#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 0.66 0.00 4.31 0.05 -1.26 -5.13 118.68 117.31 1ikm s LEU 5 Ca 0.00 -1.23 0.00 0.00 0.05 0.00 0.00 54.13 52.95 1ikm s LEU 5 Cb 0.00 1.62 0.00 0.00 -2.05 0.00 0.00 46.19 45.76 1ikm s LEU 5 CO 0.00 -1.24 0.00 0.54 -0.55 0.00 0.00 176.35 175.10 1ikm n ARG 6 N -0.47 -0.81 -2.50 1.48 5.12 -1.26 -4.54 116.66 113.68 1ikm n ARG 6 Ca -0.01 0.53 -0.43 0.00 -1.93 0.00 0.00 57.85 56.02 1ikm n ARG 6 Cb 0.62 -0.99 -0.02 0.00 -1.16 0.00 0.00 32.46 30.91 1ikm n ARG 6 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ikm n GLN 8 N 5.53 0.13 -3.73 0.00 1.13 -1.26 -4.38 117.38 114.80 1ikm n GLN 8 Ca 0.11 0.31 -0.30 0.00 -1.94 0.00 0.00 57.00 55.19 1ikm n GLN 8 Cb 0.46 -1.72 -0.15 0.00 0.11 0.00 0.00 30.24 28.94 1ikm n GLN 8 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ikm h ILE 10 N 6.49 1.25 -3.25 0.00 2.04 -2.02 -3.40 117.51 118.63 1ikm h ILE 10 Ca -0.14 -1.21 -0.66 0.00 1.00 0.00 0.00 64.86 63.84 1ikm h ILE 10 Cb 1.02 1.56 -0.31 0.00 -0.74 0.00 0.00 36.82 38.36 1ikm h ILE 10 CO 0.46 0.36 -0.79 -1.59 0.00 0.00 0.00 178.15 176.59 1ikm s LYS 11 N -4.32 3.21 0.16 2.37 -2.85 -1.26 -5.12 119.74 111.94 1ikm s LYS 11 Ca -0.04 -0.73 0.02 0.00 -1.00 0.00 0.00 55.97 54.22 1ikm s LYS 11 Cb 0.14 -2.72 0.03 0.00 -2.06 0.00 0.00 37.83 33.22 1ikm s LYS 11 CO 0.74 -0.10 0.23 0.25 0.10 0.00 0.00 175.35 176.56 1ikm n THR 12 N 4.41 0.00 -3.46 3.79 -2.24 -1.26 -4.80 114.28 110.72 1ikm n THR 12 Ca -0.19 -0.52 -0.38 0.00 -2.27 0.00 0.00 64.05 60.68 1ikm n THR 12 Cb 0.51 -0.90 -0.09 0.00 -2.10 0.00 0.00 70.33 67.75 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 -0.05 3.26 -0.16 4.78 5.04 0.13 -4.82 117.35 125.53 1ikm s TYR 13 Ca 0.17 0.35 0.15 0.00 -2.44 0.00 0.00 57.07 55.29 1ikm s TYR 13 Cb -0.01 -2.49 -0.24 0.00 0.35 0.00 0.00 41.96 39.57 1ikm s TYR 13 CO 0.11 -0.16 0.21 0.43 -1.34 0.00 0.00 175.55 174.80 1ikm n SER 14 N 5.07 0.43 -4.75 4.32 7.64 -1.26 -2.58 113.62 122.48 1ikm n SER 14 Ca -0.10 0.10 -0.40 0.00 1.01 0.00 0.00 58.87 59.48 1ikm n SER 14 Cb 0.51 0.57 -0.05 0.00 -1.01 0.00 0.00 64.21 64.24 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 4.68 0.55 1.43 1.02 -1.26 -5.03 119.74 118.61 1ikm s LYS 15 Ca -0.11 1.70 -0.09 0.00 0.02 0.00 0.00 55.97 57.50 1ikm s LYS 15 Cb 0.07 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 34.10 1ikm s LYS 15 CO 0.81 0.25 0.92 -1.25 -0.92 0.00 0.00 175.35 175.15 1ikm s PRO 16 N -1.08 3.61 0.04 -1.68 0.04 -1.26 -5.06 135.00 129.62 1ikm s PRO 16 Ca 0.45 0.54 -0.27 0.00 0.04 0.00 0.00 61.00 61.76 1ikm s PRO 16 Cb -0.30 -2.22 0.08 0.00 0.04 0.00 0.00 34.50 32.10 1ikm s PRO 16 CO 0.37 -0.38 0.68 -0.59 0.04 0.00 0.00 177.00 177.13 1ikm s PHE 17 N -2.92 -0.55 0.33 0.56 -0.71 -1.26 -5.15 117.98 108.28 1ikm s PHE 17 Ca 0.52 0.64 -0.29 0.00 -1.04 0.00 0.00 56.93 56.76 1ikm s PHE 17 Cb -0.11 0.49 -0.10 0.00 -1.21 0.00 0.00 43.02 42.09 1ikm s PHE 17 CO 0.48 -0.70 1.37 -1.58 -1.34 0.00 0.00 175.22 173.45 1ikm s HIS 18 N -2.56 2.91 0.00 3.49 5.65 -1.26 -4.97 115.29 118.55 1ikm s HIS 18 Ca -0.03 1.30 -0.20 0.00 0.25 0.00 0.00 55.06 56.38 1ikm s HIS 18 Cb -0.01 -3.79 -0.24 0.00 -1.18 0.00 0.00 32.58 27.36 1ikm s HIS 18 CO -0.03 -2.27 1.09 -1.00 -0.65 0.00 0.00 174.74 171.87 1ikm h PRO 19 N 3.46 0.41 -0.44 2.88 0.13 -1.98 -3.33 132.00 133.13 1ikm h PRO 19 Ca -0.49 -0.45 0.13 0.00 -0.87 0.00 0.00 66.00 64.31 1ikm h PRO 19 Cb 1.23 0.13 -0.02 0.00 0.13 0.00 0.00 31.00 32.47 1ikm h PRO 19 CO 0.66 1.12 0.56 -0.22 -0.23 0.00 0.00 178.00 179.89 1ikm h LYS 20 N -0.11 0.00 -0.85 0.86 3.64 -1.97 0.27 116.57 118.41 1ikm h LYS 20 Ca -0.08 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.28 1ikm h LYS 20 Cb 1.34 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.12 1ikm h LYS 20 CO 0.12 0.00 0.47 0.74 -2.27 0.00 0.00 179.45 178.51 1ikm h PHE 21 N 0.00 1.16 -2.24 1.91 0.04 -1.98 -3.41 116.94 112.42 1ikm h PHE 21 Ca 0.21 -0.02 -0.55 0.00 2.80 0.00 0.00 57.97 60.40 1ikm h PHE 21 Cb 1.33 -0.37 0.01 0.00 2.20 0.00 0.00 35.95 39.11 1ikm h PHE 21 CO 0.00 0.80 1.33 0.42 -0.60 0.00 0.00 178.31 180.26 1ikm s ILE 22 N -5.80 3.03 0.15 -0.55 1.01 0.96 -1.77 121.20 118.23 1ikm s ILE 22 Ca -0.12 0.03 0.10 0.00 0.00 0.00 0.00 60.65 60.65 1ikm s ILE 22 Cb 0.17 -3.02 -0.10 0.00 0.01 0.00 0.00 42.46 39.51 1ikm s ILE 22 CO 0.82 -0.01 1.43 0.50 0.00 0.00 0.00 174.94 177.68 1ikm h LYS 23 N 12.24 0.00 0.00 2.79 3.64 -1.35 -3.47 116.57 130.42 1ikm h LYS 23 Ca -0.46 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 58.64 1ikm h LYS 23 Cb 1.24 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.99 1ikm h LYS 23 CO 0.95 0.79 -0.19 0.39 -2.27 0.00 0.00 179.45 179.12 1ikm n GLU 24 N -3.49 0.51 0.00 1.90 1.02 -1.24 -5.00 120.64 114.33 1ikm n GLU 24 Ca -0.00 -2.43 0.00 0.00 -0.02 0.00 0.00 57.16 54.71 1ikm n GLU 24 Cb 0.79 2.23 0.00 0.00 -0.02 0.00 0.00 31.44 34.44 1ikm n GLU 24 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1ikm n ARG 26 N -0.49 0.00 -3.96 3.49 1.85 0.12 -1.63 116.66 116.04 1ikm n ARG 26 Ca 0.02 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.58 1ikm n ARG 26 Cb 0.49 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.86 1ikm n ARG 26 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 1ikm s VAL 27 N 0.00 5.18 -0.13 8.89 -7.23 -1.26 -1.40 120.40 124.45 1ikm s VAL 27 Ca 0.00 -0.60 0.01 0.00 -1.81 0.00 0.00 61.98 59.58 1ikm s VAL 27 Cb 0.00 -3.58 -0.01 0.00 0.56 0.00 0.00 36.38 33.35 1ikm s VAL 27 CO 0.00 0.04 -0.16 -0.63 -0.31 0.00 0.00 175.10 174.04 1ikm s ILE 28 N -1.59 2.72 1.21 -0.62 1.01 -0.51 -4.93 121.20 118.49 1ikm s ILE 28 Ca 0.34 -0.77 -0.17 0.00 0.00 0.00 0.00 60.65 60.05 1ikm s ILE 28 Cb -0.12 -2.12 0.29 0.00 0.01 0.00 0.00 42.46 40.51 1ikm s ILE 28 CO 0.27 0.53 1.04 -1.83 0.00 0.00 0.00 174.94 174.95 1ikm s GLU 29 N 0.48 -1.25 0.18 2.79 -1.05 -1.26 -2.95 118.70 115.65 1ikm s GLU 29 Ca -0.11 0.34 0.06 0.00 -0.15 0.00 0.00 54.97 55.11 1ikm s GLU 29 Cb -0.16 -1.56 -0.04 0.00 -0.44 0.00 0.00 34.13 31.93 1ikm s GLU 29 CO 0.05 -3.82 0.09 -1.54 0.95 0.00 0.00 175.26 170.99 1ikm s SER 30 N -3.24 5.20 0.00 0.83 1.04 -1.26 -4.70 113.70 111.57 1ikm s SER 30 Ca 0.68 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.85 1ikm s SER 30 Cb -0.17 -1.25 0.00 0.00 0.10 0.00 0.00 66.02 64.70 1ikm s SER 30 CO 0.59 0.06 0.00 0.61 0.98 0.00 0.00 173.24 175.48 1ikm n GLY 31 N -0.38 5.22 0.16 7.32 0.00 -0.54 -4.95 105.19 112.01 1ikm n GLY 31 Ca -0.09 -1.24 -0.08 0.00 0.00 0.00 0.00 46.02 44.61 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 0.28 -0.70 1.61 0.13 -1.99 -2.71 132.00 128.61 1ikm h PRO 32 Ca 0.00 -0.24 -0.04 0.00 -0.87 0.00 0.00 66.00 64.85 1ikm h PRO 32 Cb 0.00 0.05 -0.03 0.00 0.13 0.00 0.00 31.00 31.15 1ikm h PRO 32 CO 0.00 0.90 0.28 1.12 -0.23 0.00 0.00 178.00 180.08 1ikm h HIS 33 N 0.18 1.04 -2.08 1.56 2.07 -1.98 -3.39 115.15 112.55 1ikm h HIS 33 Ca -0.03 -0.07 -0.29 0.00 -2.85 0.00 0.00 60.37 57.13 1ikm h HIS 33 Cb 1.32 -0.32 -0.32 0.00 2.57 0.00 0.00 27.41 30.66 1ikm h HIS 33 CO 0.03 0.79 -0.61 0.00 -3.07 0.00 0.00 177.93 175.08 1ikm h ALA 35 N 8.24 1.43 -2.46 0.00 0.00 -1.70 -1.43 119.26 123.34 1ikm h ALA 35 Ca -0.13 -0.16 -0.56 0.00 0.00 0.00 0.00 54.91 54.06 1ikm h ALA 35 Cb 1.09 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.80 1ikm h ALA 35 CO 0.32 0.21 0.32 -0.80 0.00 0.00 0.00 179.25 179.30 1ikm s ASN 36 N -6.53 7.08 0.66 0.00 0.01 -1.26 -4.71 114.94 110.19 1ikm s ASN 36 Ca -0.03 1.31 -0.13 0.00 -0.71 0.00 0.00 52.86 53.30 1ikm s ASN 36 Cb 0.14 -2.48 -0.00 0.00 0.41 0.00 0.00 41.25 39.32 1ikm s ASN 36 CO 0.64 -0.30 1.07 -0.89 -1.51 0.00 0.00 177.10 176.11 1ikm s THR 37 N 1.54 3.68 -0.01 1.60 2.01 -1.26 -4.74 115.64 118.45 1ikm s THR 37 Ca 0.42 0.68 0.00 0.00 0.31 0.00 0.00 61.69 63.10 1ikm s THR 37 Cb -0.18 -3.26 0.02 0.00 0.01 0.00 0.00 72.50 69.09 1ikm s THR 37 CO 0.18 -0.57 0.01 -0.70 -0.69 0.00 0.00 174.62 172.84 1ikm s GLU 38 N -4.45 0.05 0.39 4.92 2.56 -1.15 -4.77 118.70 116.24 1ikm s GLU 38 Ca 0.62 0.10 -0.02 0.00 0.00 0.00 0.00 54.97 55.67 1ikm s GLU 38 Cb -0.17 -0.22 -0.04 0.00 2.00 0.00 0.00 34.13 35.71 1ikm s GLU 38 CO 0.45 -0.10 0.63 0.42 -0.56 0.00 0.00 175.26 176.11 1ikm s ILE 39 N 0.68 5.03 -0.10 -3.70 1.01 -1.12 -1.42 121.20 121.58 1ikm s ILE 39 Ca -0.06 -0.18 -0.06 0.00 0.00 0.00 0.00 60.65 60.36 1ikm s ILE 39 Cb -0.09 -3.85 0.04 0.00 0.01 0.00 0.00 42.46 38.57 1ikm s ILE 39 CO -0.02 -0.64 0.24 -0.63 0.00 0.00 0.00 174.94 173.89 1ikm s ILE 40 N -2.45 -0.03 0.20 2.92 1.01 -0.49 -1.96 121.20 120.39 1ikm s ILE 40 Ca 0.43 0.12 0.02 0.00 0.00 0.00 0.00 60.65 61.23 1ikm s ILE 40 Cb -0.10 -0.36 -0.05 0.00 0.01 0.00 0.00 42.46 41.96 1ikm s ILE 40 CO 0.39 0.05 0.00 0.68 0.00 0.00 0.00 174.94 176.06 1ikm s VAL 41 N 1.05 0.80 -0.35 2.92 -7.23 -0.97 0.10 120.40 116.72 1ikm s VAL 41 Ca -0.08 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.09 1ikm s VAL 41 Cb -0.09 -2.21 0.11 0.00 0.56 0.00 0.00 36.38 34.75 1ikm s VAL 41 CO -0.07 -0.41 0.15 -0.54 -0.31 0.00 0.00 175.10 173.92 1ikm s LYS 42 N -3.90 0.91 0.46 4.82 1.02 -0.64 -2.54 119.74 119.87 1ikm s LYS 42 Ca 0.26 -1.41 -0.23 0.00 0.02 0.00 0.00 55.97 54.61 1ikm s LYS 42 Cb 0.06 -2.11 -0.09 0.00 -0.52 0.00 0.00 37.83 35.17 1ikm s LYS 42 CO 0.06 -1.05 1.01 1.28 -0.92 0.00 0.00 175.35 175.73 1ikm n LEU 43 N 4.37 2.91 0.26 3.17 4.77 -0.34 -1.10 117.00 131.04 1ikm n LEU 43 Ca 0.02 0.99 0.18 0.00 -0.03 0.00 0.00 56.01 57.17 1ikm n LEU 43 Cb 0.39 -1.37 0.92 0.00 -2.33 0.00 0.00 43.42 41.03 1ikm n LEU 43 CO 0.16 -1.51 1.15 0.77 -1.33 0.00 0.00 177.39 176.63 1ikm h SER 44 N 1.36 0.00 0.00 -1.43 4.64 -1.67 -0.24 113.55 116.21 1ikm h SER 44 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1ikm h SER 44 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1ikm h SER 44 CO 0.56 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.99 1ikm n ASP 45 N -3.54 0.00 -0.18 4.97 9.92 -1.26 -4.81 116.55 121.65 1ikm n ASP 45 Ca -0.00 -1.31 0.00 0.00 -0.53 0.00 0.00 54.79 52.95 1ikm n ASP 45 Cb 0.26 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.74 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 0.41 0.80 3.67 0.44 0.00 -0.12 -5.07 105.19 105.32 1ikm n GLY 46 Ca 0.07 -0.65 -0.24 0.00 0.00 0.00 0.00 46.02 45.20 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 -3.73 2.40 -0.15 1.61 6.06 -1.13 -4.95 118.95 119.06 1ikm s ARG 47 Ca 0.00 -1.29 -0.00 0.00 -2.50 0.00 0.00 55.73 51.94 1ikm s ARG 47 Cb 0.00 -2.26 0.03 0.00 0.06 0.00 0.00 34.95 32.78 1ikm s ARG 47 CO 0.00 0.39 -0.08 -2.00 -2.50 0.00 0.00 175.30 171.12 1ikm s GLU 48 N -3.52 1.64 -0.08 5.12 2.12 -1.26 -1.20 118.70 121.52 1ikm s GLU 48 Ca 0.31 -0.48 -0.00 0.00 0.36 0.00 0.00 54.97 55.15 1ikm s GLU 48 Cb -0.07 -1.94 0.02 0.00 0.26 0.00 0.00 34.13 32.40 1ikm s GLU 48 CO 0.20 -0.36 -0.05 -0.51 -0.54 0.00 0.00 175.26 174.01 1ikm s LEU 49 N 1.61 1.06 0.15 2.70 1.02 -1.05 -5.00 118.68 119.16 1ikm s LEU 49 Ca 0.02 -0.19 -0.23 0.00 0.02 0.00 0.00 54.13 53.76 1ikm s LEU 49 Cb -0.14 -0.62 -0.08 0.00 0.02 0.00 0.00 46.19 45.37 1ikm s LEU 49 CO -0.08 -0.12 0.70 0.00 0.02 0.00 0.00 176.35 176.88 1ikm s LEU 51 N -1.27 4.26 -0.33 0.00 1.43 -0.83 0.21 118.68 122.15 1ikm s LEU 51 Ca 0.35 0.11 -0.11 0.00 -1.03 0.00 0.00 54.13 53.45 1ikm s LEU 51 Cb -0.21 -2.83 -0.01 0.00 0.03 0.00 0.00 46.19 43.17 1ikm s LEU 51 CO 0.23 0.04 0.19 -0.62 0.23 0.00 0.00 176.35 176.42 1ikm s ASP 52 N -3.32 5.74 0.00 2.29 2.15 -1.07 -2.81 116.67 119.66 1ikm s ASP 52 Ca 0.34 -0.55 0.15 0.00 0.43 0.00 0.00 52.55 52.91 1ikm s ASP 52 Cb -0.11 -2.05 0.76 0.00 -0.30 0.00 0.00 42.92 41.22 1ikm s ASP 52 CO 0.28 -0.23 1.40 -0.81 -0.17 0.00 0.00 175.17 175.63 1ikm n PRO 53 N 5.03 0.24 0.25 4.34 -0.04 -1.26 -2.93 135.00 140.62 1ikm n PRO 53 Ca -0.13 0.13 0.11 0.00 -0.04 0.00 0.00 63.50 63.57 1ikm n PRO 53 Cb 0.49 -1.50 0.66 0.00 -0.04 0.00 0.00 33.50 33.11 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 -7.37 0.54 1.57 -1.96 -3.44 116.57 105.92 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 0.13 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.52 1ikm h LYS 54 CO 0.00 0.15 0.26 -1.21 -0.57 0.00 0.00 179.45 178.08 1ikm s GLU 55 N -4.26 2.04 0.06 3.15 8.01 -1.15 -5.00 118.70 121.55 1ikm s GLU 55 Ca -0.03 -0.26 0.22 0.00 0.01 0.00 0.00 54.97 54.92 1ikm s GLU 55 Cb 0.14 -2.13 -0.08 0.00 -4.31 0.00 0.00 34.13 27.75 1ikm s GLU 55 CO 0.61 -1.37 0.87 0.09 0.01 0.00 0.00 175.26 175.47 1ikm n ASN 56 N -3.03 0.52 0.11 -0.19 4.13 -1.26 -3.95 115.26 111.59 1ikm n ASN 56 Ca 0.09 -0.08 -0.20 0.00 1.68 0.00 0.00 54.58 56.07 1ikm n ASN 56 Cb 0.60 1.06 -0.15 0.00 -1.54 0.00 0.00 39.78 39.76 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 0.69 -0.59 3.10 5.08 -1.94 -2.17 115.95 120.12 1ikm h TRP 57 Ca 0.00 -0.50 -0.03 0.00 1.08 0.00 0.00 58.89 59.44 1ikm h TRP 57 Cb 0.85 -0.03 -0.03 0.00 -3.00 0.00 0.00 29.16 26.96 1ikm h TRP 57 CO 0.00 1.44 0.25 0.28 -1.28 0.00 0.00 178.44 179.13 1ikm h VAL 58 N 0.10 1.22 0.00 0.12 2.07 -1.82 0.74 116.25 118.69 1ikm h VAL 58 Ca -0.22 -0.67 -0.09 0.00 0.82 0.00 0.00 66.70 66.54 1ikm h VAL 58 Cb 2.07 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 1ikm h VAL 58 CO 0.22 0.26 -0.43 0.06 0.02 0.00 0.00 177.57 177.70 1ikm h GLN 59 N 0.81 0.00 0.21 1.57 3.07 -1.69 -1.19 115.11 117.89 1ikm h GLN 59 Ca 0.20 0.00 -0.31 0.00 0.09 0.00 0.00 58.65 58.63 1ikm h GLN 59 Cb 0.17 0.00 0.03 0.00 0.08 0.00 0.00 27.48 27.76 1ikm h GLN 59 CO -0.02 0.43 -1.41 -0.09 0.09 0.00 0.00 178.83 177.83 1ikm h ARG 60 N 0.00 0.44 -0.58 0.06 2.43 -0.85 -2.18 114.38 113.70 1ikm h ARG 60 Ca -0.00 -0.76 -0.08 0.00 -0.81 0.00 0.00 59.98 58.33 1ikm h ARG 60 Cb 1.06 0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 30.87 1ikm h ARG 60 CO 0.06 1.36 0.05 0.28 -1.51 0.00 0.00 179.97 180.21 1ikm h VAL 61 N 0.00 1.26 -0.33 0.20 2.07 0.50 0.40 116.25 120.35 1ikm h VAL 61 Ca -0.26 -1.06 -0.15 0.00 0.82 0.00 0.00 66.70 66.05 1ikm h VAL 61 Cb 2.03 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 1ikm h VAL 61 CO 0.22 0.38 -0.39 0.58 0.02 0.00 0.00 177.57 178.38 1ikm h VAL 62 N 0.89 1.28 -0.34 2.57 2.07 -1.31 -1.44 116.25 119.98 1ikm h VAL 62 Ca 0.17 -1.56 -0.06 0.00 0.82 0.00 0.00 66.70 66.07 1ikm h VAL 62 Cb 0.48 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1ikm h VAL 62 CO 0.02 0.51 -0.04 -0.33 0.02 0.00 0.00 177.57 177.75 1ikm h GLU 63 N 0.65 0.63 0.00 1.57 5.08 -1.14 -0.46 114.58 120.91 1ikm h GLU 63 Ca 0.06 -0.22 -0.07 0.00 -1.00 0.00 0.00 59.36 58.12 1ikm h GLU 63 Cb 0.94 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 1ikm h GLU 63 CO 0.09 0.77 -0.34 -0.22 -1.00 0.00 0.00 179.01 178.31 1ikm h LYS 64 N 0.42 0.00 0.04 2.33 3.64 -0.86 0.18 116.57 122.32 1ikm h LYS 64 Ca 0.09 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.28 1ikm h LYS 64 Cb 0.52 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.36 1ikm h LYS 64 CO 0.03 0.34 -0.77 0.35 -2.27 0.00 0.00 179.45 177.13 1ikm h PHE 65 N 0.00 0.70 0.01 1.91 3.57 -1.00 -3.35 116.94 118.77 1ikm h PHE 65 Ca -0.00 -0.41 -0.00 0.00 3.53 0.00 0.00 57.97 61.09 1ikm h PHE 65 Cb 0.67 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.34 1ikm h PHE 65 CO 0.00 1.25 -0.00 -0.07 -2.23 0.00 0.00 178.31 177.25 1ikm h LEU 66 N -0.04 -0.01 0.00 0.59 3.38 -0.98 -3.47 115.31 114.78 1ikm h LEU 66 Ca -0.11 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 57.08 1ikm h LEU 66 Cb 1.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.24 1ikm h LEU 66 CO 0.15 0.79 0.00 1.17 0.09 0.00 0.00 178.44 180.64 1ikm n LYS 67 N -4.71 0.00 -4.15 1.13 3.00 0.63 -4.80 118.16 109.26 1ikm n LYS 67 Ca -0.09 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 57.96 1ikm n LYS 67 Cb 0.38 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.36 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 0.00 2.24 0.35 1.64 0.52 -1.26 -5.02 118.95 117.41 1ikm s ARG 68 Ca 0.00 -1.96 0.06 0.00 -0.52 0.00 0.00 55.73 53.31 1ikm s ARG 68 Cb 0.00 -1.96 -0.03 0.00 0.52 0.00 0.00 34.95 33.48 1ikm s ARG 68 CO 0.00 -0.27 0.23 0.00 0.02 0.00 0.00 175.30 175.28 1ikm s ALA 69 N -2.68 2.14 0.00 2.13 0.00 -1.26 -5.12 121.76 116.97 1ikm s ALA 69 Ca 0.35 -1.81 0.00 0.00 0.00 0.00 0.00 51.96 50.50 1ikm s ALA 69 Cb 0.02 1.27 0.00 0.00 0.00 0.00 0.00 23.12 24.41 1ikm s ALA 69 CO 0.20 -0.57 0.00 0.39 0.00 0.00 0.00 175.76 175.78 1ikm n GLU 70 N -0.69 0.00 0.00 0.00 1.02 -1.26 -5.04 120.64 114.67 1ikm n GLU 70 Ca 0.03 0.19 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 1ikm n GLU 70 Cb 0.63 -0.62 0.00 0.00 -0.02 0.00 0.00 31.44 31.43 1ikm n GLU 70 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1ikm n ASN 71 N -1.61 0.00 0.00 1.62 0.23 -1.26 -5.35 115.26 108.89 1ikm n ASN 71 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1ikm n ASN 71 Cb 0.00 0.14 0.00 0.00 -2.08 0.00 0.00 39.78 37.84 1ikm n ASN 71 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79