#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 1.72 -4.83 -4.62 -0.00 -1.26 -5.09 117.00 102.92 1ikm n LEU 5 Ca 0.00 -3.14 -0.28 0.00 -0.00 0.00 0.00 56.01 52.60 1ikm n LEU 5 Cb 0.00 0.44 -0.05 0.00 -0.00 0.00 0.00 43.42 43.81 1ikm n LEU 5 CO 0.00 1.11 -0.20 -0.13 -0.00 0.00 0.00 177.39 178.16 1ikm s ARG 6 N -3.76 3.03 -0.52 1.47 0.52 -1.26 -4.14 118.95 114.29 1ikm s ARG 6 Ca 0.28 -0.74 -0.27 0.00 -0.52 0.00 0.00 55.73 54.48 1ikm s ARG 6 Cb 0.33 -2.76 -0.02 0.00 0.52 0.00 0.00 34.95 33.03 1ikm s ARG 6 CO -0.03 0.52 1.80 0.00 0.02 0.00 0.00 175.30 177.61 1ikm n GLN 8 N 8.89 0.19 -3.87 0.00 10.64 -1.26 -4.44 117.38 127.53 1ikm n GLN 8 Ca 0.21 0.41 -0.35 0.00 -1.83 0.00 0.00 57.00 55.44 1ikm n GLN 8 Cb 0.50 -1.87 -0.13 0.00 -0.86 0.00 0.00 30.24 27.89 1ikm n GLN 8 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ikm h ILE 10 N 6.44 1.49 -3.10 0.00 5.03 -2.02 -3.46 117.51 121.89 1ikm h ILE 10 Ca -0.18 -2.44 -0.47 0.00 -0.12 0.00 0.00 64.86 61.65 1ikm h ILE 10 Cb 1.06 2.32 -0.14 0.00 -3.03 0.00 0.00 36.82 37.03 1ikm h ILE 10 CO 0.58 0.70 -0.57 -0.54 -0.68 0.00 0.00 178.15 177.64 1ikm s LYS 11 N -3.38 1.70 0.00 2.37 1.02 -1.26 -5.18 119.74 115.01 1ikm s LYS 11 Ca -0.02 -1.98 0.00 0.00 0.02 0.00 0.00 55.97 53.99 1ikm s LYS 11 Cb 0.11 -0.55 0.00 0.00 -0.52 0.00 0.00 37.83 36.87 1ikm s LYS 11 CO 0.79 -0.35 0.00 0.25 -0.92 0.00 0.00 175.35 175.12 1ikm n THR 12 N -0.71 0.00 -4.32 2.17 -2.24 -1.26 -4.67 114.28 103.25 1ikm n THR 12 Ca -0.03 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.41 1ikm n THR 12 Cb 0.66 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.76 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 -1.20 3.00 -0.22 4.78 5.04 0.30 -4.85 117.35 124.21 1ikm s TYR 13 Ca 0.00 -0.42 0.10 0.00 -2.44 0.00 0.00 57.07 54.31 1ikm s TYR 13 Cb 0.00 -1.99 -0.20 0.00 0.35 0.00 0.00 41.96 40.12 1ikm s TYR 13 CO 0.00 -0.14 -0.06 -1.13 -1.34 0.00 0.00 175.55 172.87 1ikm n SER 14 N 3.80 1.08 -4.75 4.32 3.41 -1.26 -2.49 113.62 117.73 1ikm n SER 14 Ca -0.17 -0.06 -0.40 0.00 -0.26 0.00 0.00 58.87 57.97 1ikm n SER 14 Cb 0.52 0.35 -0.05 0.00 -0.26 0.00 0.00 64.21 64.77 1ikm n SER 14 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1ikm s LYS 15 N -2.48 4.70 0.57 4.33 1.02 -1.26 -5.03 119.74 121.60 1ikm s LYS 15 Ca -0.20 1.67 -0.08 0.00 0.02 0.00 0.00 55.97 57.37 1ikm s LYS 15 Cb 0.07 -3.24 -0.03 0.00 -0.52 0.00 0.00 37.83 34.11 1ikm s LYS 15 CO 0.69 0.29 0.93 -1.25 -0.92 0.00 0.00 175.35 175.09 1ikm s PRO 16 N -1.11 3.47 0.17 -1.68 0.04 -1.26 -5.06 135.00 129.57 1ikm s PRO 16 Ca 0.44 0.46 -0.22 0.00 0.04 0.00 0.00 61.00 61.72 1ikm s PRO 16 Cb -0.29 -2.20 0.06 0.00 0.04 0.00 0.00 34.50 32.11 1ikm s PRO 16 CO 0.37 -0.47 0.60 -0.59 0.04 0.00 0.00 177.00 176.94 1ikm s PHE 17 N -3.01 -0.49 0.30 0.56 -0.71 -1.26 -5.15 117.98 108.22 1ikm s PHE 17 Ca 0.52 0.25 -0.29 0.00 -1.04 0.00 0.00 56.93 56.37 1ikm s PHE 17 Cb -0.11 0.55 -0.10 0.00 -1.21 0.00 0.00 43.02 42.16 1ikm s PHE 17 CO 0.50 -0.87 1.28 -1.58 -1.34 0.00 0.00 175.22 173.20 1ikm s HIS 18 N -3.77 3.18 0.03 3.49 5.65 -1.26 -4.97 115.29 117.63 1ikm s HIS 18 Ca 0.02 1.42 -0.18 0.00 0.25 0.00 0.00 55.06 56.57 1ikm s HIS 18 Cb -0.01 -3.60 -0.25 0.00 -1.18 0.00 0.00 32.58 27.53 1ikm s HIS 18 CO -0.11 -1.67 1.10 -1.00 -0.65 0.00 0.00 174.74 172.41 1ikm h PRO 19 N 3.86 0.52 -0.34 2.88 0.13 -1.98 -3.32 132.00 133.76 1ikm h PRO 19 Ca -0.48 -0.61 0.10 0.00 -0.87 0.00 0.00 66.00 64.14 1ikm h PRO 19 Cb 1.22 0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.52 1ikm h PRO 19 CO 0.68 1.23 0.47 -0.22 -0.23 0.00 0.00 178.00 179.93 1ikm h LYS 20 N 0.08 0.00 -0.68 0.86 1.63 -1.97 0.31 116.57 116.80 1ikm h LYS 20 Ca -0.12 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.67 1ikm h LYS 20 Cb 1.56 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 33.16 1ikm h LYS 20 CO 0.17 0.00 0.36 0.74 -3.45 0.00 0.00 179.45 177.27 1ikm h PHE 21 N 0.00 0.93 -2.33 1.91 0.04 -1.98 -3.41 116.94 112.10 1ikm h PHE 21 Ca 0.16 -0.02 -0.55 0.00 2.80 0.00 0.00 57.97 60.36 1ikm h PHE 21 Cb 1.10 -0.30 0.01 0.00 2.20 0.00 0.00 35.95 38.95 1ikm h PHE 21 CO 0.00 0.65 1.28 0.42 -0.60 0.00 0.00 178.31 180.07 1ikm s ILE 22 N -5.62 3.12 -0.04 -0.55 1.01 0.11 -1.37 121.20 117.86 1ikm s ILE 22 Ca -0.11 0.14 0.12 0.00 0.00 0.00 0.00 60.65 60.80 1ikm s ILE 22 Cb 0.17 -3.11 -0.08 0.00 0.01 0.00 0.00 42.46 39.45 1ikm s ILE 22 CO 0.79 -0.03 1.28 0.50 0.00 0.00 0.00 174.94 177.47 1ikm h LYS 23 N 11.69 0.00 -4.50 2.79 3.64 -1.03 -3.46 116.57 125.70 1ikm h LYS 23 Ca -0.45 0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 58.55 1ikm h LYS 23 Cb 1.23 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 32.94 1ikm h LYS 23 CO 0.95 0.67 -0.32 -1.21 -2.27 0.00 0.00 179.45 177.28 1ikm s GLU 24 N -2.84 1.89 0.00 1.90 2.02 -1.21 -4.99 118.70 115.46 1ikm s GLU 24 Ca 0.02 -1.92 0.00 0.00 0.02 0.00 0.00 54.97 53.09 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 -0.75 0.00 0.54 0.02 0.00 0.00 175.26 175.86 1ikm n ARG 26 N -0.61 0.00 -3.88 1.61 1.74 0.13 -1.46 116.66 114.18 1ikm n ARG 26 Ca 0.04 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.81 1ikm n ARG 26 Cb 0.62 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 32.02 1ikm n ARG 26 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1ikm s VAL 27 N 0.00 5.36 -0.14 1.55 -7.23 -1.26 -1.43 120.40 117.25 1ikm s VAL 27 Ca 0.00 -0.32 0.01 0.00 -1.81 0.00 0.00 61.98 59.86 1ikm s VAL 27 Cb 0.00 -3.63 -0.00 0.00 0.56 0.00 0.00 36.38 33.31 1ikm s VAL 27 CO 0.00 0.13 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.12 1ikm s ILE 28 N -1.53 2.56 0.60 -0.62 1.01 -0.25 -4.92 121.20 118.06 1ikm s ILE 28 Ca 0.36 -0.81 -0.10 0.00 0.00 0.00 0.00 60.65 60.09 1ikm s ILE 28 Cb -0.13 -2.07 0.15 0.00 0.01 0.00 0.00 42.46 40.42 1ikm s ILE 28 CO 0.27 0.52 0.52 -1.84 0.00 0.00 0.00 174.94 174.42 1ikm n GLU 29 N 3.95 -2.11 -3.53 2.79 0.28 -1.26 -2.31 120.64 118.45 1ikm n GLU 29 Ca -0.19 -0.84 -0.23 0.00 -0.16 0.00 0.00 57.16 55.74 1ikm n GLU 29 Cb 0.52 -0.79 -0.01 0.00 1.43 0.00 0.00 31.44 32.58 1ikm n GLU 29 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1ikm s SER 30 N -2.91 6.30 0.00 -1.84 1.04 -1.26 -4.59 113.70 110.45 1ikm s SER 30 Ca 0.34 0.36 0.00 0.00 0.48 0.00 0.00 55.95 57.13 1ikm s SER 30 Cb -0.03 -1.99 0.00 0.00 0.10 0.00 0.00 66.02 64.10 1ikm s SER 30 CO 0.26 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.86 1ikm n GLY 31 N -1.67 -0.67 0.17 7.32 0.00 -0.08 -4.96 105.19 105.29 1ikm n GLY 31 Ca -0.06 -0.46 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 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 0.39 -0.61 1.61 0.13 -1.97 -3.06 132.00 128.49 1ikm h PRO 32 Ca 0.00 -0.34 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1ikm h PRO 32 Cb 0.00 0.08 -0.03 0.00 0.13 0.00 0.00 31.00 31.18 1ikm h PRO 32 CO 0.00 0.98 0.39 1.12 -0.23 0.00 0.00 178.00 180.27 1ikm h HIS 33 N 0.26 0.77 -1.99 1.56 2.07 -1.95 -3.42 115.15 112.46 1ikm h HIS 33 Ca -0.04 0.01 0.06 0.00 -2.85 0.00 0.00 60.37 57.55 1ikm h HIS 33 Cb 1.35 -0.26 -0.21 0.00 2.57 0.00 0.00 27.41 30.86 1ikm h HIS 33 CO 0.04 0.50 -0.17 0.00 -3.07 0.00 0.00 177.93 175.23 1ikm h ALA 35 N 8.02 0.95 -2.67 0.00 0.00 -1.80 -0.19 119.26 123.57 1ikm h ALA 35 Ca -0.18 -0.20 -0.57 0.00 0.00 0.00 0.00 54.91 53.96 1ikm h ALA 35 Cb 1.11 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 1ikm h ALA 35 CO 0.12 0.60 -0.03 -0.80 0.00 0.00 0.00 179.25 179.13 1ikm s ASN 36 N -6.31 7.03 0.41 0.00 0.01 -1.26 -4.48 114.94 110.34 1ikm s ASN 36 Ca -0.12 1.25 -0.23 0.00 -0.71 0.00 0.00 52.86 53.04 1ikm s ASN 36 Cb 0.15 -2.35 -0.09 0.00 0.41 0.00 0.00 41.25 39.37 1ikm s ASN 36 CO 0.83 0.23 1.05 -0.89 -1.51 0.00 0.00 177.10 176.81 1ikm s THR 37 N -1.20 3.71 -0.03 1.60 2.01 -1.26 -4.71 115.64 115.76 1ikm s THR 37 Ca 0.31 1.27 -0.01 0.00 0.31 0.00 0.00 61.69 63.57 1ikm s THR 37 Cb -0.19 -3.63 0.02 0.00 0.01 0.00 0.00 72.50 68.71 1ikm s THR 37 CO 0.19 -0.03 0.07 -0.70 -0.69 0.00 0.00 174.62 173.46 1ikm s GLU 38 N -2.62 0.03 0.41 4.92 2.56 -0.98 -4.80 118.70 118.23 1ikm s GLU 38 Ca 0.59 0.20 -0.05 0.00 0.00 0.00 0.00 54.97 55.71 1ikm s GLU 38 Cb -0.21 -0.13 -0.04 0.00 2.00 0.00 0.00 34.13 35.74 1ikm s GLU 38 CO 0.27 -0.11 0.71 0.42 -0.56 0.00 0.00 175.26 175.98 1ikm s ILE 39 N 0.73 4.94 -0.09 -3.70 1.09 -1.10 -1.09 121.20 121.97 1ikm s ILE 39 Ca -0.06 0.15 -0.05 0.00 -1.10 0.00 0.00 60.65 59.58 1ikm s ILE 39 Cb -0.08 -3.82 0.04 0.00 -1.06 0.00 0.00 42.46 37.54 1ikm s ILE 39 CO -0.03 -0.66 0.22 -0.63 -0.10 0.00 0.00 174.94 173.75 1ikm s ILE 40 N -2.50 -0.03 0.18 2.92 1.01 -0.51 -1.79 121.20 120.48 1ikm s ILE 40 Ca 0.46 0.11 0.02 0.00 0.00 0.00 0.00 60.65 61.25 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 0.38 0.05 -0.01 0.68 0.00 0.00 0.00 174.94 176.04 1ikm s VAL 41 N 0.95 0.79 -0.30 2.92 -7.23 -0.98 0.19 120.40 116.74 1ikm s VAL 41 Ca -0.07 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.09 1ikm s VAL 41 Cb -0.08 -2.13 0.10 0.00 0.56 0.00 0.00 36.38 34.83 1ikm s VAL 41 CO -0.06 -0.48 0.11 -0.54 -0.31 0.00 0.00 175.10 173.82 1ikm s LYS 42 N -3.89 0.54 0.43 4.82 1.02 -0.54 -2.48 119.74 119.65 1ikm s LYS 42 Ca 0.24 -0.89 -0.25 0.00 0.02 0.00 0.00 55.97 55.08 1ikm s LYS 42 Cb 0.06 -1.71 -0.09 0.00 -0.52 0.00 0.00 37.83 35.56 1ikm s LYS 42 CO 0.04 -1.00 1.28 1.28 -0.92 0.00 0.00 175.35 176.03 1ikm n LEU 43 N 4.98 4.13 0.24 3.17 4.77 -0.39 -0.50 117.00 133.40 1ikm n LEU 43 Ca -0.03 1.10 0.14 0.00 -0.03 0.00 0.00 56.01 57.19 1ikm n LEU 43 Cb 0.42 -1.51 0.80 0.00 -2.33 0.00 0.00 43.42 40.80 1ikm n LEU 43 CO 0.09 -0.63 1.12 0.28 -1.33 0.00 0.00 177.39 176.92 1ikm h SER 44 N 2.06 0.00 0.35 -1.43 0.02 -1.55 0.21 113.55 113.21 1ikm h SER 44 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 1ikm h SER 44 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1ikm h SER 44 CO 0.60 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.76 1ikm n ASP 45 N -4.06 0.28 0.00 3.07 8.00 -1.26 -4.79 116.55 117.78 1ikm n ASP 45 Ca -0.01 0.59 0.00 0.00 0.71 0.00 0.00 54.79 56.09 1ikm n ASP 45 Cb 0.20 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 40.66 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 -0.59 1.76 3.74 0.44 0.00 0.04 -5.12 105.19 105.47 1ikm n GLY 46 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.63 2.43 -0.08 1.61 3.52 -1.10 -4.95 118.95 119.76 1ikm s ARG 47 Ca 0.00 -1.50 -0.02 0.00 -0.13 0.00 0.00 55.73 54.08 1ikm s ARG 47 Cb 0.00 -2.22 0.04 0.00 -1.56 0.00 0.00 34.95 31.20 1ikm s ARG 47 CO 0.00 0.13 0.05 -2.00 -0.81 0.00 0.00 175.30 172.67 1ikm s GLU 48 N -3.85 0.15 -0.06 5.12 2.12 -1.26 -1.26 118.70 119.65 1ikm s GLU 48 Ca 0.38 0.19 0.00 0.00 0.36 0.00 0.00 54.97 55.90 1ikm s GLU 48 Cb -0.03 -0.94 0.02 0.00 0.26 0.00 0.00 34.13 33.44 1ikm s GLU 48 CO 0.23 -0.40 -0.04 -0.51 -0.54 0.00 0.00 175.26 174.00 1ikm s LEU 49 N 2.10 1.13 0.04 2.70 1.02 -1.03 -5.00 118.68 119.63 1ikm s LEU 49 Ca 0.04 -0.16 -0.24 0.00 0.02 0.00 0.00 54.13 53.79 1ikm s LEU 49 Cb -0.13 -0.54 -0.05 0.00 0.02 0.00 0.00 46.19 45.49 1ikm s LEU 49 CO -0.05 -0.10 0.73 0.00 0.02 0.00 0.00 176.35 176.96 1ikm s LEU 51 N -0.10 4.16 -0.28 0.00 1.43 -0.74 0.11 118.68 123.27 1ikm s LEU 51 Ca 0.37 0.49 -0.10 0.00 -1.03 0.00 0.00 54.13 53.86 1ikm s LEU 51 Cb -0.20 -3.28 -0.04 0.00 0.03 0.00 0.00 46.19 42.70 1ikm s LEU 51 CO 0.22 -0.11 0.16 -0.62 0.23 0.00 0.00 176.35 176.23 1ikm s ASP 52 N -3.23 5.78 0.00 2.29 -1.08 -1.04 -2.71 116.67 116.67 1ikm s ASP 52 Ca 0.40 -0.10 0.14 0.00 -0.52 0.00 0.00 52.55 52.47 1ikm s ASP 52 Cb -0.11 -2.07 0.64 0.00 -1.46 0.00 0.00 42.92 39.93 1ikm s ASP 52 CO 0.30 -0.06 1.43 -0.81 0.52 0.00 0.00 175.17 176.55 1ikm n PRO 53 N 5.03 0.07 0.22 4.34 -0.04 -1.26 -2.90 135.00 140.46 1ikm n PRO 53 Ca -0.14 0.22 0.07 0.00 -0.04 0.00 0.00 63.50 63.60 1ikm n PRO 53 Cb 0.52 -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 0.05 -7.29 0.54 1.57 -1.95 -3.43 116.57 106.06 1ikm h LYS 54 Ca 0.00 -0.01 -0.48 0.00 -1.87 0.00 0.00 60.65 58.30 1ikm h LYS 54 Cb 0.21 -0.01 0.07 0.00 0.08 0.00 0.00 32.23 32.57 1ikm h LYS 54 CO 0.00 0.10 0.28 -1.21 -0.57 0.00 0.00 179.45 178.05 1ikm s GLU 55 N -4.95 2.74 0.09 3.15 8.01 -1.14 -4.98 118.70 121.62 1ikm s GLU 55 Ca -0.05 0.12 0.23 0.00 0.01 0.00 0.00 54.97 55.28 1ikm s GLU 55 Cb 0.17 -2.16 0.08 0.00 -4.31 0.00 0.00 34.13 27.91 1ikm s GLU 55 CO 0.69 -0.94 1.06 0.09 0.01 0.00 0.00 175.26 176.17 1ikm n ASN 56 N -2.81 0.63 0.13 -0.19 4.13 -1.26 -3.85 115.26 112.03 1ikm n ASN 56 Ca 0.06 -0.03 -0.21 0.00 1.68 0.00 0.00 54.58 56.07 1ikm n ASN 56 Cb 0.58 0.67 -0.15 0.00 -1.54 0.00 0.00 39.78 39.34 1ikm n ASN 56 CO 0.00 0.00 0.00 4.11 0.28 0.00 0.00 177.26 181.65 1ikm h TRP 57 N 0.00 0.79 -0.55 3.10 5.08 -1.93 -1.54 115.95 120.89 1ikm h TRP 57 Ca 0.00 -0.58 -0.05 0.00 1.08 0.00 0.00 58.89 59.35 1ikm h TRP 57 Cb 0.80 -0.03 -0.02 0.00 -3.00 0.00 0.00 29.16 26.90 1ikm h TRP 57 CO 0.00 1.47 0.15 0.28 -1.28 0.00 0.00 178.44 179.06 1ikm h VAL 58 N 0.12 1.24 0.00 0.12 2.07 -1.81 0.92 116.25 118.91 1ikm h VAL 58 Ca -0.22 -0.84 -0.13 0.00 0.82 0.00 0.00 66.70 66.33 1ikm h VAL 58 Cb 2.10 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 32.59 1ikm h VAL 58 CO 0.24 0.31 -0.60 0.06 0.02 0.00 0.00 177.57 177.60 1ikm h GLN 59 N 0.77 0.00 0.18 1.57 3.07 -1.67 -1.95 115.11 117.09 1ikm h GLN 59 Ca 0.18 0.00 -0.32 0.00 0.09 0.00 0.00 58.65 58.60 1ikm h GLN 59 Cb 0.31 0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.89 1ikm h GLN 59 CO -0.00 0.60 -1.50 0.00 0.09 0.00 0.00 178.83 178.03 1ikm h ARG 60 N 0.00 0.38 -0.76 0.06 3.08 -0.91 -2.53 114.38 113.69 1ikm h ARG 60 Ca -0.01 -0.65 -0.05 0.00 0.07 0.00 0.00 59.98 59.34 1ikm h ARG 60 Cb 1.19 0.24 -0.03 0.00 0.08 0.00 0.00 29.97 31.45 1ikm h ARG 60 CO 0.08 1.29 0.26 0.28 -1.07 0.00 0.00 179.97 180.81 1ikm h VAL 61 N 0.10 1.26 -0.31 2.04 2.07 0.89 0.24 116.25 122.54 1ikm h VAL 61 Ca -0.24 -0.88 -0.13 0.00 0.82 0.00 0.00 66.70 66.27 1ikm h VAL 61 Cb 2.08 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 32.23 1ikm h VAL 61 CO 0.21 0.35 -0.30 0.58 0.02 0.00 0.00 177.57 178.43 1ikm h VAL 62 N 1.12 1.29 -0.50 2.57 2.07 -1.42 -1.73 116.25 119.65 1ikm h VAL 62 Ca 0.25 -1.47 -0.09 0.00 0.82 0.00 0.00 66.70 66.21 1ikm h VAL 62 Cb 0.27 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 1ikm h VAL 62 CO -0.01 0.48 -0.06 -0.08 0.02 0.00 0.00 177.57 177.91 1ikm h GLU 63 N 0.52 0.89 0.00 1.57 4.22 -1.13 -1.53 114.58 119.12 1ikm h GLU 63 Ca 0.05 -0.29 0.00 0.00 0.08 0.00 0.00 59.36 59.20 1ikm h GLU 63 Cb 0.87 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1ikm h GLU 63 CO 0.08 0.93 0.00 1.17 -2.18 0.00 0.00 179.01 179.00 1ikm n LYS 64 N -4.17 0.03 -0.04 1.92 4.81 0.81 0.26 118.16 121.78 1ikm n LYS 64 Ca 0.02 0.13 -0.21 0.00 -0.87 0.00 0.00 58.31 57.38 1ikm n LYS 64 Cb 0.36 -1.55 -0.13 0.00 0.02 0.00 0.00 35.03 33.73 1ikm n LYS 64 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1ikm n PHE 65 N -1.61 0.92 -0.12 5.64 7.35 -0.66 -4.60 117.46 124.40 1ikm n PHE 65 Ca 0.05 0.22 -0.15 0.00 -0.76 0.00 0.00 57.45 56.82 1ikm n PHE 65 Cb 0.28 -1.12 -0.14 0.00 0.35 0.00 0.00 39.48 38.86 1ikm n PHE 65 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1ikm n LEU 66 N -3.59 1.75 -2.62 -2.13 7.94 -0.64 -5.05 117.00 112.65 1ikm n LEU 66 Ca -0.36 -0.08 -0.19 0.00 -1.11 0.00 0.00 56.01 54.27 1ikm n LEU 66 Cb 0.98 -0.33 0.02 0.00 0.53 0.00 0.00 43.42 44.62 1ikm n LEU 66 CO 0.35 0.76 -0.24 2.29 -1.11 0.00 0.00 177.39 179.43 1ikm n LYS 67 N -3.05 -0.97 -2.32 1.96 0.00 0.14 -4.98 118.16 108.94 1ikm n LYS 67 Ca -0.40 0.84 -0.04 0.00 -0.00 0.00 0.00 58.31 58.70 1ikm n LYS 67 Cb 1.06 -1.15 -0.01 0.00 -0.00 0.00 0.00 35.03 34.92 1ikm n LYS 67 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 1ikm n ARG 68 N 0.25 0.13 -0.00 -1.58 1.85 -1.26 -5.10 116.66 110.95 1ikm n ARG 68 Ca -0.04 -0.72 -0.00 0.00 -1.00 0.00 0.00 57.85 56.09 1ikm n ARG 68 Cb 0.44 0.64 -0.00 0.00 -1.05 0.00 0.00 32.46 32.49 1ikm n ARG 68 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ikm h ALA 69 N 1.42 0.00 -3.00 2.89 0.00 -2.02 -3.49 119.26 115.06 1ikm h ALA 69 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ikm h ALA 69 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1ikm h ALA 69 CO 0.08 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.72 1ikm n GLU 70 N -2.04 3.98 -3.55 0.00 1.02 -1.26 -5.18 120.64 113.61 1ikm n GLU 70 Ca -0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 1ikm n GLU 70 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 1ikm n GLU 70 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1ikm s ASN 71 N 1.00 -0.41 0.00 1.62 2.20 -1.26 -5.12 114.94 112.98 1ikm s ASN 71 Ca 0.00 -0.20 0.00 0.00 -0.94 0.00 0.00 52.86 51.72 1ikm s ASN 71 Cb 0.00 0.56 0.00 0.00 -2.00 0.00 0.00 41.25 39.81 1ikm s ASN 71 CO 0.00 -0.96 0.00 -1.20 -2.94 0.00 0.00 177.10 172.00