01 -3.69 -0.25 0.00 -1.18 0.00 0.00 32.58 27.46 1ikm s HIS 18 CO -0.10 -2.03 1.13 -1.00 -0.65 0.00 0.00 174.74 172.09 1ikm h PRO 19 N 4.31 0.59 -0.53 2.88 0.13 -1.97 -3.32 132.00 134.08 1ikm h PRO 19 Ca -0.47 -0.67 0.15 0.00 -0.87 0.00 0.00 66.00 64.14 1ikm h PRO 19 Cb 1.22 0.20 -0.02 0.00 0.13 0.00 0.00 31.00 32.53 1ikm h PRO 19 CO 0.72 1.27 0.57 -0.22 -0.23 0.00 0.00 178.00 180.10 1ikm h LYS 20 N 0.19 0.00 -0.89 0.86 3.64 -1.97 0.31 116.57 118.70 1ikm h LYS 20 Ca -0.13 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.24 1ikm h LYS 20 Cb 1.62 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.40 1ikm h LYS 20 CO 0.18 0.00 0.52 0.74 -2.27 0.00 0.00 179.45 178.62 1ikm h PHE 21 N 0.00 1.19 -2.44 1.91 0.04 -1.98 -3.41 116.94 112.24 1ikm h PHE 21 Ca 0.25 -0.01 -0.53 0.00 2.80 0.00 0.00 57.97 60.48 1ikm h PHE 21 Cb 1.38 -0.39 0.02 0.00 2.20 0.00 0.00 35.95 39.17 1ikm h PHE 21 CO 0.00 0.80 1.19 0.42 -0.60 0.00 0.00 178.31 180.12 1ikm s ILE 22 N -5.87 2.98 -0.07 -0.55 -1.09 0.11 -1.48 121.20 115.23 1ikm s ILE 22 Ca -0.12 0.11 0.14 0.00 -2.23 0.00 0.00 60.65 58.55 1ikm s ILE 22 Cb 0.17 -3.07 -0.10 0.00 -1.58 0.00 0.00 42.46 37.88 1ikm s ILE 22 CO 0.82 -0.01 1.11 0.50 -1.23 0.00 0.00 174.94 176.13 1ikm h LYS 23 N 10.03 0.00 -4.65 2.79 3.64 -1.09 -3.46 116.57 123.83 1ikm h LYS 23 Ca -0.48 0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 58.52 1ikm h LYS 23 Cb 1.23 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 32.93 1ikm h LYS 23 CO 0.94 0.53 -0.43 -1.21 -2.27 0.00 0.00 179.45 177.02 1ikm s GLU 24 N -2.85 1.71 0.00 1.90 2.02 -1.23 -4.99 118.70 115.26 1ikm s GLU 24 Ca 0.00 -1.89 0.00 0.00 0.02 0.00 0.00 54.97 53.10 1ikm s GLU 24 Cb 0.08 0.35 0.00 0.00 0.10 0.00 0.00 34.13 34.66 1ikm s GLU 24 CO 0.79 -0.65 0.00 -2.13 0.02 0.00 0.00 175.26 173.30 1ikm n ARG 26 N -0.55 0.00 -3.99 1.61 0.63 0.13 -1.31 116.66 113.17 1ikm n ARG 26 Ca 0.05 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.67 1ikm n ARG 26 Cb 0.63 0.00 -0.05 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 5.00 -0.13 5.15 -7.23 -1.26 -1.38 120.40 120.54 1ikm s VAL 27 Ca 0.00 -0.50 -0.03 0.00 -1.81 0.00 0.00 61.98 59.64 1ikm s VAL 27 Cb 0.00 -3.39 -0.03 0.00 0.56 0.00 0.00 36.38 33.52 1ikm s VAL 27 CO 0.00 0.19 -0.02 -0.63 -0.31 0.00 0.00 175.10 174.33 1ikm s ILE 28 N -1.40 4.11 1.11 -0.62 1.01 -0.56 -4.93 121.20 119.92 1ikm s ILE 28 Ca 0.30 -0.29 -0.19 0.00 0.00 0.00 0.00 60.65 60.47 1ikm s ILE 28 Cb -0.13 -2.78 0.27 0.00 0.01 0.00 0.00 42.46 39.84 1ikm s ILE 28 CO 0.23 0.53 1.00 -0.62 0.00 0.00 0.00 174.94 176.08 1ikm n GLU 29 N 3.00 -2.88 -4.02 2.79 1.02 -1.26 -3.09 120.64 116.20 1ikm n GLU 29 Ca -0.18 -1.60 -0.22 0.00 -0.02 0.00 0.00 57.16 55.14 1ikm n GLU 29 Cb 0.53 -1.48 -0.03 0.00 -0.02 0.00 0.00 31.44 30.44 1ikm n GLU 29 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1ikm s SER 30 N -4.24 6.02 0.00 1.62 1.04 -1.26 -4.66 113.70 112.22 1ikm s SER 30 Ca 0.65 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 57.04 1ikm s SER 30 Cb -0.06 -1.70 0.00 0.00 0.10 0.00 0.00 66.02 64.36 1ikm s SER 30 CO 0.49 -0.04 0.00 0.61 0.98 0.00 0.00 173.24 175.28 1ikm n GLY 31 N -1.21 -0.73 0.18 7.32 0.00 0.13 -4.94 105.19 105.93 1ikm n GLY 31 Ca -0.08 -0.38 -0.11 0.00 0.00 0.00 0.00 46.02 45.44 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 0.47 -0.50 1.61 0.13 -1.97 -2.67 132.00 129.07 1ikm h PRO 32 Ca 0.00 -0.39 0.01 0.00 -0.87 0.00 0.00 66.00 64.75 1ikm h PRO 32 Cb 0.00 0.08 -0.03 0.00 0.13 0.00 0.00 31.00 31.19 1ikm h PRO 32 CO 0.00 1.02 0.33 1.12 -0.23 0.00 0.00 178.00 180.25 1ikm h HIS 33 N 0.32 0.62 -0.84 1.56 2.07 -1.93 -3.41 115.15 113.54 1ikm h HIS 33 Ca -0.04 0.01 0.15 0.00 -2.85 0.00 0.00 60.37 57.65 1ikm h HIS 33 Cb 1.33 -0.21 -0.21 0.00 2.57 0.00 0.00 27.41 30.89 1ikm h HIS 33 CO 0.05 0.39 -0.08 0.00 -3.07 0.00 0.00 177.93 175.22 1ikm h ALA 35 N 7.96 1.33 -2.79 0.00 0.00 -1.73 0.40 119.26 124.43 1ikm h ALA 35 Ca -0.19 -0.24 -0.57 0.00 0.00 0.00 0.00 54.91 53.91 1ikm h ALA 35 Cb 1.16 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.76 1ikm h ALA 35 CO 0.11 0.45 -0.04 -0.80 0.00 0.00 0.00 179.25 178.98 1ikm s ASN 36 N -6.78 6.86 0.23 0.00 0.01 -1.26 -4.50 114.94 109.50 1ikm s ASN 36 Ca -0.07 1.03 -0.30 0.00 -0.71 0.00 0.00 52.86 52.82 1ikm s ASN 36 Cb 0.15 -2.34 -0.09 0.00 0.41 0.00 0.00 41.25 39.38 1ikm s ASN 36 CO 0.76 0.01 1.25 -0.89 -1.51 0.00 0.00 177.10 176.73 1ikm s THR 37 N 0.34 3.27 -0.09 1.60 2.01 -1.26 -4.78 115.64 116.73 1ikm s THR 37 Ca 0.31 1.11 0.02 0.00 0.31 0.00 0.00 61.69 63.43 1ikm s THR 37 Cb -0.17 -3.71 0.01 0.00 0.01 0.00 0.00 72.50 68.65 1ikm s THR 37 CO 0.15 0.20 -0.14 -1.83 -0.69 0.00 0.00 174.62 172.30 1ikm s GLU 38 N -0.59 2.03 0.49 4.92 -1.05 -1.18 -4.70 118.70 118.63 1ikm s GLU 38 Ca 0.53 -0.51 -0.09 0.00 -0.15 0.00 0.00 54.97 54.75 1ikm s GLU 38 Cb -0.35 -1.70 -0.05 0.00 -0.44 0.00 0.00 34.13 31.58 1ikm s GLU 38 CO 0.40 -0.02 0.86 0.42 0.95 0.00 0.00 175.26 177.88 1ikm s ILE 39 N 0.84 4.78 -0.09 1.83 1.09 -1.07 -1.50 121.20 127.08 1ikm s ILE 39 Ca -0.10 0.61 -0.05 0.00 -1.10 0.00 0.00 60.65 60.00 1ikm s ILE 39 Cb -0.15 -3.81 0.04 0.00 -1.06 0.00 0.00 42.46 37.48 1ikm s ILE 39 CO 0.01 -0.80 0.22 -0.63 -0.10 0.00 0.00 174.94 173.64 1ikm s ILE 40 N -2.72 -0.03 0.21 2.92 1.01 -0.48 -1.71 121.20 120.40 1ikm s ILE 40 Ca 0.52 0.13 0.02 0.00 0.00 0.00 0.00 60.65 61.31 1ikm s ILE 40 Cb -0.10 -0.34 -0.05 0.00 0.01 0.00 0.00 42.46 41.98 1ikm s ILE 40 CO 0.41 0.05 0.04 0.68 0.00 0.00 0.00 174.94 176.13 1ikm s VAL 41 N 1.02 0.64 -0.30 2.92 -7.23 -0.98 0.19 120.40 116.67 1ikm s VAL 41 Ca -0.07 -1.99 -0.02 0.00 -1.81 0.00 0.00 61.98 58.09 1ikm s VAL 41 Cb -0.09 -2.35 0.10 0.00 0.56 0.00 0.00 36.38 34.60 1ikm s VAL 41 CO -0.06 -0.27 0.10 -0.54 -0.31 0.00 0.00 175.10 174.02 1ikm s LYS 42 N -3.96 0.58 0.49 4.82 3.01 -0.43 -2.63 119.74 121.61 1ikm s LYS 42 Ca 0.30 -0.90 -0.23 0.00 -1.01 0.00 0.00 55.97 54.13 1ikm s LYS 42 Cb 0.07 -1.78 -0.08 0.00 -1.01 0.00 0.00 37.83 35.03 1ikm s LYS 42 CO 0.08 -0.98 1.21 1.28 0.51 0.00 0.00 175.35 177.45 1ikm n LEU 43 N 4.96 4.20 0.26 3.17 4.77 -0.46 -0.59 117.00 133.31 1ikm n LEU 43 Ca -0.03 1.01 0.17 0.00 -0.03 0.00 0.00 56.01 57.12 1ikm n LEU 43 Cb 0.42 -1.48 0.91 0.00 -2.33 0.00 0.00 43.42 40.94 1ikm n LEU 43 CO 0.10 -0.96 1.14 0.77 -1.33 0.00 0.00 177.39 177.11 1ikm h SER 44 N 1.55 0.00 0.04 -1.43 4.64 -1.59 -0.01 113.55 116.74 1ikm h SER 44 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1ikm h SER 44 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1ikm h SER 44 CO 0.57 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 177.00 1ikm n ASP 45 N -3.68 0.00 -0.11 4.97 9.92 -1.26 -4.81 116.55 121.58 1ikm n ASP 45 Ca -0.01 -0.61 0.00 0.00 -0.53 0.00 0.00 54.79 53.64 1ikm n ASP 45 Cb 0.22 -0.03 0.00 0.00 -0.64 0.00 0.00 41.12 40.67 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 0.36 1.13 3.71 0.44 0.00 -0.03 -5.09 105.19 105.70 1ikm n GLY 46 Ca 0.16 -0.35 -0.23 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.28 2.51 -0.13 1.61 6.06 -1.12 -4.95 118.95 120.65 1ikm s ARG 47 Ca 0.00 -1.29 -0.01 0.00 -2.50 0.00 0.00 55.73 51.93 1ikm s ARG 47 Cb 0.00 -2.30 0.03 0.00 0.06 0.00 0.00 34.95 32.74 1ikm s ARG 47 CO 0.00 0.38 -0.06 -2.00 -2.50 0.00 0.00 175.30 171.12 1ikm s GLU 48 N -3.73 1.40 -0.06 5.12 2.12 -1.26 -1.35 118.70 120.94 1ikm s GLU 48 Ca 0.32 -0.32 -0.01 0.00 0.36 0.00 0.00 54.97 55.32 1ikm s GLU 48 Cb -0.07 -1.70 0.03 0.00 0.26 0.00 0.00 34.13 32.65 1ikm s GLU 48 CO 0.22 -0.34 -0.02 -0.51 -0.54 0.00 0.00 175.26 174.07 1ikm s LEU 49 N 1.71 0.86 0.02 2.70 1.02 -1.08 -5.01 118.68 118.90 1ikm s LEU 49 Ca 0.03 -0.11 -0.25 0.00 0.02 0.00 0.00 54.13 53.83 1ikm s LEU 49 Cb -0.14 -0.46 -0.05 0.00 0.02 0.00 0.00 46.19 45.56 1ikm s LEU 49 CO -0.08 -0.15 0.76 0.00 0.02 0.00 0.00 176.35 176.91 1ikm s LEU 51 N 0.15 4.14 -0.28 0.00 1.43 -0.70 0.13 118.68 123.56 1ikm s LEU 51 Ca 0.39 0.52 -0.10 0.00 -1.03 0.00 0.00 54.13 53.91 1ikm s LEU 51 Cb -0.20 -3.32 -0.03 0.00 0.03 0.00 0.00 46.19 42.67 1ikm s LEU 51 CO 0.22 -0.13 0.15 -0.62 0.23 0.00 0.00 176.35 176.20 1ikm s ASP 52 N -3.26 5.63 0.00 2.29 -1.08 -1.02 -2.60 116.67 116.63 1ikm s ASP 52 Ca 0.41 -0.20 0.15 0.00 -0.52 0.00 0.00 52.55 52.39 1ikm s ASP 52 Cb -0.11 -2.03 0.73 0.00 -1.46 0.00 0.00 42.92 40.06 1ikm s ASP 52 CO 0.30 -0.08 1.45 -0.81 0.52 0.00 0.00 175.17 176.54 1ikm n PRO 53 N 5.00 0.15 0.25 4.34 -0.04 -1.26 -2.93 135.00 140.51 1ikm n PRO 53 Ca -0.15 0.17 0.09 0.00 -0.04 0.00 0.00 63.50 63.58 1ikm n PRO 53 Cb 0.51 -1.50 0.64 0.00 -0.04 0.00 0.00 33.50 33.12 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 -7.30 0.54 1.57 -1.95 -3.43 116.57 106.00 1ikm h LYS 54 Ca 0.00 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.32 1ikm h LYS 54 Cb 0.18 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.58 1ikm h LYS 54 CO 0.00 0.11 0.21 -1.21 -0.57 0.00 0.00 179.45 177.99 1ikm s GLU 55 N -4.59 1.98 0.04 3.15 0.41 -1.15 -5.00 118.70 113.54 1ikm s GLU 55 Ca -0.04 -0.43 0.22 0.00 -0.41 0.00 0.00 54.97 54.31 1ikm s GLU 55 Cb 0.15 -2.18 -0.12 0.00 -1.78 0.00 0.00 34.13 30.20 1ikm s GLU 55 CO 0.64 -1.36 0.83 0.09 -0.49 0.00 0.00 175.26 174.98 1ikm n ASN 56 N -2.96 0.49 0.11 -0.19 3.02 -1.26 -4.00 115.26 110.47 1ikm n ASN 56 Ca 0.10 -0.15 -0.19 0.00 -0.03 0.00 0.00 54.58 54.31 1ikm n ASN 56 Cb 0.60 1.17 -0.12 0.00 -0.61 0.00 0.00 39.78 40.82 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 0.77 -0.45 3.10 5.08 -1.94 -1.43 115.95 121.08 1ikm h TRP 57 Ca 0.00 -0.51 -0.06 0.00 1.08 0.00 0.00 58.89 59.40 1ikm h TRP 57 Cb 0.83 -0.05 -0.02 0.00 -3.00 0.00 0.00 29.16 26.93 1ikm h TRP 57 CO 0.00 1.38 0.05 0.28 -1.28 0.00 0.00 178.44 178.86 1ikm h VAL 58 N 0.17 1.25 -0.01 0.12 2.07 -1.81 0.80 116.25 118.84 1ikm h VAL 58 Ca -0.17 -0.95 -0.14 0.00 0.82 0.00 0.00 66.70 66.26 1ikm h VAL 58 Cb 1.94 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 32.69 1ikm h VAL 58 CO 0.22 0.33 -0.67 0.06 0.02 0.00 0.00 177.57 177.53 1ikm h GLN 59 N 0.61 0.05 0.20 1.57 3.07 -1.69 -1.01 115.11 117.91 1ikm h GLN 59 Ca 0.13 -0.04 -0.31 0.00 0.09 0.00 0.00 58.65 58.52 1ikm h GLN 59 Cb 0.42 0.01 0.03 0.00 0.08 0.00 0.00 27.48 28.02 1ikm h GLN 59 CO 0.01 0.70 -1.34 0.00 0.09 0.00 0.00 178.83 178.30 1ikm h ARG 60 N 0.04 0.55 -0.80 0.06 2.47 -1.01 -2.69 114.38 113.00 1ikm h ARG 60 Ca -0.01 -0.86 -0.04 0.00 -1.26 0.00 0.00 59.98 57.81 1ikm h ARG 60 Cb 1.19 0.31 -0.04 0.00 -1.65 0.00 0.00 29.97 29.78 1ikm h ARG 60 CO 0.09 1.40 0.34 0.28 0.56 0.00 0.00 179.97 182.64 1ikm h VAL 61 N 0.14 1.26 -0.52 2.04 2.07 0.65 -0.52 116.25 121.37 1ikm h VAL 61 Ca -0.22 -0.79 -0.05 0.00 0.82 0.00 0.00 66.70 66.45 1ikm h VAL 61 Cb 2.03 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 1ikm h VAL 61 CO 0.25 0.33 0.12 0.58 0.02 0.00 0.00 177.57 178.87 1ikm h VAL 62 N 1.16 1.24 -0.22 2.57 2.07 -1.22 -0.68 116.25 121.17 1ikm h VAL 62 Ca 0.27 -0.87 -0.02 0.00 0.82 0.00 0.00 66.70 66.90 1ikm h VAL 62 Cb 0.19 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1ikm h VAL 62 CO -0.03 0.31 0.06 -0.33 0.02 0.00 0.00 177.57 177.61 1ikm h GLU 63 N 0.72 0.35 -0.76 1.57 4.39 -1.10 0.49 114.58 120.25 1ikm h GLU 63 Ca 0.16 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 1ikm h GLU 63 Cb 0.34 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.91 1ikm h GLU 63 CO 0.00 0.45 0.43 -0.22 -1.16 0.00 0.00 179.01 178.52 1ikm h LYS 64 N 0.18 1.04 -0.00 2.33 3.11 -0.98 0.17 116.57 122.42 1ikm h LYS 64 Ca 0.07 -0.10 -0.14 0.00 -2.81 0.00 0.00 60.65 57.67 1ikm h LYS 64 Cb 0.26 -0.21 0.01 0.00 -1.00 0.00 0.00 32.23 31.29 1ikm h LYS 64 CO -0.00 0.74 -0.55 0.35 -2.81 0.00 0.00 179.45 177.19 1ikm h PHE 65 N 1.05 0.55 -0.65 1.91 3.57 -0.87 -3.30 116.94 119.20 1ikm h PHE 65 Ca 0.27 -0.30 -0.06 0.00 3.53 0.00 0.00 57.97 61.41 1ikm h PHE 65 Cb -0.00 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 1ikm h PHE 65 CO 0.01 1.12 0.16 -0.07 -2.23 0.00 0.00 178.31 177.29 1ikm h LEU 66 N -0.17 1.00 -9.83 0.59 3.38 0.20 -3.44 115.31 107.03 1ikm h LEU 66 Ca -0.07 -0.23 -0.54 0.00 0.09 0.00 0.00 57.88 57.12 1ikm h LEU 66 Cb 1.27 -0.26 0.20 0.00 0.09 0.00 0.00 40.66 41.95 1ikm h LEU 66 CO 0.11 0.97 -0.30 1.17 0.09 0.00 0.00 178.44 180.48 1ikm n LYS 67 N -4.29 0.05 -0.21 1.13 4.81 0.59 -4.71 118.16 115.52 1ikm n LYS 67 Ca 0.04 0.07 0.03 0.00 -0.87 0.00 0.00 58.31 57.58 1ikm n LYS 67 Cb 0.25 -1.98 -0.01 0.00 0.02 0.00 0.00 35.03 33.32 1ikm n LYS 67 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1ikm n ARG 68 N -1.69 -0.42 0.09 1.64 3.00 -1.26 -4.96 116.66 113.05 1ikm n ARG 68 Ca 0.10 0.28 0.00 0.00 -0.01 0.00 0.00 57.85 58.22 1ikm n ARG 68 Cb 0.51 -0.52 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1ikm n ARG 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ikm n ALA 69 N -0.46 2.75 -0.02 7.54 0.00 -1.26 -4.94 120.51 124.12 1ikm n ALA 69 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 1ikm n ALA 69 Cb 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.42 1ikm n ALA 69 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1ikm h GLU 70 N 0.00 0.14 0.00 0.00 4.39 -1.99 -3.47 114.58 113.66 1ikm h GLU 70 Ca 0.00 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.50 1ikm h GLU 70 Cb 0.00 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1ikm h GLU 70 CO 0.00 1.03 0.00 -1.71 -1.16 0.00 0.00 179.01 177.17 1ikm n ASN 71 N -4.45 0.00 -0.84 1.42 2.85 -1.26 -5.27 115.26 107.71 1ikm n ASN 71 Ca -0.11 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.49 1ikm n ASN 71 Cb 0.58 0.00 0.21 0.00 1.24 0.00 0.00 39.78 41.80 1ikm n ASN 71 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61