#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ike n THR 3 N -0.12 0.00 -4.17 0.00 -2.24 -1.26 -4.98 114.28 101.51 1ike n THR 3 Ca 0.03 -0.29 -0.34 0.00 -2.27 0.00 0.00 64.05 61.18 1ike n THR 3 Cb 0.53 1.25 -0.11 0.00 -2.10 0.00 0.00 70.33 69.89 1ike n THR 3 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ike s LYS 4 N -0.23 3.75 -0.80 -0.78 -0.14 -1.26 -5.03 119.74 115.25 1ike s LYS 4 Ca 0.00 -0.46 -0.18 0.00 -1.36 0.00 0.00 55.97 53.97 1ike s LYS 4 Cb 0.00 -3.07 0.14 0.00 -1.68 0.00 0.00 37.83 33.23 1ike s LYS 4 CO 0.00 0.18 0.91 1.21 -0.76 0.00 0.00 175.35 176.88 1ike s ASN 5 N 0.58 6.52 0.36 2.83 2.47 -1.26 -5.05 114.94 121.40 1ike s ASN 5 Ca -0.00 -2.01 -0.26 0.00 0.42 0.00 0.00 52.86 51.01 1ike s ASN 5 Cb -0.14 -2.32 -0.09 0.00 -1.45 0.00 0.00 41.25 37.25 1ike s ASN 5 CO 0.02 -0.96 1.14 0.00 -3.72 0.00 0.00 177.10 173.57 1ike s ALA 6 N 2.06 3.24 -0.19 1.71 0.00 -1.26 -5.01 121.76 122.31 1ike s ALA 6 Ca 0.22 0.92 -0.14 0.00 0.00 0.00 0.00 51.96 52.96 1ike s ALA 6 Cb -0.12 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.60 1ike s ALA 6 CO -0.04 -0.37 0.31 0.42 0.00 0.00 0.00 175.76 176.08 1ike s ILE 7 N -1.37 5.28 0.58 0.00 -1.09 -1.26 -5.01 121.20 118.32 1ike s ILE 7 Ca 0.53 0.55 -0.19 0.00 -2.23 0.00 0.00 60.65 59.31 1ike s ILE 7 Cb -0.30 -3.65 -0.04 0.00 -1.58 0.00 0.00 42.46 36.89 1ike s ILE 7 CO 0.38 0.33 1.15 0.00 -1.23 0.00 0.00 174.94 175.57 1ike s ALA 8 N 0.86 2.61 0.19 9.38 0.00 -1.26 -4.37 121.76 129.18 1ike s ALA 8 Ca 0.16 0.84 -0.33 0.00 0.00 0.00 0.00 51.96 52.63 1ike s ALA 8 Cb -0.14 -3.38 -0.14 0.00 0.00 0.00 0.00 23.12 19.46 1ike s ALA 8 CO 0.05 -0.97 1.48 0.94 0.00 0.00 0.00 175.76 177.27 1ike n GLN 9 N -1.56 2.01 -1.77 0.00 7.27 -0.18 -4.91 117.38 118.24 1ike n GLN 9 Ca 0.12 0.72 -0.42 0.00 0.07 0.00 0.00 57.00 57.49 1ike n GLN 9 Cb 0.51 -2.43 -0.03 0.00 2.41 0.00 0.00 30.24 30.70 1ike n GLN 9 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1ike s THR 10 N 0.46 2.48 -0.92 1.69 2.01 -1.26 -2.33 115.64 117.77 1ike s THR 10 Ca 0.75 0.15 0.00 0.00 0.31 0.00 0.00 61.69 62.90 1ike s THR 10 Cb -0.69 -3.10 0.00 0.00 0.01 0.00 0.00 72.50 68.72 1ike s THR 10 CO 0.44 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.98 1ike n GLY 11 N 4.08 0.88 3.56 4.40 0.00 -1.26 -4.92 105.19 111.93 1ike n GLY 11 Ca 0.17 -0.61 -0.55 0.00 0.00 0.00 0.00 46.02 45.02 1ike n GLY 11 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1ike n PHE 12 N -2.96 1.18 -3.21 1.61 7.35 -0.99 -4.91 117.46 115.54 1ike n PHE 12 Ca -0.09 0.81 -0.46 0.00 -0.76 0.00 0.00 57.45 56.95 1ike n PHE 12 Cb 0.34 -2.24 -0.03 0.00 0.35 0.00 0.00 39.48 37.91 1ike n PHE 12 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1ike s ASN 13 N 0.43 6.58 0.33 -2.13 3.84 -1.26 -4.93 114.94 117.79 1ike s ASN 13 Ca 0.88 -2.26 0.05 0.00 0.21 0.00 0.00 52.86 51.74 1ike s ASN 13 Cb -1.09 -2.26 0.59 0.00 -0.55 0.00 0.00 41.25 37.93 1ike s ASN 13 CO 0.52 -0.79 1.84 0.07 -2.79 0.00 0.00 177.10 175.95 1ike h LYS 14 N 8.34 0.46 0.00 0.43 2.10 -2.00 -2.30 116.57 123.60 1ike h LYS 14 Ca 0.01 -0.12 -0.08 0.00 -2.00 0.00 0.00 60.65 58.46 1ike h LYS 14 Cb 1.05 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 32.31 1ike h LYS 14 CO 0.91 0.56 -0.40 -0.44 -2.00 0.00 0.00 179.45 178.08 1ike h ASP 15 N 0.43 0.00 -0.08 7.07 3.32 -1.92 -0.13 116.42 125.11 1ike h ASP 15 Ca 0.09 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.90 1ike h ASP 15 Cb 0.42 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.99 1ike h ASP 15 CO 0.02 0.40 -0.86 0.11 -1.72 0.00 0.00 179.24 177.19 1ike h LYS 16 N 0.00 0.72 -0.08 3.56 1.57 -1.91 -3.24 116.57 117.19 1ike h LYS 16 Ca -0.00 -0.67 -0.02 0.00 -1.87 0.00 0.00 60.65 58.08 1ike h LYS 16 Cb 0.98 0.17 -0.00 0.00 0.08 0.00 0.00 32.23 33.46 1ike h LYS 16 CO 0.05 1.27 -0.03 -0.92 -0.57 0.00 0.00 179.45 179.25 1ike h TYR 17 N 0.42 0.19 -1.15 -1.35 3.20 -1.23 -3.28 116.97 113.76 1ike h TYR 17 Ca -0.09 -0.04 -0.71 0.00 3.14 0.00 0.00 58.73 61.03 1ike h TYR 17 Cb 1.51 -0.05 -0.13 0.00 1.54 0.00 0.00 36.73 39.60 1ike h TYR 17 CO 0.10 0.51 2.09 1.19 -1.64 0.00 0.00 178.16 180.41 1ike n PHE 18 N -4.77 2.44 -0.40 -3.82 3.72 -0.08 -4.61 117.46 109.95 1ike n PHE 18 Ca -0.07 -2.69 0.12 0.00 -0.05 0.00 0.00 57.45 54.76 1ike n PHE 18 Cb 0.25 -1.76 0.33 0.00 -0.94 0.00 0.00 39.48 37.36 1ike n PHE 18 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1ike n ASN 19 N 1.57 4.09 0.00 4.37 6.94 -1.12 -3.78 115.26 127.33 1ike n ASN 19 Ca 0.60 -2.06 0.00 0.00 -0.02 0.00 0.00 54.58 53.10 1ike n ASN 19 Cb 0.29 -0.51 0.00 0.00 -2.36 0.00 0.00 39.78 37.20 1ike n ASN 19 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ike n GLY 20 N 1.61 0.87 3.97 4.83 0.00 0.66 -4.95 105.19 112.19 1ike n GLY 20 Ca 0.25 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.03 1ike n GLY 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ike s ASP 21 N -2.86 4.55 0.02 1.61 2.15 -1.25 -4.65 116.67 116.25 1ike s ASP 21 Ca 0.00 -0.07 -0.08 0.00 0.43 0.00 0.00 52.55 52.82 1ike s ASP 21 Cb 0.00 -0.45 -0.05 0.00 -0.30 0.00 0.00 42.92 42.12 1ike s ASP 21 CO 0.00 -1.72 0.32 -0.69 -0.17 0.00 0.00 175.17 172.91 1ike s VAL 22 N -3.14 5.22 -0.06 1.11 1.01 -1.26 -2.78 120.40 120.51 1ike s VAL 22 Ca 0.64 0.31 0.05 0.00 0.00 0.00 0.00 61.98 62.98 1ike s VAL 22 Cb -0.07 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 1ike s VAL 22 CO 0.44 0.37 -0.21 0.26 0.00 0.00 0.00 175.10 175.95 1ike s TRP 23 N -1.30 2.16 -0.12 5.22 0.52 0.70 -4.62 118.94 121.49 1ike s TRP 23 Ca 0.28 -0.69 -0.04 0.00 0.02 0.00 0.00 56.10 55.67 1ike s TRP 23 Cb -0.14 -1.44 -0.04 0.00 -1.15 0.00 0.00 33.47 30.71 1ike s TRP 23 CO 0.16 -0.24 0.04 0.71 0.02 0.00 0.00 176.95 177.64 1ike s TYR 24 N 0.03 3.24 -0.21 -1.98 2.02 -0.50 -0.41 117.35 119.55 1ike s TYR 24 Ca -0.07 0.17 -0.29 0.00 -0.37 0.00 0.00 57.07 56.51 1ike s TYR 24 Cb -0.14 -1.91 -0.00 0.00 -0.40 0.00 0.00 41.96 39.51 1ike s TYR 24 CO 0.04 0.38 1.17 0.08 -1.57 0.00 0.00 175.55 175.65 1ike s VAL 25 N -0.44 4.43 -0.09 0.71 1.01 -0.32 -1.76 120.40 123.95 1ike s VAL 25 Ca 0.09 1.71 0.21 0.00 0.00 0.00 0.00 61.98 63.99 1ike s VAL 25 Cb -0.12 -4.15 -0.30 0.00 0.00 0.00 0.00 36.38 31.81 1ike s VAL 25 CO 0.02 -0.20 0.38 0.35 0.00 0.00 0.00 175.10 175.65 1ike n THR 26 N 5.45 0.45 -3.68 3.92 -2.24 0.63 -4.66 114.28 114.14 1ike n THR 26 Ca 0.13 -0.61 -0.14 0.00 -2.27 0.00 0.00 64.05 61.16 1ike n THR 26 Cb 0.46 -0.16 -0.08 0.00 -2.10 0.00 0.00 70.33 68.44 1ike n THR 26 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1ike s ASP 27 N -4.85 -0.40 0.06 3.42 1.11 -1.18 -1.59 116.67 113.24 1ike s ASP 27 Ca -0.08 0.51 -0.06 0.00 0.18 0.00 0.00 52.55 53.10 1ike s ASP 27 Cb 0.11 0.57 -0.01 0.00 1.07 0.00 0.00 42.92 44.66 1ike s ASP 27 CO 0.88 -0.40 0.10 -0.72 1.18 0.00 0.00 175.17 176.21 1ike s TYR 28 N -0.82 0.25 -0.23 4.23 1.13 0.15 -0.38 117.35 121.68 1ike s TYR 28 Ca -0.09 -0.65 -0.01 0.00 -1.41 0.00 0.00 57.07 54.90 1ike s TYR 28 Cb -0.03 -0.17 0.07 0.00 -1.10 0.00 0.00 41.96 40.73 1ike s TYR 28 CO 0.05 -0.43 0.03 -1.17 -2.51 0.00 0.00 175.55 171.51 1ike s LEU 29 N -2.57 1.83 -0.19 -3.49 2.96 0.19 0.15 118.68 117.56 1ike s LEU 29 Ca 0.01 -1.13 -0.19 0.00 -0.22 0.00 0.00 54.13 52.60 1ike s LEU 29 Cb 0.03 -0.82 -0.03 0.00 0.50 0.00 0.00 46.19 45.87 1ike s LEU 29 CO -0.08 -0.32 0.54 -0.62 -1.32 0.00 0.00 176.35 174.55 1ike s ASP 30 N 1.67 6.61 0.05 3.68 -1.08 -1.26 -0.54 116.67 125.79 1ike s ASP 30 Ca 0.01 0.73 0.26 0.00 -0.52 0.00 0.00 52.55 53.03 1ike s ASP 30 Cb -0.18 -2.31 0.71 0.00 -1.46 0.00 0.00 42.92 39.69 1ike s ASP 30 CO -0.12 -0.18 1.58 0.18 0.52 0.00 0.00 175.17 177.15 1ike n LEU 31 N 4.71 0.44 -3.05 -1.34 4.77 -0.54 -4.36 117.00 117.64 1ike n LEU 31 Ca -0.04 0.26 -0.22 0.00 -0.03 0.00 0.00 56.01 55.97 1ike n LEU 31 Cb 0.50 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 1ike n LEU 31 CO 0.43 0.02 -0.04 1.21 -1.33 0.00 0.00 177.39 177.67 1ike n GLU 32 N -1.72 2.12 -1.35 3.23 2.13 -1.26 -4.95 120.64 118.85 1ike n GLU 32 Ca 0.05 -4.12 -0.01 0.00 0.66 0.00 0.00 57.16 53.74 1ike n GLU 32 Cb 0.37 -1.97 0.00 0.00 0.27 0.00 0.00 31.44 30.11 1ike n GLU 32 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 1ike n PRO 33 N 0.01 1.17 0.00 5.31 -0.04 -1.26 -4.89 135.00 135.30 1ike n PRO 33 Ca 0.28 -0.21 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 1ike n PRO 33 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 1ike n PRO 33 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1ike n ASP 34 N -2.56 1.20 0.05 3.54 -0.08 -1.26 -4.97 116.55 112.48 1ike n ASP 34 Ca 0.01 0.00 0.07 0.00 -1.51 0.00 0.00 54.79 53.35 1ike n ASP 34 Cb 0.04 0.00 0.30 0.00 2.34 0.00 0.00 41.12 43.80 1ike n ASP 34 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 1ike n ASP 35 N 0.00 0.22 -3.11 1.67 3.85 -1.26 -4.88 116.55 113.04 1ike n ASP 35 Ca 0.00 0.58 -0.29 0.00 -0.71 0.00 0.00 54.79 54.37 1ike n ASP 35 Cb 0.00 -0.61 0.03 0.00 -1.35 0.00 0.00 41.12 39.18 1ike n ASP 35 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.20 177.52 1ike n VAL 36 N -1.77 0.00 -1.42 2.12 0.24 -1.26 -4.43 118.33 111.82 1ike n VAL 36 Ca 0.01 -0.28 -0.16 0.00 -2.04 0.00 0.00 64.34 61.87 1ike n VAL 36 Cb 0.11 0.00 -0.16 0.00 -1.47 0.00 0.00 33.84 32.32 1ike n VAL 36 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 1ike n PRO 37 N 1.94 0.07 -0.02 7.34 -0.02 -1.26 -4.68 135.00 138.37 1ike n PRO 37 Ca -0.02 -0.16 0.07 0.00 -2.02 0.00 0.00 63.50 61.37 1ike n PRO 37 Cb 0.48 -1.43 0.45 0.00 -0.02 0.00 0.00 33.50 32.98 1ike n PRO 37 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1ike h LYS 38 N 10.85 0.49 -5.43 -0.52 3.64 -1.91 -3.38 116.57 120.31 1ike h LYS 38 Ca 0.03 -0.03 -0.63 0.00 -1.27 0.00 0.00 60.65 58.75 1ike h LYS 38 Cb 1.09 -0.11 -0.12 0.00 -0.41 0.00 0.00 32.23 32.68 1ike h LYS 38 CO 1.41 0.32 -0.52 1.03 -2.27 0.00 0.00 179.45 179.43 1ike s ARG 39 N -5.46 3.83 0.08 1.90 3.00 -1.26 -5.02 118.95 116.02 1ike s ARG 39 Ca -0.08 -0.24 -0.14 0.00 0.00 0.00 0.00 55.73 55.27 1ike s ARG 39 Cb 0.18 -3.25 0.02 0.00 0.00 0.00 0.00 34.95 31.90 1ike s ARG 39 CO 0.74 0.46 0.32 -0.47 0.00 0.00 0.00 175.30 176.35 1ike s TYR 40 N -0.12 -0.10 -0.05 -0.53 6.14 -1.26 -4.53 117.35 116.89 1ike s TYR 40 Ca 0.09 -0.14 0.04 0.00 0.64 0.00 0.00 57.07 57.69 1ike s TYR 40 Cb -0.12 0.13 0.00 0.00 0.42 0.00 0.00 41.96 42.39 1ike s TYR 40 CO 0.01 -0.58 -0.17 0.00 0.64 0.00 0.00 175.55 175.45 1ike s ALA 42 N 0.19 -1.11 0.18 0.00 0.00 -1.26 -1.35 121.76 118.40 1ike s ALA 42 Ca -0.07 0.75 -0.18 0.00 0.00 0.00 0.00 51.96 52.46 1ike s ALA 42 Cb -0.13 -0.07 0.04 0.00 0.00 0.00 0.00 23.12 22.95 1ike s ALA 42 CO 0.03 -0.28 0.52 0.00 0.00 0.00 0.00 175.76 176.03 1ike s ALA 43 N -1.05 -1.05 0.08 0.00 0.00 -0.60 -1.17 121.76 117.98 1ike s ALA 43 Ca -0.11 -0.08 -0.09 0.00 0.00 0.00 0.00 51.96 51.68 1ike s ALA 43 Cb -0.03 0.83 0.00 0.00 0.00 0.00 0.00 23.12 23.92 1ike s ALA 43 CO 0.05 -0.78 0.20 -0.48 0.00 0.00 0.00 175.76 174.75 1ike s LEU 44 N -2.84 1.35 0.13 0.00 0.05 0.46 -1.00 118.68 116.82 1ike s LEU 44 Ca 0.07 -0.59 0.09 0.00 0.05 0.00 0.00 54.13 53.75 1ike s LEU 44 Cb -0.01 1.08 -0.04 0.00 -2.05 0.00 0.00 46.19 45.17 1ike s LEU 44 CO -0.05 -0.71 -0.19 0.00 -0.55 0.00 0.00 176.35 174.84 1ike s ALA 45 N -3.69 2.66 -0.06 1.48 0.00 0.13 -0.21 121.76 122.07 1ike s ALA 45 Ca 0.04 -1.40 -0.02 0.00 0.00 0.00 0.00 51.96 50.57 1ike s ALA 45 Cb 0.04 -0.60 0.04 0.00 0.00 0.00 0.00 23.12 22.60 1ike s ALA 45 CO -0.10 0.56 0.11 0.00 0.00 0.00 0.00 175.76 176.33 1ike s ALA 46 N -1.24 -0.10 0.16 0.00 0.00 -1.12 -1.15 121.76 118.32 1ike s ALA 46 Ca 0.18 0.50 -0.24 0.00 0.00 0.00 0.00 51.96 52.41 1ike s ALA 46 Cb -0.10 -0.51 0.07 0.00 0.00 0.00 0.00 23.12 22.58 1ike s ALA 46 CO 0.10 -0.28 1.00 0.20 0.00 0.00 0.00 175.76 176.79 1ike s GLY 47 N 1.52 -0.11 -0.21 0.00 0.00 -0.34 -0.25 107.32 107.94 1ike s GLY 47 Ca -0.05 -0.02 -0.09 0.00 0.00 0.00 0.00 44.72 44.56 1ike s GLY 47 CO -0.05 0.79 0.12 -1.59 0.00 0.00 0.00 173.10 172.37 1ike s THR 48 N -2.84 5.20 -0.17 0.90 2.01 -1.25 0.12 115.64 119.63 1ike s THR 48 Ca 0.16 0.12 0.00 0.00 0.31 0.00 0.00 61.69 62.28 1ike s THR 48 Cb -0.01 -3.38 0.03 0.00 0.01 0.00 0.00 72.50 69.14 1ike s THR 48 CO 0.03 0.42 -0.12 0.00 -0.69 0.00 0.00 174.62 174.26 1ike s ALA 49 N 0.56 1.89 -1.49 7.40 0.00 0.81 -4.74 121.76 126.19 1ike s ALA 49 Ca 0.07 -1.01 -0.01 0.00 0.00 0.00 0.00 51.96 51.01 1ike s ALA 49 Cb -0.12 -1.14 0.00 0.00 0.00 0.00 0.00 23.12 21.87 1ike s ALA 49 CO 0.00 -0.56 0.20 0.43 0.00 0.00 0.00 175.76 175.83 1ike n SER 50 N 4.75 0.33 0.00 0.00 7.64 -1.26 -1.27 113.62 123.81 1ike n SER 50 Ca -0.16 -1.16 0.00 0.00 1.01 0.00 0.00 58.87 58.57 1ike n SER 50 Cb 0.49 -2.25 0.00 0.00 -1.01 0.00 0.00 64.21 61.44 1ike n SER 50 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ike n GLY 51 N -2.29 1.66 3.65 0.23 0.00 -1.26 -5.01 105.19 102.17 1ike n GLY 51 Ca -0.31 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 1ike n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ike s LYS 52 N -0.22 3.35 -0.12 1.61 -0.14 -0.39 -5.08 119.74 118.75 1ike s LYS 52 Ca 0.00 -0.40 -0.29 0.00 -1.36 0.00 0.00 55.97 53.91 1ike s LYS 52 Cb 0.00 -2.93 -0.01 0.00 -1.68 0.00 0.00 37.83 33.22 1ike s LYS 52 CO 0.00 0.52 1.01 -1.17 -0.76 0.00 0.00 175.35 174.95 1ike s LEU 53 N -0.38 4.23 0.09 3.17 2.96 -1.26 -0.13 118.68 127.35 1ike s LEU 53 Ca 0.08 1.50 0.05 0.00 -0.22 0.00 0.00 54.13 55.54 1ike s LEU 53 Cb -0.12 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.99 1ike s LEU 53 CO 0.02 -0.47 -0.14 -0.54 -1.32 0.00 0.00 176.35 173.90 1ike s LYS 54 N 2.17 0.91 -0.02 1.98 -0.14 0.12 -0.08 119.74 124.68 1ike s LYS 54 Ca 0.47 -1.09 0.02 0.00 -1.36 0.00 0.00 55.97 54.01 1ike s LYS 54 Cb -0.18 -0.84 0.00 0.00 -1.68 0.00 0.00 37.83 35.13 1ike s LYS 54 CO 0.16 0.17 -0.08 -2.00 -0.76 0.00 0.00 175.35 172.85 1ike s GLU 55 N -2.22 0.77 -0.14 1.68 2.12 -0.68 -1.20 118.70 119.03 1ike s GLU 55 Ca 0.03 -0.26 -0.01 0.00 0.36 0.00 0.00 54.97 55.09 1ike s GLU 55 Cb -0.07 -0.74 -0.02 0.00 0.26 0.00 0.00 34.13 33.56 1ike s GLU 55 CO 0.02 0.11 -0.11 0.00 -0.54 0.00 0.00 175.26 174.75 1ike s ALA 56 N 0.12 2.71 0.16 6.30 0.00 -0.30 -0.96 121.76 129.78 1ike s ALA 56 Ca -0.01 -0.89 0.08 0.00 0.00 0.00 0.00 51.96 51.14 1ike s ALA 56 Cb -0.07 -1.31 -0.04 0.00 0.00 0.00 0.00 23.12 21.70 1ike s ALA 56 CO 0.00 0.21 -0.07 -0.51 0.00 0.00 0.00 175.76 175.40 1ike s LEU 57 N 0.40 3.11 -0.03 0.00 1.43 0.27 -0.70 118.68 123.16 1ike s LEU 57 Ca -0.09 -0.46 0.00 0.00 -1.03 0.00 0.00 54.13 52.55 1ike s LEU 57 Cb -0.15 -1.81 0.03 0.00 0.03 0.00 0.00 46.19 44.28 1ike s LEU 57 CO 0.05 0.12 -0.01 -0.47 0.23 0.00 0.00 176.35 176.26 1ike s TYR 58 N -1.58 0.44 -0.03 0.29 5.04 -0.17 -1.50 117.35 119.84 1ike s TYR 58 Ca 0.25 -0.06 0.06 0.00 -2.44 0.00 0.00 57.07 54.88 1ike s TYR 58 Cb -0.10 -0.49 -0.01 0.00 0.35 0.00 0.00 41.96 41.71 1ike s TYR 58 CO 0.16 -0.15 -0.20 -1.01 -1.34 0.00 0.00 175.55 173.00 1ike s HIS 59 N 1.04 1.90 -0.07 4.97 3.76 -0.07 -1.55 115.29 125.27 1ike s HIS 59 Ca -0.09 -0.45 -0.03 0.00 -0.15 0.00 0.00 55.06 54.34 1ike s HIS 59 Cb -0.14 -1.24 0.04 0.00 1.11 0.00 0.00 32.58 32.35 1ike s HIS 59 CO -0.01 -0.10 0.14 -0.47 -0.85 0.00 0.00 174.74 173.44 1ike s TYR 60 N -0.29 -0.13 -0.45 1.40 5.04 -0.46 -1.51 117.35 120.96 1ike s TYR 60 Ca 0.03 0.52 -0.20 0.00 -2.44 0.00 0.00 57.07 54.98 1ike s TYR 60 Cb -0.10 -0.28 0.03 0.00 0.35 0.00 0.00 41.96 41.96 1ike s TYR 60 CO 0.01 -0.24 0.64 0.34 -1.34 0.00 0.00 175.55 174.95 1ike s ASP 61 N 2.13 6.30 0.02 4.32 -1.08 -0.19 -0.66 116.67 127.51 1ike s ASP 61 Ca 0.02 -0.43 0.15 0.00 -0.52 0.00 0.00 52.55 51.77 1ike s ASP 61 Cb -0.12 -2.31 0.63 0.00 -1.46 0.00 0.00 42.92 39.66 1ike s ASP 61 CO -0.05 -0.79 1.47 -0.81 0.52 0.00 0.00 175.17 175.51 1ike n PRO 62 N 6.25 0.01 -0.07 4.34 -0.04 -1.26 -0.57 135.00 143.66 1ike n PRO 62 Ca -0.02 0.27 -0.22 0.00 -0.04 0.00 0.00 63.50 63.49 1ike n PRO 62 Cb 0.47 -1.52 -0.13 0.00 -0.04 0.00 0.00 33.50 32.29 1ike n PRO 62 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1ike n LYS 63 N -1.55 0.68 0.12 0.54 4.76 -1.26 -4.46 118.16 116.99 1ike n LYS 63 Ca 0.03 0.29 0.11 0.00 -2.87 0.00 0.00 58.31 55.88 1ike n LYS 63 Cb 0.17 -1.64 0.02 0.00 -1.84 0.00 0.00 35.03 31.74 1ike n LYS 63 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 1ike h THR 64 N -0.27 0.02 0.00 -0.18 1.35 -1.95 -3.47 112.91 108.41 1ike h THR 64 Ca -0.48 -1.03 0.00 0.00 -0.55 0.00 0.00 66.41 64.34 1ike h THR 64 Cb 1.82 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.83 1ike h THR 64 CO -0.07 0.01 0.00 0.00 -0.25 0.00 0.00 175.52 175.21 1ike n GLN 65 N -2.75 -0.07 -1.68 4.72 6.02 0.27 -5.01 117.38 118.89 1ike n GLN 65 Ca 0.00 0.02 -0.44 0.00 -0.01 0.00 0.00 57.00 56.57 1ike n GLN 65 Cb 0.56 -2.92 -0.04 0.00 1.02 0.00 0.00 30.24 28.86 1ike n GLN 65 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1ike n ASP 66 N -0.03 3.74 -4.06 1.08 2.03 -1.24 -4.75 116.55 113.32 1ike n ASP 66 Ca 0.00 0.99 -0.23 0.00 0.52 0.00 0.00 54.79 56.07 1ike n ASP 66 Cb 0.02 -1.48 -0.16 0.00 -0.72 0.00 0.00 41.12 38.78 1ike n ASP 66 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1ike s THR 67 N 2.93 1.07 -0.10 5.18 2.01 -1.26 -1.03 115.64 124.45 1ike s THR 67 Ca 0.85 -0.52 -0.26 0.00 0.31 0.00 0.00 61.69 62.08 1ike s THR 67 Cb -0.57 -0.94 0.06 0.00 0.01 0.00 0.00 72.50 71.07 1ike s THR 67 CO 0.42 0.32 0.60 0.72 -0.69 0.00 0.00 174.62 175.99 1ike s PHE 68 N 0.15 -0.59 0.13 4.92 -0.71 -0.57 -5.00 117.98 116.30 1ike s PHE 68 Ca -0.04 1.14 0.07 0.00 -1.04 0.00 0.00 56.93 57.06 1ike s PHE 68 Cb -0.10 0.31 -0.04 0.00 -1.21 0.00 0.00 43.02 41.98 1ike s PHE 68 CO 0.01 -0.50 -0.03 0.71 -1.34 0.00 0.00 175.22 174.07 1ike s TYR 69 N -0.79 2.85 0.04 3.49 1.51 -1.23 -0.89 117.35 122.33 1ike s TYR 69 Ca -0.08 -0.11 0.01 0.00 -1.01 0.00 0.00 57.07 55.88 1ike s TYR 69 Cb -0.02 -1.44 -0.03 0.00 -0.11 0.00 0.00 41.96 40.36 1ike s TYR 69 CO 0.07 0.48 -0.06 -0.51 -1.11 0.00 0.00 175.55 174.41 1ike s ASP 70 N -2.53 0.70 0.02 2.29 1.11 -0.56 -1.52 116.67 116.17 1ike s ASP 70 Ca 0.25 -0.60 0.03 0.00 0.18 0.00 0.00 52.55 52.42 1ike s ASP 70 Cb -0.11 0.07 -0.01 0.00 1.07 0.00 0.00 42.92 43.94 1ike s ASP 70 CO 0.17 -0.27 -0.10 0.68 1.18 0.00 0.00 175.17 176.83 1ike s VAL 71 N -1.71 0.74 0.03 -1.27 -7.23 -0.19 -0.56 120.40 110.22 1ike s VAL 71 Ca -0.09 -0.67 0.01 0.00 -1.81 0.00 0.00 61.98 59.42 1ike s VAL 71 Cb -0.08 -0.68 -0.02 0.00 0.56 0.00 0.00 36.38 36.16 1ike s VAL 71 CO -0.01 0.01 -0.05 -0.44 -0.31 0.00 0.00 175.10 174.30 1ike s SER 72 N -0.74 0.56 -0.28 4.85 0.01 -0.13 -1.32 113.70 116.65 1ike s SER 72 Ca 0.00 -0.55 -0.16 0.00 1.31 0.00 0.00 55.95 56.55 1ike s SER 72 Cb -0.06 0.07 -0.03 0.00 0.21 0.00 0.00 66.02 66.21 1ike s SER 72 CO 0.00 -0.27 0.41 -0.70 0.41 0.00 0.00 173.24 173.09 1ike s GLU 73 N -1.65 3.98 0.19 12.44 -6.30 -1.26 -1.69 118.70 124.41 1ike s GLU 73 Ca -0.12 0.06 -0.23 0.00 -2.50 0.00 0.00 54.97 52.18 1ike s GLU 73 Cb -0.09 -3.67 -0.08 0.00 0.00 0.00 0.00 34.13 30.29 1ike s GLU 73 CO -0.01 -0.33 0.76 -0.51 0.02 0.00 0.00 175.26 175.19 1ike s LEU 74 N 2.14 4.48 -0.10 2.70 1.02 0.89 -4.16 118.68 125.66 1ike s LEU 74 Ca 0.16 1.56 -0.03 0.00 0.02 0.00 0.00 54.13 55.84 1ike s LEU 74 Cb -0.16 -3.43 -0.03 0.00 0.02 0.00 0.00 46.19 42.59 1ike s LEU 74 CO 0.10 0.13 0.04 -1.10 0.02 0.00 0.00 176.35 175.54 1ike s GLN 75 N -1.51 3.11 -0.02 1.70 -1.52 -0.20 -4.62 119.66 116.61 1ike s GLN 75 Ca 0.39 -0.33 -0.27 0.00 -1.95 0.00 0.00 55.36 53.20 1ike s GLN 75 Cb -0.20 -2.90 -0.03 0.00 -0.22 0.00 0.00 33.01 29.65 1ike s GLN 75 CO 0.24 0.72 0.85 0.08 -0.25 0.00 0.00 175.29 176.93 1ike s VAL 76 N -0.91 4.93 -0.23 1.09 1.01 -1.26 -0.88 120.40 124.15 1ike s VAL 76 Ca 0.14 1.78 0.04 0.00 0.00 0.00 0.00 61.98 63.93 1ike s VAL 76 Cb -0.12 -4.19 -0.17 0.00 0.00 0.00 0.00 36.38 31.91 1ike s VAL 76 CO 0.03 0.21 -0.17 -0.62 0.00 0.00 0.00 175.10 174.55 1ike n GLU 77 N 3.78 0.65 -3.81 2.72 -0.58 -0.22 -4.92 120.64 118.26 1ike n GLU 77 Ca 0.02 0.11 -0.01 0.00 -0.42 0.00 0.00 57.16 56.87 1ike n GLU 77 Cb 0.51 -1.47 0.01 0.00 -0.57 0.00 0.00 31.44 29.91 1ike n GLU 77 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1ike s SER 78 N -6.13 -0.05 0.05 1.62 1.04 -1.09 -5.02 113.70 104.11 1ike s SER 78 Ca -0.28 -0.42 -0.30 0.00 0.48 0.00 0.00 55.95 55.42 1ike s SER 78 Cb 0.08 0.37 -0.08 0.00 0.10 0.00 0.00 66.02 66.48 1ike s SER 78 CO 0.58 -0.71 1.72 -0.22 0.98 0.00 0.00 173.24 175.59 1ike s LEU 79 N -3.28 4.37 0.00 2.42 2.96 -1.26 -1.33 118.68 122.57 1ike s LEU 79 Ca 0.19 2.49 0.00 0.00 -0.22 0.00 0.00 54.13 56.60 1ike s LEU 79 Cb -0.00 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.13 1ike s LEU 79 CO 0.02 -0.93 0.00 0.61 -1.32 0.00 0.00 176.35 174.72 1ike n GLY 80 N 4.13 0.86 2.94 7.98 0.00 -1.26 -4.74 105.19 115.10 1ike n GLY 80 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 1ike n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ike s LYS 81 N -0.37 1.65 0.08 1.61 1.02 -0.44 -0.97 119.74 122.33 1ike s LYS 81 Ca 0.00 -0.32 0.04 0.00 0.02 0.00 0.00 55.97 55.71 1ike s LYS 81 Cb 0.00 -1.63 -0.03 0.00 -0.52 0.00 0.00 37.83 35.64 1ike s LYS 81 CO 0.00 -0.22 -0.11 0.71 -0.92 0.00 0.00 175.35 174.81 1ike s TYR 82 N 1.54 1.02 -0.15 3.18 2.02 -0.05 -1.05 117.35 123.85 1ike s TYR 82 Ca 0.02 -0.58 -0.02 0.00 -0.37 0.00 0.00 57.07 56.13 1ike s TYR 82 Cb -0.13 -0.57 -0.02 0.00 -0.40 0.00 0.00 41.96 40.84 1ike s TYR 82 CO -0.07 -0.01 -0.08 0.99 -1.57 0.00 0.00 175.55 174.81 1ike s THR 83 N -1.94 3.44 -0.27 -0.71 2.01 -0.06 -1.13 115.64 117.00 1ike s THR 83 Ca 0.00 -0.52 0.03 0.00 0.31 0.00 0.00 61.69 61.52 1ike s THR 83 Cb -0.06 -2.49 0.06 0.00 0.01 0.00 0.00 72.50 70.03 1ike s THR 83 CO 0.01 0.50 -0.10 0.00 -0.69 0.00 0.00 174.62 174.34 1ike s ALA 84 N 0.45 2.58 -0.37 7.40 0.00 0.75 -1.03 121.76 131.54 1ike s ALA 84 Ca -0.07 -1.82 -0.27 0.00 0.00 0.00 0.00 51.96 49.81 1ike s ALA 84 Cb -0.15 -1.61 0.02 0.00 0.00 0.00 0.00 23.12 21.37 1ike s ALA 84 CO 0.04 -1.24 0.99 -0.80 0.00 0.00 0.00 175.76 174.75 1ike s ASN 85 N 1.09 6.74 0.22 0.00 0.01 -1.26 -1.55 114.94 120.20 1ike s ASN 85 Ca -0.07 0.68 -0.03 0.00 -0.71 0.00 0.00 52.86 52.72 1ike s ASN 85 Cb -0.20 -2.50 -0.05 0.00 0.41 0.00 0.00 41.25 38.92 1ike s ASN 85 CO -0.05 -0.92 0.46 0.72 -1.51 0.00 0.00 177.10 175.79 1ike s PHE 86 N 3.65 3.48 -0.06 2.20 -0.12 -1.19 -4.13 117.98 121.82 1ike s PHE 86 Ca 0.41 0.51 0.05 0.00 -0.05 0.00 0.00 56.93 57.85 1ike s PHE 86 Cb -0.11 -1.99 -0.00 0.00 -0.63 0.00 0.00 43.02 40.28 1ike s PHE 86 CO 0.20 0.31 -0.20 -1.59 -0.05 0.00 0.00 175.22 173.88 1ike s LYS 87 N -3.26 2.18 0.05 1.99 -2.85 -0.43 -4.25 119.74 113.16 1ike s LYS 87 Ca 0.41 -0.73 -0.30 0.00 -1.00 0.00 0.00 55.97 54.35 1ike s LYS 87 Cb -0.11 -1.84 -0.05 0.00 -2.06 0.00 0.00 37.83 33.77 1ike s LYS 87 CO 0.28 0.27 1.13 0.21 0.10 0.00 0.00 175.35 177.34 1ike s LYS 88 N 0.05 4.48 0.19 1.78 2.20 -0.63 -1.02 119.74 126.78 1ike s LYS 88 Ca -0.06 1.66 0.05 0.00 -0.36 0.00 0.00 55.97 57.25 1ike s LYS 88 Cb -0.13 -3.38 -0.05 0.00 -1.51 0.00 0.00 37.83 32.76 1ike s LYS 88 CO 0.04 -0.18 -0.07 0.14 -0.36 0.00 0.00 175.35 174.92 1ike s VAL 89 N 0.99 1.19 1.02 4.02 -7.23 -0.58 -0.27 120.40 119.54 1ike s VAL 89 Ca 0.56 -2.07 -0.17 0.00 -1.81 0.00 0.00 61.98 58.49 1ike s VAL 89 Cb -0.27 -2.06 0.23 0.00 0.56 0.00 0.00 36.38 34.84 1ike s VAL 89 CO 0.29 -0.57 1.34 1.51 -0.31 0.00 0.00 175.10 177.36 1ike s ASP 90 N -3.24 2.61 0.52 4.85 1.47 -0.50 -3.57 116.67 118.81 1ike s ASP 90 Ca 0.22 0.18 0.34 0.00 1.18 0.00 0.00 52.55 54.47 1ike s ASP 90 Cb 0.03 -0.13 1.60 0.00 -0.34 0.00 0.00 42.92 44.08 1ike s ASP 90 CO 0.04 -3.04 2.02 0.07 0.68 0.00 0.00 175.17 174.94 1ike h LYS 91 N -1.86 0.00 -0.06 2.11 2.10 -1.96 -1.46 116.57 115.44 1ike h LYS 91 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 1ike h LYS 91 Cb 1.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.55 1ike h LYS 91 CO 0.31 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.85 1ike n ASN 92 N -2.87 2.01 0.00 7.07 5.03 -1.26 -4.77 115.26 120.47 1ike n ASN 92 Ca -0.00 -1.68 0.00 0.00 0.87 0.00 0.00 54.58 53.76 1ike n ASN 92 Cb 0.20 -0.03 0.00 0.00 -1.02 0.00 0.00 39.78 38.93 1ike n ASN 92 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ike n GLY 93 N 1.23 0.75 3.74 7.41 0.00 -0.55 -4.98 105.19 112.78 1ike n GLY 93 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1ike n GLY 93 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ike s ASN 94 N -2.49 7.21 0.06 1.61 0.01 -1.26 -4.77 114.94 115.32 1ike s ASN 94 Ca 0.00 2.12 -0.30 0.00 -0.71 0.00 0.00 52.86 53.97 1ike s ASN 94 Cb 0.00 -2.60 -0.05 0.00 0.41 0.00 0.00 41.25 39.00 1ike s ASN 94 CO 0.00 -0.27 1.16 -0.69 -1.51 0.00 0.00 177.10 175.79 1ike s VAL 95 N -0.12 4.14 -0.20 1.60 1.01 -1.26 -1.41 120.40 124.16 1ike s VAL 95 Ca 0.51 1.56 0.04 0.00 0.00 0.00 0.00 61.98 64.08 1ike s VAL 95 Cb -0.30 -4.00 -0.15 0.00 0.00 0.00 0.00 36.38 31.93 1ike s VAL 95 CO 0.35 0.13 -0.15 0.29 0.00 0.00 0.00 175.10 175.72 1ike n LYS 96 N 3.81 0.65 -3.74 2.72 5.02 0.62 -4.92 118.16 122.32 1ike n LYS 96 Ca 0.08 0.10 -0.23 0.00 -2.02 0.00 0.00 58.31 56.24 1ike n LYS 96 Cb 0.47 -1.42 -0.17 0.00 -0.02 0.00 0.00 35.03 33.89 1ike n LYS 96 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ike s VAL 97 N -2.42 0.27 0.80 -0.18 1.01 -0.65 -4.97 120.40 114.25 1ike s VAL 97 Ca -0.25 0.08 -0.11 0.00 0.00 0.00 0.00 61.98 61.70 1ike s VAL 97 Cb 0.07 -0.52 0.07 0.00 0.00 0.00 0.00 36.38 36.00 1ike s VAL 97 CO 0.51 0.16 1.09 0.00 0.00 0.00 0.00 175.10 176.86 1ike s ALA 98 N 2.01 2.16 0.32 5.51 0.00 -1.26 -1.60 121.76 128.89 1ike s ALA 98 Ca 0.04 -0.02 -0.29 0.00 0.00 0.00 0.00 51.96 51.70 1ike s ALA 98 Cb -0.13 -3.18 -0.12 0.00 0.00 0.00 0.00 23.12 19.69 1ike s ALA 98 CO -0.05 -1.80 1.33 0.28 0.00 0.00 0.00 175.76 175.52 1ike n VAL 99 N -3.51 1.78 -3.81 0.00 0.31 -1.26 -4.80 118.33 107.04 1ike n VAL 99 Ca 0.08 -0.45 -0.12 0.00 -0.01 0.00 0.00 64.34 63.84 1ike n VAL 99 Cb 0.55 -1.59 -0.10 0.00 -0.91 0.00 0.00 33.84 31.79 1ike n VAL 99 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1ike s THR 100 N -0.87 0.05 0.29 2.52 -1.32 -1.26 -5.07 115.64 109.97 1ike s THR 100 Ca 0.58 -0.44 -0.30 0.00 -1.21 0.00 0.00 61.69 60.32 1ike s THR 100 Cb -0.57 -0.47 -0.11 0.00 -1.51 0.00 0.00 72.50 69.84 1ike s THR 100 CO 0.60 -0.24 1.50 0.00 -2.21 0.00 0.00 174.62 174.26 1ike s ALA 101 N -0.97 3.66 0.00 11.08 0.00 -1.26 -1.99 121.76 132.28 1ike s ALA 101 Ca -0.10 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.30 1ike s ALA 101 Cb -0.05 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.47 1ike s ALA 101 CO 0.02 -0.87 0.00 0.41 0.00 0.00 0.00 175.76 175.33 1ike n GLY 102 N 1.91 2.79 3.29 0.00 0.00 -1.26 -4.89 105.19 107.03 1ike n GLY 102 Ca 0.06 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.63 1ike n GLY 102 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ike s ASN 103 N -1.28 6.31 0.06 1.61 -0.87 -0.84 -2.84 114.94 117.08 1ike s ASN 103 Ca 0.00 -2.30 -0.23 0.00 -1.57 0.00 0.00 52.86 48.76 1ike s ASN 103 Cb 0.00 -2.16 0.06 0.00 -0.02 0.00 0.00 41.25 39.13 1ike s ASN 103 CO 0.00 -0.67 0.54 -0.72 -2.57 0.00 0.00 177.10 173.68 1ike s TYR 104 N 0.79 -0.45 0.11 2.20 1.13 -0.30 -3.14 117.35 117.68 1ike s TYR 104 Ca 0.11 0.49 0.09 0.00 -1.41 0.00 0.00 57.07 56.36 1ike s TYR 104 Cb -0.20 0.37 -0.04 0.00 -1.10 0.00 0.00 41.96 41.00 1ike s TYR 104 CO -0.03 -0.67 -0.23 1.52 -2.51 0.00 0.00 175.55 173.63 1ike s TYR 105 N -2.55 1.97 0.32 -3.49 1.13 -0.59 -0.56 117.35 113.57 1ike s TYR 105 Ca -0.05 -0.40 0.01 0.00 -1.41 0.00 0.00 57.07 55.22 1ike s TYR 105 Cb -0.01 -1.08 -0.03 0.00 -1.10 0.00 0.00 41.96 39.74 1ike s TYR 105 CO -0.02 0.24 0.51 0.95 -2.51 0.00 0.00 175.55 174.71 1ike s THR 106 N -1.11 5.14 -0.12 -3.49 -4.23 -0.09 -0.18 115.64 111.56 1ike s THR 106 Ca 0.09 -0.54 -0.04 0.00 -1.18 0.00 0.00 61.69 60.02 1ike s THR 106 Cb -0.10 -3.85 0.06 0.00 1.34 0.00 0.00 72.50 69.95 1ike s THR 106 CO 0.05 -0.49 0.17 0.12 -0.54 0.00 0.00 174.62 173.93 1ike s PHE 107 N -2.23 -0.19 -0.13 3.99 5.36 -0.28 -1.99 117.98 122.52 1ike s PHE 107 Ca 0.39 0.48 0.02 0.00 -0.96 0.00 0.00 56.93 56.86 1ike s PHE 107 Cb -0.10 -0.30 0.00 0.00 -0.34 0.00 0.00 43.02 42.28 1ike s PHE 107 CO 0.34 -0.37 -0.21 0.99 -1.46 0.00 0.00 175.22 174.52 1ike s THR 108 N 2.30 2.26 -0.55 0.12 2.01 -0.13 -0.87 115.64 120.77 1ike s THR 108 Ca 0.04 -0.93 -0.19 0.00 0.31 0.00 0.00 61.69 60.92 1ike s THR 108 Cb -0.13 -1.90 0.09 0.00 0.01 0.00 0.00 72.50 70.56 1ike s THR 108 CO -0.08 0.55 0.64 -0.69 -0.69 0.00 0.00 174.62 174.35 1ike s VAL 109 N 0.59 4.90 0.11 3.82 1.01 -0.14 -0.74 120.40 129.95 1ike s VAL 109 Ca -0.12 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.08 1ike s VAL 109 Cb -0.16 -4.38 -0.22 0.00 0.00 0.00 0.00 36.38 31.62 1ike s VAL 109 CO 0.03 -0.95 1.26 0.24 0.00 0.00 0.00 175.10 175.69 1ike h MET 110 N 9.06 0.03 -2.64 2.72 2.86 -1.23 -0.46 114.93 125.27 1ike h MET 110 Ca -0.29 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.20 1ike h MET 110 Cb 1.09 0.02 -0.22 0.00 0.06 0.00 0.00 31.60 32.55 1ike h MET 110 CO 1.03 1.02 -0.15 -0.47 1.06 0.00 0.00 176.91 179.40 1ike s TYR 111 N -2.70 -0.45 -0.13 -0.22 5.04 -1.03 -2.95 117.35 114.91 1ike s TYR 111 Ca 0.00 0.99 -0.26 0.00 -2.44 0.00 0.00 57.07 55.36 1ike s TYR 111 Cb 0.10 0.18 0.06 0.00 0.35 0.00 0.00 41.96 42.65 1ike s TYR 111 CO 0.83 -0.33 0.64 0.00 -1.34 0.00 0.00 175.55 175.35 1ike s ALA 112 N -0.32 -1.63 0.00 3.97 0.00 -1.26 -0.90 121.76 121.61 1ike s ALA 112 Ca -0.05 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.40 1ike s ALA 112 Cb -0.03 -0.47 0.00 0.00 0.00 0.00 0.00 23.12 22.61 1ike s ALA 112 CO 0.03 -0.34 0.00 -0.40 0.00 0.00 0.00 175.76 175.05 1ike n ASP 113 N 1.74 0.18 0.11 0.00 5.68 -0.08 -4.95 116.55 119.23 1ike n ASP 113 Ca -0.17 -0.34 0.12 0.00 -0.50 0.00 0.00 54.79 53.90 1ike n ASP 113 Cb 0.56 0.00 0.46 0.00 -1.14 0.00 0.00 41.12 41.00 1ike n ASP 113 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1ike n ASP 114 N -0.96 0.63 0.00 -1.12 8.00 -1.26 -3.79 116.55 118.06 1ike n ASP 114 Ca 0.00 0.62 0.00 0.00 0.71 0.00 0.00 54.79 56.12 1ike n ASP 114 Cb 0.00 -0.77 0.00 0.00 -0.02 0.00 0.00 41.12 40.33 1ike n ASP 114 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1ike n SER 115 N -2.16 2.60 -3.94 -2.24 7.64 -1.26 -4.86 113.62 109.39 1ike n SER 115 Ca 0.03 -0.21 -0.09 0.00 1.01 0.00 0.00 58.87 59.62 1ike n SER 115 Cb 0.28 0.94 -0.09 0.00 -1.01 0.00 0.00 64.21 64.33 1ike n SER 115 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ike s SER 116 N -1.46 0.23 0.15 6.43 1.04 -1.25 -0.84 113.70 118.00 1ike s SER 116 Ca 0.00 -0.69 -0.19 0.00 0.48 0.00 0.00 55.95 55.55 1ike s SER 116 Cb 0.00 0.26 0.05 0.00 0.10 0.00 0.00 66.02 66.43 1ike s SER 116 CO 0.00 -0.61 0.50 0.00 0.98 0.00 0.00 173.24 174.12 1ike s ALA 117 N -3.35 -1.23 -0.13 5.32 0.00 -0.66 -0.90 121.76 120.81 1ike s ALA 117 Ca 0.01 0.17 0.01 0.00 0.00 0.00 0.00 51.96 52.15 1ike s ALA 117 Cb 0.03 0.79 0.02 0.00 0.00 0.00 0.00 23.12 23.97 1ike s ALA 117 CO -0.08 -0.72 -0.14 -1.17 0.00 0.00 0.00 175.76 173.65 1ike s LEU 118 N -2.79 1.68 0.21 0.00 2.96 -0.07 -0.53 118.68 120.14 1ike s LEU 118 Ca 0.03 -0.46 0.10 0.00 -0.22 0.00 0.00 54.13 53.58 1ike s LEU 118 Cb 0.00 -1.13 -0.05 0.00 0.50 0.00 0.00 46.19 45.51 1ike s LEU 118 CO -0.11 -0.03 -0.19 0.27 -1.32 0.00 0.00 176.35 174.96 1ike s ILE 119 N 1.31 2.14 0.01 6.68 -4.36 -0.37 -0.91 121.20 125.69 1ike s ILE 119 Ca 0.01 -2.15 0.04 0.00 -0.26 0.00 0.00 60.65 58.29 1ike s ILE 119 Cb -0.14 -2.09 -0.03 0.00 1.25 0.00 0.00 42.46 41.46 1ike s ILE 119 CO -0.07 -0.35 -0.10 -2.28 0.24 0.00 0.00 174.94 172.39 1ike s HIS 120 N -2.27 2.80 0.01 1.37 5.65 0.08 -1.31 115.29 121.63 1ike s HIS 120 Ca 0.23 -0.09 0.01 0.00 0.25 0.00 0.00 55.06 55.45 1ike s HIS 120 Cb -0.05 -1.58 -0.01 0.00 -1.18 0.00 0.00 32.58 29.76 1ike s HIS 120 CO 0.10 0.33 -0.05 -0.08 -0.65 0.00 0.00 174.74 174.39 1ike s THR 121 N -0.95 0.33 -0.23 0.89 -1.32 0.01 -0.96 115.64 113.41 1ike s THR 121 Ca 0.16 -0.46 0.02 0.00 -1.21 0.00 0.00 61.69 60.20 1ike s THR 121 Cb -0.11 -0.34 0.05 0.00 -1.51 0.00 0.00 72.50 70.59 1ike s THR 121 CO 0.06 -0.09 -0.10 0.00 -2.21 0.00 0.00 174.62 172.28 1ike s LEU 123 N 1.29 4.36 -0.11 0.00 2.96 -1.25 -0.91 118.68 125.02 1ike s LEU 123 Ca -0.04 0.91 0.04 0.00 -0.22 0.00 0.00 54.13 54.81 1ike s LEU 123 Cb -0.18 -2.69 0.00 0.00 0.50 0.00 0.00 46.19 43.82 1ike s LEU 123 CO -0.07 0.13 -0.23 -1.00 -1.32 0.00 0.00 176.35 173.86 1ike s HIS 124 N -0.07 2.51 -0.31 5.38 3.76 0.28 -4.42 115.29 122.42 1ike s HIS 124 Ca 0.26 -1.08 0.02 0.00 -0.15 0.00 0.00 55.06 54.11 1ike s HIS 124 Cb -0.16 -1.69 0.16 0.00 1.11 0.00 0.00 32.58 31.99 1ike s HIS 124 CO 0.12 -0.45 0.39 0.21 -0.85 0.00 0.00 174.74 174.17 1ike s LYS 125 N 0.45 0.46 6.73 1.40 2.20 -1.19 -1.15 119.74 128.64 1ike s LYS 125 Ca -0.16 -0.12 0.00 0.00 -0.36 0.00 0.00 55.97 55.32 1ike s LYS 125 Cb -0.17 -0.43 0.00 0.00 -1.51 0.00 0.00 37.83 35.72 1ike s LYS 125 CO 0.07 -1.07 0.00 0.41 -0.36 0.00 0.00 175.35 174.39 1ike n GLY 126 N 5.10 2.88 0.95 5.54 0.00 -1.13 -2.50 105.19 116.03 1ike n GLY 126 Ca 0.03 -0.31 0.04 0.00 0.00 0.00 0.00 46.02 45.77 1ike n GLY 126 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ike n ASN 127 N 3.43 2.66 -4.86 1.61 2.04 -1.26 -4.93 115.26 113.95 1ike n ASN 127 Ca 0.00 -2.26 -0.31 0.00 -0.44 0.00 0.00 54.58 51.57 1ike n ASN 127 Cb 0.00 -0.45 -0.04 0.00 -2.53 0.00 0.00 39.78 36.76 1ike n ASN 127 CO 0.00 0.00 0.00 -0.75 -0.44 0.00 0.00 177.26 176.07 1ike s LYS 128 N -1.71 3.87 -0.31 -3.83 2.20 -1.04 -5.06 119.74 113.86 1ike s LYS 128 Ca 0.24 0.59 -0.15 0.00 -0.36 0.00 0.00 55.97 56.30 1ike s LYS 128 Cb 0.16 -2.36 -0.02 0.00 -1.51 0.00 0.00 37.83 34.09 1ike s LYS 128 CO 0.10 -0.02 0.37 0.16 -0.36 0.00 0.00 175.35 175.61 1ike s ASP 129 N -2.90 6.21 0.19 1.43 1.47 -1.26 -4.65 116.67 117.16 1ike s ASP 129 Ca 0.53 0.02 0.00 0.00 1.18 0.00 0.00 52.55 54.28 1ike s ASP 129 Cb -0.10 -2.20 0.00 0.00 -0.34 0.00 0.00 42.92 40.27 1ike s ASP 129 CO 0.27 -0.27 0.00 0.18 0.68 0.00 0.00 175.17 176.04 1ike n LEU 130 N 5.37 0.45 0.00 2.11 4.77 -1.26 -4.86 117.00 123.58 1ike n LEU 130 Ca -0.09 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1ike n LEU 130 Cb 0.50 0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1ike n LEU 130 CO 0.39 -0.75 0.00 0.61 -1.33 0.00 0.00 177.39 176.31 1ike n GLY 131 N 2.51 0.88 3.83 -0.72 0.00 -1.26 -4.54 105.19 105.88 1ike n GLY 131 Ca 0.00 -2.12 -0.33 0.00 0.00 0.00 0.00 46.02 43.57 1ike n GLY 131 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ike s ASP 132 N 0.00 6.91 -0.06 1.61 1.11 -1.26 -3.87 116.67 121.11 1ike s ASP 132 Ca 0.00 1.61 -0.02 0.00 0.18 0.00 0.00 52.55 54.31 1ike s ASP 132 Cb 0.00 -2.51 0.04 0.00 1.07 0.00 0.00 42.92 41.52 1ike s ASP 132 CO 0.00 -0.32 0.13 -0.22 1.18 0.00 0.00 175.17 175.94 1ike s LEU 133 N -3.12 0.56 0.05 1.23 0.20 -0.57 -1.46 118.68 115.57 1ike s LEU 133 Ca 0.60 0.26 0.01 0.00 0.69 0.00 0.00 54.13 55.69 1ike s LEU 133 Cb -0.09 0.25 -0.04 0.00 -0.43 0.00 0.00 46.19 45.88 1ike s LEU 133 CO 0.14 -0.17 0.10 -0.31 -0.29 0.00 0.00 176.35 175.82 1ike s TYR 134 N 1.47 3.28 -0.02 5.38 2.02 0.29 -0.81 117.35 128.96 1ike s TYR 134 Ca -0.06 0.15 -0.01 0.00 -0.37 0.00 0.00 57.07 56.78 1ike s TYR 134 Cb -0.12 -1.68 0.01 0.00 -0.40 0.00 0.00 41.96 39.77 1ike s TYR 134 CO -0.05 0.54 0.04 0.00 -1.57 0.00 0.00 175.55 174.51 1ike s ALA 135 N -1.35 -0.03 -0.16 3.71 0.00 -0.43 -0.64 121.76 122.86 1ike s ALA 135 Ca 0.28 0.20 -0.20 0.00 0.00 0.00 0.00 51.96 52.24 1ike s ALA 135 Cb -0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 1ike s ALA 135 CO 0.21 -0.06 0.60 0.08 0.00 0.00 0.00 175.76 176.59 1ike s VAL 136 N 0.46 5.07 0.19 0.00 1.01 0.49 -1.23 120.40 126.39 1ike s VAL 136 Ca -0.04 1.16 0.09 0.00 0.00 0.00 0.00 61.98 63.19 1ike s VAL 136 Cb -0.05 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 1ike s VAL 136 CO -0.01 0.19 -0.07 -0.76 0.00 0.00 0.00 175.10 174.44 1ike s LEU 137 N 1.42 3.05 -0.01 3.92 1.43 0.31 -0.27 118.68 128.54 1ike s LEU 137 Ca 0.29 -0.56 -0.10 0.00 -1.03 0.00 0.00 54.13 52.73 1ike s LEU 137 Cb -0.16 -1.70 0.01 0.00 0.03 0.00 0.00 46.19 44.37 1ike s LEU 137 CO 0.12 0.09 0.20 0.21 0.23 0.00 0.00 176.35 177.19 1ike s ASN 138 N -2.96 -0.06 0.50 2.29 3.84 -0.72 -1.66 114.94 116.17 1ike s ASN 138 Ca 0.26 -0.08 0.27 0.00 0.21 0.00 0.00 52.86 53.52 1ike s ASN 138 Cb -0.08 0.25 1.32 0.00 -0.55 0.00 0.00 41.25 42.19 1ike s ASN 138 CO 0.16 -0.39 2.00 0.03 -2.79 0.00 0.00 177.10 176.12 1ike h ARG 139 N 4.18 0.00 -4.98 0.43 2.47 -1.25 -1.32 114.38 113.91 1ike h ARG 139 Ca -0.30 0.00 -0.65 0.00 -1.26 0.00 0.00 59.98 57.77 1ike h ARG 139 Cb 1.19 0.00 -0.22 0.00 -1.65 0.00 0.00 29.97 29.29 1ike h ARG 139 CO 0.40 0.14 -0.61 1.21 0.56 0.00 0.00 179.97 181.67 1ike s ASN 140 N -6.10 5.21 0.64 7.04 3.84 -1.26 -4.83 114.94 119.48 1ike s ASN 140 Ca -0.02 -0.17 0.41 0.00 0.21 0.00 0.00 52.86 53.29 1ike s ASN 140 Cb 0.12 -1.93 2.15 0.00 -0.55 0.00 0.00 41.25 41.04 1ike s ASN 140 CO 0.59 -0.02 2.28 0.07 -2.79 0.00 0.00 177.10 177.23 1ike h LYS 141 N 8.11 0.00 -0.42 0.43 2.10 -1.94 -2.12 116.57 122.73 1ike h LYS 141 Ca -0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 1ike h LYS 141 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1ike h LYS 141 CO 0.58 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.79 1ike n ASP 142 N -3.12 3.22 -4.71 7.07 8.00 -1.26 -4.92 116.55 120.84 1ike n ASP 142 Ca -0.02 -1.93 -0.42 0.00 0.71 0.00 0.00 54.79 53.13 1ike n ASP 142 Cb 0.13 -0.27 -0.03 0.00 -0.02 0.00 0.00 41.12 40.93 1ike n ASP 142 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ike s ALA 143 N -1.12 3.41 0.42 2.24 0.00 -0.80 -5.00 121.76 120.91 1ike s ALA 143 Ca 0.33 0.79 -0.25 0.00 0.00 0.00 0.00 51.96 52.82 1ike s ALA 143 Cb 0.18 -3.46 -0.08 0.00 0.00 0.00 0.00 23.12 19.76 1ike s ALA 143 CO 0.24 -0.51 1.24 0.00 0.00 0.00 0.00 175.76 176.73 1ike s ALA 144 N 1.36 3.15 0.05 0.00 0.00 -1.26 -4.94 121.76 120.12 1ike s ALA 144 Ca 0.58 1.11 -0.32 0.00 0.00 0.00 0.00 51.96 53.33 1ike s ALA 144 Cb -0.28 -3.44 -0.11 0.00 0.00 0.00 0.00 23.12 19.29 1ike s ALA 144 CO 0.27 -0.74 1.86 0.00 0.00 0.00 0.00 175.76 177.15 1ike n ALA 145 N -0.06 1.59 -2.39 0.00 0.00 -1.26 -4.99 120.51 113.40 1ike n ALA 145 Ca 0.05 0.29 -0.22 0.00 0.00 0.00 0.00 53.44 53.56 1ike n ALA 145 Cb 0.45 -2.57 0.14 0.00 0.00 0.00 0.00 19.45 17.48 1ike n ALA 145 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ike n GLY 146 N 4.28 0.01 0.22 0.00 0.00 -1.26 -4.86 105.19 103.57 1ike n GLY 146 Ca 0.20 -1.93 -0.06 0.00 0.00 0.00 0.00 46.02 44.22 1ike n GLY 146 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ike h ASP 147 N -0.92 0.51 0.10 1.61 3.32 -1.98 -1.42 116.42 117.64 1ike h ASP 147 Ca -0.35 -0.23 0.02 0.00 0.02 0.00 0.00 57.03 56.49 1ike h ASP 147 Cb 1.18 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 40.55 1ike h ASP 147 CO 0.33 0.87 -0.37 0.11 -1.72 0.00 0.00 179.24 178.46 1ike h LYS 148 N 0.39 -0.57 -0.00 3.56 1.57 -1.99 0.15 116.57 119.68 1ike h LYS 148 Ca 0.03 0.04 -0.17 0.00 -1.87 0.00 0.00 60.65 58.68 1ike h LYS 148 Cb 0.90 0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 1ike h LYS 148 CO 0.08 -0.38 -0.79 -0.24 -0.57 0.00 0.00 179.45 177.55 1ike h VAL 149 N -0.59 1.52 -0.16 0.50 3.04 -1.93 -1.87 116.25 116.77 1ike h VAL 149 Ca 0.03 -2.58 -0.14 0.00 -1.01 0.00 0.00 66.70 63.00 1ike h VAL 149 Cb 0.63 2.40 -0.01 0.00 -2.01 0.00 0.00 31.29 32.30 1ike h VAL 149 CO -0.23 0.74 -0.48 0.11 -1.01 0.00 0.00 177.57 176.70 1ike h LYS 150 N 0.04 0.42 -0.56 4.17 1.57 -1.11 -1.39 116.57 119.72 1ike h LYS 150 Ca -0.02 -0.24 -0.05 0.00 -1.87 0.00 0.00 60.65 58.48 1ike h LYS 150 Cb 1.38 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.68 1ike h LYS 150 CO 0.11 0.81 0.15 0.77 -0.57 0.00 0.00 179.45 180.72 1ike h SER 151 N 0.34 0.79 -0.02 0.86 0.02 -0.55 -1.43 113.55 113.55 1ike h SER 151 Ca 0.02 -0.13 -0.08 0.00 -0.84 0.00 0.00 61.79 60.75 1ike h SER 151 Cb 0.97 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.29 1ike h SER 151 CO 0.08 0.76 -0.21 0.00 -1.14 0.00 0.00 176.83 176.32 1ike h ALA 152 N 1.35 1.23 -0.20 3.77 0.00 -0.71 0.16 119.26 124.87 1ike h ALA 152 Ca 0.18 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1ike h ALA 152 Cb 0.27 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1ike h ALA 152 CO -0.00 0.50 0.13 0.28 0.00 0.00 0.00 179.25 180.16 1ike h VAL 153 N 0.36 1.05 -0.89 0.00 2.07 -0.68 -1.56 116.25 116.59 1ike h VAL 153 Ca 0.06 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 1ike h VAL 153 Cb 0.58 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 1ike h VAL 153 CO 0.04 0.05 0.54 -1.28 0.02 0.00 0.00 177.57 176.93 1ike h SER 154 N 0.26 1.07 0.37 0.57 0.87 -0.59 -1.77 113.55 114.34 1ike h SER 154 Ca 0.07 -0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.55 1ike h SER 154 Cb -0.03 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 61.66 1ike h SER 154 CO -0.02 0.82 -0.08 0.00 -0.53 0.00 0.00 176.83 177.02 1ike h ALA 155 N 1.29 1.23 -0.20 6.23 0.00 -0.30 0.93 119.26 128.44 1ike h ALA 155 Ca 0.32 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1ike h ALA 155 Cb -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1ike h ALA 155 CO -0.06 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.29 1ike n ALA 156 N -2.24 2.49 -3.54 0.00 0.00 -0.62 -4.88 120.51 111.72 1ike n ALA 156 Ca -0.02 -0.36 -0.23 0.00 0.00 0.00 0.00 53.44 52.84 1ike n ALA 156 Cb 0.21 -0.99 0.08 0.00 0.00 0.00 0.00 19.45 18.76 1ike n ALA 156 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1ike n THR 157 N 0.09 -3.06 -4.45 0.00 -1.04 0.32 -5.03 114.28 101.11 1ike n THR 157 Ca 0.07 -0.03 -0.23 0.00 -2.04 0.00 0.00 64.05 61.82 1ike n THR 157 Cb 0.19 -3.96 -0.10 0.00 -1.82 0.00 0.00 70.33 64.64 1ike n THR 157 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1ike s LEU 158 N -7.00 2.59 -0.24 -4.42 1.43 -0.89 -5.04 118.68 105.11 1ike s LEU 158 Ca 0.53 -1.04 -0.04 0.00 -1.03 0.00 0.00 54.13 52.54 1ike s LEU 158 Cb -0.23 -0.99 0.00 0.00 0.03 0.00 0.00 46.19 44.99 1ike s LEU 158 CO 0.70 -0.03 -0.02 -0.70 0.23 0.00 0.00 176.35 176.54 1ike s GLU 159 N -3.55 3.23 0.48 1.70 2.56 -1.26 -3.80 118.70 118.06 1ike s GLU 159 Ca 0.29 -0.73 0.17 0.00 0.00 0.00 0.00 54.97 54.69 1ike s GLU 159 Cb -0.03 -3.09 1.17 0.00 2.00 0.00 0.00 34.13 34.17 1ike s GLU 159 CO 0.13 -0.29 2.04 0.35 -0.56 0.00 0.00 175.26 176.93 1ike h PHE 160 N 8.12 0.22 0.00 5.30 3.57 -1.90 0.10 116.94 132.36 1ike h PHE 160 Ca -0.38 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.13 1ike h PHE 160 Cb 1.14 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.81 1ike h PHE 160 CO 0.59 0.11 0.00 0.66 -2.23 0.00 0.00 178.31 177.45 1ike h SER 161 N 0.22 0.00 1.48 0.41 4.64 -2.01 -0.56 113.55 117.73 1ike h SER 161 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1ike h SER 161 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1ike h SER 161 CO -0.03 0.00 -0.11 0.11 -0.87 0.00 0.00 176.83 175.93 1ike h LYS 162 N 0.00 0.00 -7.00 4.77 6.56 -1.39 -3.46 116.57 116.05 1ike h LYS 162 Ca 0.00 0.00 -0.49 0.00 -1.06 0.00 0.00 60.65 59.10 1ike h LYS 162 Cb 0.13 0.00 0.04 0.00 -0.57 0.00 0.00 32.23 31.83 1ike h LYS 162 CO 0.00 0.00 0.45 -0.06 -2.06 0.00 0.00 179.45 177.78 1ike s PHE 163 N -3.14 3.01 -0.17 -1.35 0.40 -0.22 -4.91 117.98 111.61 1ike s PHE 163 Ca 0.09 1.58 -0.13 0.00 -0.60 0.00 0.00 56.93 57.87 1ike s PHE 163 Cb 0.11 -3.26 -0.05 0.00 0.51 0.00 0.00 43.02 40.34 1ike s PHE 163 CO 0.63 -1.13 0.26 0.42 0.70 0.00 0.00 175.22 176.09 1ike s ILE 164 N -1.64 5.33 0.39 0.64 -1.09 0.12 -4.82 121.20 120.13 1ike s ILE 164 Ca 0.62 0.47 -0.21 0.00 -2.23 0.00 0.00 60.65 59.30 1ike s ILE 164 Cb -0.25 -3.60 -0.10 0.00 -1.58 0.00 0.00 42.46 36.93 1ike s ILE 164 CO 0.30 0.40 0.92 -0.55 -1.23 0.00 0.00 174.94 174.78 1ike s SER 165 N 0.43 7.02 0.00 3.58 0.15 -1.26 -0.68 113.70 122.93 1ike s SER 165 Ca 0.15 1.67 0.23 0.00 0.70 0.00 0.00 55.95 58.69 1ike s SER 165 Cb -0.13 -2.53 0.11 0.00 -1.71 0.00 0.00 66.02 61.77 1ike s SER 165 CO 0.03 -0.26 1.18 0.35 1.20 0.00 0.00 173.24 175.73 1ike n THR 166 N -0.29 0.00 0.25 6.45 -2.24 -0.62 -4.67 114.28 113.17 1ike n THR 166 Ca 0.05 -0.41 0.14 0.00 -2.27 0.00 0.00 64.05 61.55 1ike n THR 166 Cb 0.53 1.40 0.61 0.00 -2.10 0.00 0.00 70.33 70.77 1ike n THR 166 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1ike h LYS 167 N 3.77 0.00 0.00 -0.78 2.10 -1.91 -1.57 116.57 118.18 1ike h LYS 167 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1ike h LYS 167 Cb 0.89 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.22 1ike h LYS 167 CO 0.00 0.12 -0.02 1.05 -2.00 0.00 0.00 179.45 178.60 1ike h GLU 168 N 0.00 0.00 0.00 0.07 -0.00 -1.97 -3.33 114.58 109.35 1ike h GLU 168 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1ike h GLU 168 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.32 1ike h GLU 168 CO 0.02 0.02 0.00 0.09 -0.00 0.00 0.00 179.01 179.13 1ike n ASN 169 N -3.11 0.00 -3.28 3.06 5.03 -0.59 -4.90 115.26 111.48 1ike n ASN 169 Ca 0.03 -0.82 -0.23 0.00 0.87 0.00 0.00 54.58 54.43 1ike n ASN 169 Cb 0.50 -0.06 0.06 0.00 -1.02 0.00 0.00 39.78 39.26 1ike n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1ike n ASN 170 N -1.06 -6.21 -4.73 6.41 4.13 -1.25 -4.91 115.26 107.64 1ike n ASN 170 Ca 0.22 -0.42 -0.42 0.00 1.68 0.00 0.00 54.58 55.64 1ike n ASN 170 Cb 0.14 -4.92 -0.03 0.00 -1.54 0.00 0.00 39.78 33.43 1ike n ASN 170 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ike s ALA 172 N 0.77 2.35 0.12 0.00 0.00 -1.26 -5.14 121.76 118.60 1ike s ALA 172 Ca 0.67 -1.06 0.10 0.00 0.00 0.00 0.00 51.96 51.68 1ike s ALA 172 Cb -0.44 -0.73 -0.04 0.00 0.00 0.00 0.00 23.12 21.92 1ike s ALA 172 CO 0.36 0.52 -0.24 0.71 0.00 0.00 0.00 175.76 177.10 1ike s TYR 173 N -0.57 2.38 -0.92 0.00 2.02 -1.26 -5.08 117.35 113.92 1ike s TYR 173 Ca 0.08 -0.34 -0.13 0.00 -0.37 0.00 0.00 57.07 56.30 1ike s TYR 173 Cb -0.11 -1.30 0.22 0.00 -0.40 0.00 0.00 41.96 40.37 1ike s TYR 173 CO 0.00 0.33 0.92 0.34 -1.57 0.00 0.00 175.55 175.57 1ike s ASP 174 N -1.99 6.89 0.37 2.29 -1.08 -1.26 -4.88 116.67 117.01 1ike s ASP 174 Ca 0.15 -2.83 0.06 0.00 -0.52 0.00 0.00 52.55 49.41 1ike s ASP 174 Cb -0.10 -2.24 0.76 0.00 -1.46 0.00 0.00 42.92 39.88 1ike s ASP 174 CO 0.07 -0.58 1.98 0.78 0.52 0.00 0.00 175.17 177.94 1ike h ASN 175 N 7.63 0.63 -0.39 -0.34 -0.26 -1.99 -2.48 115.58 118.38 1ike h ASN 175 Ca 0.14 -0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.83 1ike h ASN 175 Cb 0.99 -0.14 -0.01 0.00 -1.06 0.00 0.00 38.32 38.10 1ike h ASN 175 CO 0.87 0.42 0.03 0.44 -1.06 0.00 0.00 177.43 178.14 1ike h ASP 176 N 0.72 0.64 -0.77 5.81 3.32 -2.00 -1.36 116.42 122.79 1ike h ASP 176 Ca 0.29 -0.28 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 1ike h ASP 176 Cb 0.21 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 1ike h ASP 176 CO -0.09 0.77 0.29 0.28 -1.72 0.00 0.00 179.24 178.77 1ike h SER 177 N 0.50 1.08 -0.74 6.45 0.02 -1.82 -0.44 113.55 118.60 1ike h SER 177 Ca 0.11 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.86 1ike h SER 177 Cb 0.41 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.64 1ike h SER 177 CO 0.01 0.97 0.37 -0.07 -1.14 0.00 0.00 176.83 176.97 1ike h LEU 178 N 1.13 0.96 -0.50 5.07 3.38 -1.02 -0.37 115.31 123.96 1ike h LEU 178 Ca 0.26 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 1ike h LEU 178 Cb 0.24 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1ike h LEU 178 CO -0.02 0.82 -0.13 0.11 0.09 0.00 0.00 178.44 179.31 1ike h LYS 179 N 1.04 0.97 0.00 1.13 1.57 -1.05 -3.06 116.57 117.16 1ike h LYS 179 Ca 0.26 -0.38 -0.10 0.00 -1.87 0.00 0.00 60.65 58.56 1ike h LYS 179 Cb 0.10 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1ike h LYS 179 CO -0.03 1.05 -0.48 0.66 -0.57 0.00 0.00 179.45 180.07 1ike h SER 180 N 0.83 0.00 0.00 0.86 4.64 -0.71 -2.74 113.55 116.44 1ike h SER 180 Ca 0.13 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1ike h SER 180 Cb 0.69 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1ike h SER 180 CO 0.05 0.48 -0.00 -0.07 -0.87 0.00 0.00 176.83 176.42 1ike h LEU 181 N 0.00 0.00 -2.11 5.97 3.38 -0.97 -2.05 115.31 119.54 1ike h LEU 181 Ca -0.00 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.05 1ike h LEU 181 Cb 0.98 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 1ike h LEU 181 CO 0.06 0.00 0.32 -0.07 0.09 0.00 0.00 178.44 178.84 1ike h LEU 182 N 0.00 0.00 -1.00 1.67 3.38 -1.51 -0.46 115.31 117.39 1ike h LEU 182 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ike h LEU 182 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1ike h LEU 182 CO 0.00 0.00 -0.10 0.35 0.09 0.00 0.00 178.44 178.78 1ike n THR 183 N -3.71 0.00 0.84 0.22 -2.24 -0.77 -4.69 114.28 103.93 1ike n THR 183 Ca 0.04 -0.26 0.10 0.00 -2.27 0.00 0.00 64.05 61.66 1ike n THR 183 Cb 0.46 0.69 0.08 0.00 -2.10 0.00 0.00 70.33 69.47 1ike n THR 183 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79