#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b69 s LYS 4 N 0.00 1.25 0.81 3.49 3.01 -1.26 -5.13 119.74 121.91 1b69 s LYS 4 Ca 0.00 -0.21 -0.12 0.00 -1.01 0.00 0.00 55.97 54.63 1b69 s LYS 4 Cb 0.00 -1.22 0.08 0.00 -1.01 0.00 0.00 37.83 35.68 1b69 s LYS 4 CO 0.00 -0.12 1.14 1.03 0.51 0.00 0.00 175.35 177.91 1b69 s ARG 5 N 1.16 1.96 0.33 1.68 0.52 -1.26 -4.97 118.95 118.37 1b69 s ARG 5 Ca -0.06 0.28 0.03 0.00 -0.52 0.00 0.00 55.73 55.46 1b69 s ARG 5 Cb -0.14 -1.93 -0.04 0.00 0.52 0.00 0.00 34.95 33.35 1b69 s ARG 5 CO -0.01 -1.63 0.11 1.03 0.02 0.00 0.00 175.30 174.81 1b69 s ARG 6 N -5.42 1.68 0.00 3.54 0.52 -1.26 -2.93 118.95 115.08 1b69 s ARG 6 Ca 0.62 -1.97 0.00 0.00 -0.52 0.00 0.00 55.73 53.86 1b69 s ARG 6 Cb -0.12 -0.51 0.00 0.00 0.52 0.00 0.00 34.95 34.84 1b69 s ARG 6 CO 0.51 -0.36 0.00 -0.40 0.02 0.00 0.00 175.30 175.08 1b69 n ASP 7 N -0.89 0.00 0.00 0.23 5.68 -1.26 -4.80 116.55 115.51 1b69 n ASP 7 Ca -0.02 -0.44 0.12 0.00 -0.50 0.00 0.00 54.79 53.95 1b69 n ASP 7 Cb 0.66 0.00 0.71 0.00 -1.14 0.00 0.00 41.12 41.35 1b69 n ASP 7 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1b69 n ASN 8 N -1.33 0.00 0.00 -1.12 3.02 -1.26 -4.54 115.26 110.03 1b69 n ASN 8 Ca 0.00 -0.65 0.00 0.00 -0.03 0.00 0.00 54.58 53.90 1b69 n ASN 8 Cb 0.00 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 1b69 n ASN 8 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1b69 n ARG 9 N -1.05 0.00 -0.25 3.52 5.12 -1.26 -5.05 116.66 117.69 1b69 n ARG 9 Ca 0.17 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.09 1b69 n ARG 9 Cb 0.10 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.40 1b69 n ARG 9 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1b69 n GLY 10 N 4.85 0.31 0.00 -0.13 0.00 -1.26 -5.11 105.19 103.85 1b69 n GLY 10 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1b69 n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b69 n ARG 11 N 0.00 0.79 -3.87 1.61 1.74 -1.26 -4.95 116.66 110.72 1b69 n ARG 11 Ca 0.00 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.82 1b69 n ARG 11 Cb 0.53 0.00 -0.17 0.00 -1.02 0.00 0.00 32.46 31.80 1b69 n ARG 11 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1b69 s ILE 12 N -0.16 0.90 0.13 0.55 -1.09 -1.26 -4.07 121.20 116.18 1b69 s ILE 12 Ca 0.00 -0.25 -0.16 0.00 -2.23 0.00 0.00 60.65 58.01 1b69 s ILE 12 Cb 0.00 -0.97 -0.07 0.00 -1.58 0.00 0.00 42.46 39.84 1b69 s ILE 12 CO 0.00 0.31 0.56 -0.76 -1.23 0.00 0.00 174.94 173.82 1b69 s LEU 13 N 1.76 4.39 0.45 2.97 1.43 -1.15 -4.95 118.68 123.58 1b69 s LEU 13 Ca 0.04 1.14 -0.03 0.00 -1.03 0.00 0.00 54.13 54.25 1b69 s LEU 13 Cb -0.13 -3.16 -0.03 0.00 0.03 0.00 0.00 46.19 42.89 1b69 s LEU 13 CO -0.08 0.15 0.72 -0.54 0.23 0.00 0.00 176.35 176.84 1b69 s LYS 14 N -1.70 3.48 1.00 1.70 -0.14 -1.26 -4.57 119.74 118.25 1b69 s LYS 14 Ca 0.35 0.02 -0.17 0.00 -1.36 0.00 0.00 55.97 54.81 1b69 s LYS 14 Cb -0.16 -2.46 -0.04 0.00 -1.68 0.00 0.00 37.83 33.49 1b69 s LYS 14 CO 0.19 -0.13 -0.30 2.41 -0.76 0.00 0.00 175.35 176.76 1b69 n THR 15 N -2.14 0.00 0.00 2.17 -1.04 -1.26 -1.50 114.28 110.52 1b69 n THR 15 Ca -0.01 -0.29 0.00 0.00 -2.04 0.00 0.00 64.05 61.72 1b69 n THR 15 Cb 0.56 -0.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.73 1b69 n THR 15 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1b69 n GLY 16 N 2.49 1.45 3.92 3.41 0.00 -1.26 -4.94 105.19 110.26 1b69 n GLY 16 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 1b69 n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1b69 s GLU 17 N 0.00 3.55 0.00 1.61 2.02 -0.56 -2.32 118.70 122.99 1b69 s GLU 17 Ca 0.00 -0.12 0.00 0.00 0.02 0.00 0.00 54.97 54.87 1b69 s GLU 17 Cb 0.00 -2.60 0.00 0.00 0.10 0.00 0.00 34.13 31.63 1b69 s GLU 17 CO 0.00 0.10 0.00 -1.13 0.02 0.00 0.00 175.26 174.25 1b69 n SER 18 N -1.59 0.00 -3.84 -0.19 3.41 -0.44 -4.78 113.62 106.20 1b69 n SER 18 Ca -0.03 -0.28 -0.12 0.00 -0.26 0.00 0.00 58.87 58.18 1b69 n SER 18 Cb 0.55 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.38 1b69 n SER 18 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1b69 s GLN 19 N 0.15 0.17 0.00 4.33 -2.07 -1.26 -1.15 119.66 119.82 1b69 s GLN 19 Ca 0.00 0.09 0.00 0.00 -1.82 0.00 0.00 55.36 53.63 1b69 s GLN 19 Cb 0.00 0.08 0.00 0.00 -1.09 0.00 0.00 33.01 32.00 1b69 s GLN 19 CO 0.00 -0.03 0.00 -2.13 -1.32 0.00 0.00 175.29 171.81 1b69 n ARG 20 N 2.85 2.50 0.14 9.60 0.63 -0.99 -4.88 116.66 126.51 1b69 n ARG 20 Ca -0.14 0.00 0.10 0.00 -0.92 0.00 0.00 57.85 56.90 1b69 n ARG 20 Cb 0.59 0.00 0.05 0.00 0.45 0.00 0.00 32.46 33.54 1b69 n ARG 20 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 1b69 h LYS 21 N 0.00 0.00 -0.05 -0.14 1.57 -2.02 -3.28 116.57 112.65 1b69 h LYS 21 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1b69 h LYS 21 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1b69 h LYS 21 CO 0.00 0.04 0.00 -0.25 -0.57 0.00 0.00 179.45 178.67 1b69 n ASP 22 N -2.84 0.51 0.00 0.86 8.00 -1.26 -4.86 116.55 116.95 1b69 n ASP 22 Ca 0.01 -1.51 0.00 0.00 0.71 0.00 0.00 54.79 54.00 1b69 n ASP 22 Cb 0.57 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 1b69 n ASP 22 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1b69 n GLY 23 N 0.89 3.01 3.76 0.44 0.00 -1.24 -4.99 105.19 107.07 1b69 n GLY 23 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1b69 n GLY 23 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1b69 s ARG 24 N -0.08 2.85 0.53 1.61 1.70 -1.26 -4.77 118.95 119.53 1b69 s ARG 24 Ca 0.00 1.60 -0.17 0.00 -0.47 0.00 0.00 55.73 56.69 1b69 s ARG 24 Cb 0.00 -1.94 -0.07 0.00 -0.57 0.00 0.00 34.95 32.37 1b69 s ARG 24 CO 0.00 -1.25 1.02 0.71 -1.08 0.00 0.00 175.30 174.70 1b69 s TYR 25 N -1.98 3.18 -0.05 5.89 2.02 -0.02 -2.33 117.35 124.05 1b69 s TYR 25 Ca 0.72 1.52 -0.02 0.00 -0.37 0.00 0.00 57.07 58.92 1b69 s TYR 25 Cb -0.25 -2.93 0.04 0.00 -0.40 0.00 0.00 41.96 38.42 1b69 s TYR 25 CO 0.37 -0.71 0.10 -1.17 -1.57 0.00 0.00 175.55 172.57 1b69 s LEU 26 N -4.02 0.50 -0.30 -1.29 2.96 -0.30 -2.98 118.68 113.25 1b69 s LEU 26 Ca 0.63 0.19 0.02 0.00 -0.22 0.00 0.00 54.13 54.75 1b69 s LEU 26 Cb -0.13 0.11 0.07 0.00 0.50 0.00 0.00 46.19 46.74 1b69 s LEU 26 CO 0.29 -0.19 -0.03 -0.47 -1.32 0.00 0.00 176.35 174.63 1b69 s TYR 27 N 1.63 3.44 -0.06 5.38 5.04 -0.97 -1.32 117.35 130.48 1b69 s TYR 27 Ca -0.03 -2.48 -0.13 0.00 -2.44 0.00 0.00 57.07 51.99 1b69 s TYR 27 Cb -0.12 -2.32 -0.05 0.00 0.35 0.00 0.00 41.96 39.82 1b69 s TYR 27 CO -0.04 -0.90 0.33 0.21 -1.34 0.00 0.00 175.55 173.81 1b69 s LYS 28 N 1.06 3.90 -0.20 4.97 2.20 -0.98 -2.93 119.74 127.76 1b69 s LYS 28 Ca -0.02 0.23 -0.11 0.00 -0.36 0.00 0.00 55.97 55.72 1b69 s LYS 28 Cb -0.20 -3.26 0.07 0.00 -1.51 0.00 0.00 37.83 32.92 1b69 s LYS 28 CO -0.05 0.60 0.48 1.52 -0.36 0.00 0.00 175.35 177.54 1b69 s TYR 29 N -0.68 -0.73 -0.15 4.03 -0.85 -1.12 -4.76 117.35 113.09 1b69 s TYR 29 Ca 0.20 1.52 -0.29 0.00 -0.52 0.00 0.00 57.07 57.98 1b69 s TYR 29 Cb -0.15 0.37 -0.03 0.00 0.38 0.00 0.00 41.96 42.53 1b69 s TYR 29 CO 0.09 -0.40 1.40 0.42 -1.52 0.00 0.00 175.55 175.54 1b69 s ILE 30 N 1.51 4.04 0.85 -3.49 -1.09 -1.26 -2.06 121.20 119.70 1b69 s ILE 30 Ca -0.09 1.24 -0.12 0.00 -2.23 0.00 0.00 60.65 59.45 1b69 s ILE 30 Cb -0.08 -3.83 0.12 0.00 -1.58 0.00 0.00 42.46 37.09 1b69 s ILE 30 CO -0.15 -0.15 1.20 1.51 -1.23 0.00 0.00 174.94 176.13 1b69 s ASP 31 N 2.56 4.04 0.00 3.58 -4.77 -1.25 -4.87 116.67 115.96 1b69 s ASP 31 Ca 0.61 0.52 0.00 0.00 -3.30 0.00 0.00 52.55 50.38 1b69 s ASP 31 Cb -0.25 -0.86 0.00 0.00 -1.09 0.00 0.00 42.92 40.72 1b69 s ASP 31 CO 0.20 -2.16 0.30 -1.20 0.70 0.00 0.00 175.17 173.01 1b69 n SER 32 N -3.41 0.05 -0.10 2.11 7.64 -1.26 -1.99 113.62 116.67 1b69 n SER 32 Ca 0.11 -0.66 -0.10 0.00 1.01 0.00 0.00 58.87 59.24 1b69 n SER 32 Cb 0.60 -0.03 -0.16 0.00 -1.01 0.00 0.00 64.21 63.62 1b69 n SER 32 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1b69 n PHE 33 N -0.36 0.00 0.00 1.43 3.72 -1.26 -5.00 117.46 115.99 1b69 n PHE 33 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1b69 n PHE 33 Cb 0.01 -0.99 0.00 0.00 -0.94 0.00 0.00 39.48 37.57 1b69 n PHE 33 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b69 n GLY 34 N 1.75 1.76 2.70 1.37 0.00 -0.84 -5.09 105.19 106.84 1b69 n GLY 34 Ca -0.32 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.46 1b69 n GLY 34 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1b69 s GLU 35 N -0.71 0.31 0.61 1.61 -1.05 -1.26 -4.99 118.70 113.22 1b69 s GLU 35 Ca 0.00 0.04 -0.18 0.00 -0.15 0.00 0.00 54.97 54.68 1b69 s GLU 35 Cb 0.00 -1.26 -0.13 0.00 -0.44 0.00 0.00 34.13 32.30 1b69 s GLU 35 CO 0.00 -0.46 -0.04 -2.30 0.95 0.00 0.00 175.26 173.41 1b69 n PRO 36 N 5.20 0.11 -4.69 -4.83 -0.02 -1.26 -3.85 135.00 125.67 1b69 n PRO 36 Ca -0.06 0.05 -0.25 0.00 -2.02 0.00 0.00 63.50 61.22 1b69 n PRO 36 Cb 0.49 -1.21 -0.16 0.00 -0.02 0.00 0.00 33.50 32.60 1b69 n PRO 36 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1b69 s GLN 37 N -1.53 1.63 -0.16 -0.52 0.74 -0.87 -4.88 119.66 114.07 1b69 s GLN 37 Ca 0.57 -0.50 -0.10 0.00 0.05 0.00 0.00 55.36 55.38 1b69 s GLN 37 Cb -0.43 -1.40 -0.05 0.00 1.10 0.00 0.00 33.01 32.24 1b69 s GLN 37 CO 0.66 0.16 0.18 -0.06 -0.55 0.00 0.00 175.29 175.67 1b69 s PHE 38 N 0.25 3.49 -0.14 1.67 0.40 -1.26 -2.80 117.98 119.60 1b69 s PHE 38 Ca -0.07 0.48 -0.00 0.00 -0.60 0.00 0.00 56.93 56.73 1b69 s PHE 38 Cb -0.12 -2.14 0.03 0.00 0.51 0.00 0.00 43.02 41.30 1b69 s PHE 38 CO 0.02 0.43 -0.07 0.08 0.70 0.00 0.00 175.22 176.38 1b69 s VAL 39 N -0.11 1.11 0.25 -0.44 1.01 -1.15 -5.01 120.40 116.07 1b69 s VAL 39 Ca 0.13 -0.45 0.06 0.00 0.00 0.00 0.00 61.98 61.72 1b69 s VAL 39 Cb -0.12 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 1b69 s VAL 39 CO 0.02 0.29 0.27 -0.31 0.00 0.00 0.00 175.10 175.37 1b69 s TYR 40 N 1.66 3.23 -0.09 5.22 2.02 -1.26 -2.30 117.35 125.84 1b69 s TYR 40 Ca 0.03 -0.08 -0.33 0.00 -0.37 0.00 0.00 57.07 56.32 1b69 s TYR 40 Cb -0.14 -1.49 0.14 0.00 -0.40 0.00 0.00 41.96 40.08 1b69 s TYR 40 CO -0.08 0.47 1.41 0.45 -1.57 0.00 0.00 175.55 176.23 1b69 s SER 41 N -3.91 -0.01 -0.01 2.29 0.15 -1.16 -4.88 113.70 106.17 1b69 s SER 41 Ca 0.34 -0.03 0.01 0.00 0.70 0.00 0.00 55.95 56.96 1b69 s SER 41 Cb -0.08 0.04 -0.01 0.00 -1.71 0.00 0.00 66.02 64.25 1b69 s SER 41 CO 0.27 -0.07 -0.00 0.79 1.20 0.00 0.00 173.24 175.42 1b69 n TRP 42 N -0.48 0.00 -3.40 3.44 7.02 -1.26 -0.84 117.44 121.91 1b69 n TRP 42 Ca -0.09 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 56.01 1b69 n TRP 42 Cb 0.63 -0.06 -0.07 0.00 -2.42 0.00 0.00 31.31 29.39 1b69 n TRP 42 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 1b69 s LYS 43 N -2.03 4.22 0.20 -0.99 1.02 -1.26 -4.66 119.74 116.23 1b69 s LYS 43 Ca -0.01 0.22 -0.00 0.00 0.02 0.00 0.00 55.97 56.20 1b69 s LYS 43 Cb 0.00 -3.50 0.13 0.00 -0.52 0.00 0.00 37.83 33.94 1b69 s LYS 43 CO 0.04 0.04 1.49 1.25 -0.92 0.00 0.00 175.35 177.25 1b69 h LEU 44 N 7.33 0.46 -8.27 3.17 5.85 -1.94 -1.95 115.31 119.96 1b69 h LEU 44 Ca -0.38 -0.27 -0.25 0.00 0.84 0.00 0.00 57.88 57.82 1b69 h LEU 44 Cb 1.16 -0.13 -0.19 0.00 0.37 0.00 0.00 40.66 41.87 1b69 h LEU 44 CO 0.73 0.98 -0.72 0.68 -0.34 0.00 0.00 178.44 179.77 1b69 s VAL 45 N -3.76 0.59 -0.72 1.05 -7.23 -1.26 -3.24 120.40 105.82 1b69 s VAL 45 Ca -0.06 -1.40 -0.15 0.00 -1.81 0.00 0.00 61.98 58.56 1b69 s VAL 45 Cb 0.11 -1.01 -0.12 0.00 0.56 0.00 0.00 36.38 35.92 1b69 s VAL 45 CO 0.83 -0.57 1.91 0.00 -0.31 0.00 0.00 175.10 176.95 1b69 n ALA 46 N 0.89 3.50 0.00 1.32 0.00 -1.26 -2.78 120.51 122.19 1b69 n ALA 46 Ca -0.19 -2.57 0.00 0.00 0.00 0.00 0.00 53.44 50.68 1b69 n ALA 46 Cb 0.57 -3.33 0.00 0.00 0.00 0.00 0.00 19.45 16.69 1b69 n ALA 46 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1b69 n THR 47 N 5.34 0.00 -0.17 0.00 -1.04 -1.26 -5.04 114.28 112.12 1b69 n THR 47 Ca 0.44 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.45 1b69 n THR 47 Cb 0.28 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.79 1b69 n THR 47 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1b69 n ASP 48 N -0.66 -0.49 -0.00 8.00 9.92 -1.12 -5.10 116.55 127.11 1b69 n ASP 48 Ca 0.00 -0.17 0.00 0.00 -0.53 0.00 0.00 54.79 54.09 1b69 n ASP 48 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1b69 n ASP 48 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1b69 n ARG 49 N -0.66 1.99 -3.66 -1.24 5.12 -1.26 -5.03 116.66 111.92 1b69 n ARG 49 Ca 0.00 0.00 -0.06 0.00 -1.93 0.00 0.00 57.85 55.86 1b69 n ARG 49 Cb 0.00 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.23 1b69 n ARG 49 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1b69 s VAL 50 N -0.01 -0.52 0.08 1.55 -7.23 -1.26 -4.48 120.40 108.52 1b69 s VAL 50 Ca 0.00 0.05 -0.36 0.00 -1.81 0.00 0.00 61.98 59.86 1b69 s VAL 50 Cb 0.00 -0.87 -0.18 0.00 0.56 0.00 0.00 36.38 35.88 1b69 s VAL 50 CO 0.00 0.02 1.04 -2.65 -0.31 0.00 0.00 175.10 173.20 1b69 n PRO 51 N 4.97 0.38 -1.53 4.82 -0.02 -1.26 -4.82 135.00 137.54 1b69 n PRO 51 Ca -0.15 0.14 -0.40 0.00 -2.02 0.00 0.00 63.50 61.07 1b69 n PRO 51 Cb 0.53 -1.58 0.02 0.00 -0.02 0.00 0.00 33.50 32.45 1b69 n PRO 51 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1b69 n ALA 52 N 1.41 -0.59 0.00 3.55 0.00 -1.26 -1.96 120.51 121.66 1b69 n ALA 52 Ca 0.19 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1b69 n ALA 52 Cb 0.15 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1b69 n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b69 n GLY 53 N 1.51 3.32 3.88 0.00 0.00 -1.26 -5.04 105.19 107.59 1b69 n GLY 53 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1b69 n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b69 s LYS 54 N -0.88 3.79 -0.09 1.61 3.01 -0.83 -5.03 119.74 121.32 1b69 s LYS 54 Ca 0.00 0.41 -0.29 0.00 -1.01 0.00 0.00 55.97 55.09 1b69 s LYS 54 Cb 0.00 -2.46 -0.02 0.00 -1.01 0.00 0.00 37.83 34.35 1b69 s LYS 54 CO 0.00 0.06 0.96 1.03 0.51 0.00 0.00 175.35 177.91 1b69 s ARG 55 N -3.58 4.43 0.80 1.68 0.52 -1.26 -5.01 118.95 116.54 1b69 s ARG 55 Ca 0.50 1.31 -0.14 0.00 -0.52 0.00 0.00 55.73 56.89 1b69 s ARG 55 Cb -0.10 -3.53 0.04 0.00 0.52 0.00 0.00 34.95 31.88 1b69 s ARG 55 CO 0.28 -0.24 0.89 -0.40 0.02 0.00 0.00 175.30 175.85 1b69 n ASP 56 N 4.75 -0.05 -3.52 0.23 5.68 -1.26 -5.00 116.55 117.38 1b69 n ASP 56 Ca 0.07 0.56 -0.08 0.00 -0.50 0.00 0.00 54.79 54.84 1b69 n ASP 56 Cb 0.49 -1.38 -0.02 0.00 -1.14 0.00 0.00 41.12 39.07 1b69 n ASP 56 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1b69 s ALA 57 N -2.08 -1.87 1.04 2.12 0.00 -1.26 -5.13 121.76 114.58 1b69 s ALA 57 Ca 0.69 1.15 -0.14 0.00 0.00 0.00 0.00 51.96 53.66 1b69 s ALA 57 Cb -0.30 0.25 0.21 0.00 0.00 0.00 0.00 23.12 23.28 1b69 s ALA 57 CO 0.55 -0.64 1.11 0.96 0.00 0.00 0.00 175.76 177.74 1b69 s ILE 58 N -2.85 1.91 0.30 0.00 -4.36 -1.26 -4.86 121.20 110.08 1b69 s ILE 58 Ca 0.05 0.00 -0.28 0.00 -0.26 0.00 0.00 60.65 60.16 1b69 s ILE 58 Cb -0.01 -2.55 -0.09 0.00 1.25 0.00 0.00 42.46 41.06 1b69 s ILE 58 CO -0.07 0.00 1.03 -0.94 0.24 0.00 0.00 174.94 175.20 1b69 s SER 59 N -3.69 7.26 0.49 4.36 1.04 -1.26 -4.69 113.70 117.20 1b69 s SER 59 Ca 0.67 2.09 0.33 0.00 0.48 0.00 0.00 55.95 59.52 1b69 s SER 59 Cb -0.16 -2.61 1.46 0.00 0.10 0.00 0.00 66.02 64.81 1b69 s SER 59 CO 0.56 -0.14 1.71 0.25 0.98 0.00 0.00 173.24 176.60 1b69 h LEU 60 N 3.52 0.16 -1.89 2.42 6.46 -1.49 1.53 115.31 126.02 1b69 h LEU 60 Ca -0.47 0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.33 1b69 h LEU 60 Cb 1.21 0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 41.17 1b69 h LEU 60 CO 0.66 -0.03 -0.07 0.03 -0.62 0.00 0.00 178.44 178.41 1b69 h ARG 61 N 0.11 0.00 0.01 1.25 2.47 -1.80 0.20 114.38 116.62 1b69 h ARG 61 Ca 0.71 0.00 -0.22 0.00 -1.26 0.00 0.00 59.98 59.20 1b69 h ARG 61 Cb 2.46 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.78 1b69 h ARG 61 CO -0.18 0.07 -0.95 0.93 0.56 0.00 0.00 179.97 180.40 1b69 h GLU 62 N 0.00 0.37 0.22 0.04 4.39 0.19 -2.51 114.58 117.28 1b69 h GLU 62 Ca -0.00 -0.41 -0.01 0.00 0.34 0.00 0.00 59.36 59.28 1b69 h GLU 62 Cb 0.13 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1b69 h GLU 62 CO 0.01 1.09 -0.11 0.87 -1.16 0.00 0.00 179.01 179.71 1b69 h LYS 63 N 0.20 -0.29 -0.87 2.33 1.57 -0.93 -2.92 116.57 115.66 1b69 h LYS 63 Ca -0.08 0.02 0.20 0.00 -1.87 0.00 0.00 60.65 58.92 1b69 h LYS 63 Cb 1.59 0.07 -0.12 0.00 0.08 0.00 0.00 32.23 33.85 1b69 h LYS 63 CO 0.16 0.07 0.39 0.82 -0.57 0.00 0.00 179.45 180.32 1b69 h ILE 64 N -0.73 0.54 -0.71 1.86 2.04 -0.74 0.70 117.51 120.47 1b69 h ILE 64 Ca -0.03 -0.15 0.13 0.00 1.00 0.00 0.00 64.86 65.81 1b69 h ILE 64 Cb 0.49 0.05 -0.05 0.00 -0.74 0.00 0.00 36.82 36.58 1b69 h ILE 64 CO 0.05 0.08 0.48 0.00 0.00 0.00 0.00 178.15 178.76 1b69 h ALA 65 N 1.66 2.06 -0.19 1.87 0.00 -1.29 -0.25 119.26 123.13 1b69 h ALA 65 Ca 0.53 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 55.23 1b69 h ALA 65 Cb 0.94 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1b69 h ALA 65 CO -0.48 -0.24 -0.69 0.93 0.00 0.00 0.00 179.25 178.76 1b69 h GLU 66 N 0.43 0.76 0.00 0.00 5.08 0.59 -1.86 114.58 119.58 1b69 h GLU 66 Ca 0.34 -0.56 -0.08 0.00 -1.00 0.00 0.00 59.36 58.06 1b69 h GLU 66 Cb 0.73 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 1b69 h GLU 66 CO -0.11 1.18 -0.37 -0.07 -1.00 0.00 0.00 179.01 178.64 1b69 h LEU 67 N 0.54 0.00 0.15 1.33 3.38 -0.57 -2.76 115.31 117.39 1b69 h LEU 67 Ca -0.03 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.64 1b69 h LEU 67 Cb 1.30 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.07 1b69 h LEU 67 CO 0.14 0.37 -1.31 1.56 0.09 0.00 0.00 178.44 179.29 1b69 h GLN 68 N 0.00 0.46 0.00 1.13 4.20 -1.02 -3.42 115.11 116.47 1b69 h GLN 68 Ca -0.00 -0.72 0.00 0.00 0.06 0.00 0.00 58.65 57.99 1b69 h GLN 68 Cb 0.69 0.26 0.00 0.00 0.30 0.00 0.00 27.48 28.73 1b69 h GLN 68 CO 0.05 1.33 0.00 1.63 -0.67 0.00 0.00 178.83 181.17 1b69 n LYS 69 N -3.67 0.00 0.00 1.46 5.02 -0.71 -5.03 118.16 115.22 1b69 n LYS 69 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 1b69 n LYS 69 Cb 1.03 -0.07 0.00 0.00 -0.02 0.00 0.00 35.03 35.97 1b69 n LYS 69 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1b69 n ASP 70 N 0.00 0.00 0.00 4.39 -0.08 -1.06 -5.08 116.55 114.72 1b69 n ASP 70 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1b69 n ASP 70 Cb 0.00 0.20 0.00 0.00 2.34 0.00 0.00 41.12 43.66 1b69 n ASP 70 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32