#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bb8 n LYS 4 N 0.00 0.15 -2.71 3.49 5.02 -1.26 -5.02 118.16 117.84 1bb8 n LYS 4 Ca 0.00 -0.19 -0.40 0.00 -2.02 0.00 0.00 58.31 55.70 1bb8 n LYS 4 Cb 0.00 -0.09 -0.06 0.00 -0.02 0.00 0.00 35.03 34.86 1bb8 n LYS 4 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1bb8 s ARG 5 N -3.00 4.82 0.24 1.97 3.00 -1.26 -5.04 118.95 119.68 1bb8 s ARG 5 Ca 0.06 1.54 -0.04 0.00 0.00 0.00 0.00 55.73 57.29 1bb8 s ARG 5 Cb -0.00 -3.27 -0.02 0.00 0.00 0.00 0.00 34.95 31.65 1bb8 s ARG 5 CO 0.04 0.46 0.28 -0.98 0.00 0.00 0.00 175.30 175.10 1bb8 s ARG 6 N -1.16 1.41 1.08 3.54 1.70 -1.26 -3.36 118.95 120.89 1bb8 s ARG 6 Ca 0.42 -1.56 -0.18 0.00 -0.47 0.00 0.00 55.73 53.93 1bb8 s ARG 6 Cb -0.27 0.35 0.26 0.00 -0.57 0.00 0.00 34.95 34.72 1bb8 s ARG 6 CO 0.33 -0.52 1.21 -0.40 -1.08 0.00 0.00 175.30 174.84 1bb8 n ASP 7 N -0.51 -0.87 0.00 -2.89 5.68 0.33 -4.85 116.55 113.44 1bb8 n ASP 7 Ca 0.01 -1.33 0.06 0.00 -0.50 0.00 0.00 54.79 53.03 1bb8 n ASP 7 Cb 0.64 -1.00 0.27 0.00 -1.14 0.00 0.00 41.12 39.89 1bb8 n ASP 7 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1bb8 n ASN 8 N -4.29 0.00 -0.03 -1.12 3.02 -1.26 -2.68 115.26 108.89 1bb8 n ASN 8 Ca 0.16 0.37 0.04 0.00 -0.03 0.00 0.00 54.58 55.13 1bb8 n ASN 8 Cb 0.57 -0.43 -0.15 0.00 -0.61 0.00 0.00 39.78 39.16 1bb8 n ASN 8 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1bb8 n ARG 9 N -1.43 0.72 0.00 3.52 5.12 -1.26 -4.99 116.66 118.34 1bb8 n ARG 9 Ca 0.04 -0.13 0.00 0.00 -1.93 0.00 0.00 57.85 55.83 1bb8 n ARG 9 Cb 0.12 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 29.95 1bb8 n ARG 9 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1bb8 n GLY 10 N 1.52 1.03 3.69 -0.13 0.00 -1.09 -5.11 105.19 105.09 1bb8 n GLY 10 Ca -0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 1bb8 n GLY 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bb8 s ARG 11 N 0.00 4.36 -0.49 1.61 0.52 -1.26 -4.78 118.95 118.91 1bb8 s ARG 11 Ca 0.00 0.98 -0.28 0.00 -0.52 0.00 0.00 55.73 55.91 1bb8 s ARG 11 Cb 0.00 -3.52 -0.01 0.00 0.52 0.00 0.00 34.95 31.94 1bb8 s ARG 11 CO 0.00 -0.17 1.67 0.42 0.02 0.00 0.00 175.30 177.24 1bb8 s ILE 12 N 1.59 3.57 0.27 1.52 -1.09 -1.26 -0.52 121.20 125.28 1bb8 s ILE 12 Ca 0.38 0.50 -0.14 0.00 -2.23 0.00 0.00 60.65 59.16 1bb8 s ILE 12 Cb -0.17 -4.01 -0.08 0.00 -1.58 0.00 0.00 42.46 36.62 1bb8 s ILE 12 CO 0.15 -0.81 0.66 -1.48 -1.23 0.00 0.00 174.94 172.24 1bb8 s LEU 13 N 7.19 4.15 0.00 2.97 0.05 -1.21 -4.96 118.68 126.86 1bb8 s LEU 13 Ca 0.66 1.16 -0.01 0.00 0.05 0.00 0.00 54.13 55.99 1bb8 s LEU 13 Cb -0.15 -3.84 0.08 0.00 -2.05 0.00 0.00 46.19 40.23 1bb8 s LEU 13 CO 0.27 -0.11 0.55 0.29 -0.55 0.00 0.00 176.35 176.80 1bb8 n LYS 14 N -0.09 0.13 -1.64 1.48 5.02 -1.26 -4.82 118.16 116.98 1bb8 n LYS 14 Ca 0.01 -1.40 -0.39 0.00 -2.02 0.00 0.00 58.31 54.51 1bb8 n LYS 14 Cb 0.53 -0.39 0.03 0.00 -0.02 0.00 0.00 35.03 35.18 1bb8 n LYS 14 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1bb8 n THR 15 N -2.25 3.12 0.00 -0.18 -2.24 -1.26 -3.04 114.28 108.43 1bb8 n THR 15 Ca 0.09 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1bb8 n THR 15 Cb 0.31 -1.28 0.00 0.00 -2.10 0.00 0.00 70.33 67.26 1bb8 n THR 15 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bb8 n GLY 16 N 1.12 1.66 3.75 3.38 0.00 -1.26 -4.96 105.19 108.88 1bb8 n GLY 16 Ca 0.11 -0.09 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1bb8 n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bb8 s GLU 17 N 0.00 3.22 -0.08 1.61 8.01 -1.17 -4.54 118.70 125.76 1bb8 s GLU 17 Ca 0.00 2.26 -0.30 0.00 0.01 0.00 0.00 54.97 56.93 1bb8 s GLU 17 Cb 0.00 -2.31 0.08 0.00 -4.31 0.00 0.00 34.13 27.58 1bb8 s GLU 17 CO 0.00 -1.13 0.71 0.45 0.01 0.00 0.00 175.26 175.30 1bb8 s SER 18 N -0.89 -0.64 -0.19 -0.19 0.15 -0.89 -4.77 113.70 106.29 1bb8 s SER 18 Ca 0.70 0.74 -0.10 0.00 0.70 0.00 0.00 55.95 57.99 1bb8 s SER 18 Cb -0.41 0.58 -0.05 0.00 -1.71 0.00 0.00 66.02 64.43 1bb8 s SER 18 CO 0.49 -0.56 0.16 -1.58 1.20 0.00 0.00 173.24 172.95 1bb8 s GLN 19 N -1.07 4.14 0.11 5.44 0.74 -1.26 -2.08 119.66 125.68 1bb8 s GLN 19 Ca -0.09 -0.15 -0.01 0.00 0.05 0.00 0.00 55.36 55.15 1bb8 s GLN 19 Cb -0.00 -3.40 0.02 0.00 1.10 0.00 0.00 33.01 30.73 1bb8 s GLN 19 CO 0.09 0.33 0.15 0.54 -0.55 0.00 0.00 175.29 175.85 1bb8 n ARG 20 N 3.40 0.09 0.21 1.67 1.74 -0.97 -4.91 116.66 117.88 1bb8 n ARG 20 Ca -0.16 -0.29 0.09 0.00 -0.77 0.00 0.00 57.85 56.72 1bb8 n ARG 20 Cb 0.52 -0.14 0.31 0.00 -1.02 0.00 0.00 32.46 32.13 1bb8 n ARG 20 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1bb8 h LYS 21 N 0.00 0.00 0.00 5.56 6.56 -1.99 -2.92 116.57 123.79 1bb8 h LYS 21 Ca -0.05 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.54 1bb8 h LYS 21 Cb 0.15 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.81 1bb8 h LYS 21 CO 0.04 0.23 -0.47 -0.44 -2.06 0.00 0.00 179.45 176.76 1bb8 h ASP 22 N 0.00 0.00 0.00 0.86 3.32 -2.03 -3.47 116.42 115.10 1bb8 h ASP 22 Ca -0.00 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.89 1bb8 h ASP 22 Cb 0.94 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.49 1bb8 h ASP 22 CO 0.03 0.08 0.00 0.61 -1.72 0.00 0.00 179.24 178.24 1bb8 n GLY 23 N 1.32 3.10 3.77 2.75 0.00 -1.10 -5.06 105.19 109.98 1bb8 n GLY 23 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1bb8 n GLY 23 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1bb8 s ARG 24 N -0.89 3.91 0.58 1.61 1.70 -1.26 -4.57 118.95 120.03 1bb8 s ARG 24 Ca 0.00 2.37 -0.04 0.00 -0.47 0.00 0.00 55.73 57.59 1bb8 s ARG 24 Cb 0.00 -2.79 0.01 0.00 -0.57 0.00 0.00 34.95 31.60 1bb8 s ARG 24 CO 0.00 -0.62 0.86 0.71 -1.08 0.00 0.00 175.30 175.18 1bb8 s TYR 25 N -1.19 3.19 -0.21 5.89 2.02 -0.02 -2.29 117.35 124.74 1bb8 s TYR 25 Ca 0.57 0.51 -0.12 0.00 -0.37 0.00 0.00 57.07 57.66 1bb8 s TYR 25 Cb -0.43 -2.71 0.07 0.00 -0.40 0.00 0.00 41.96 38.49 1bb8 s TYR 25 CO 0.56 -0.81 0.52 -1.17 -1.57 0.00 0.00 175.55 173.08 1bb8 s LEU 26 N -4.93 -0.38 0.27 -1.29 1.98 -0.88 -3.10 118.68 110.35 1bb8 s LEU 26 Ca 0.54 1.12 0.03 0.00 -2.89 0.00 0.00 54.13 52.93 1bb8 s LEU 26 Cb -0.10 1.75 -0.06 0.00 0.66 0.00 0.00 46.19 48.44 1bb8 s LEU 26 CO 0.43 -0.21 0.05 -0.47 -1.89 0.00 0.00 176.35 174.27 1bb8 s TYR 27 N 1.38 1.69 -0.00 5.38 5.04 -1.07 -2.09 117.35 127.68 1bb8 s TYR 27 Ca -0.09 -1.02 0.01 0.00 -2.44 0.00 0.00 57.07 53.53 1bb8 s TYR 27 Cb -0.07 -1.03 -0.00 0.00 0.35 0.00 0.00 41.96 41.21 1bb8 s TYR 27 CO -0.14 -0.12 -0.04 0.21 -1.34 0.00 0.00 175.55 174.11 1bb8 s LYS 28 N -3.93 0.33 0.26 4.97 2.20 -1.26 -1.87 119.74 120.44 1bb8 s LYS 28 Ca 0.34 -0.15 -0.02 0.00 -0.36 0.00 0.00 55.97 55.79 1bb8 s LYS 28 Cb 0.07 -0.32 -0.02 0.00 -1.51 0.00 0.00 37.83 36.05 1bb8 s LYS 28 CO 0.13 0.09 0.28 1.52 -0.36 0.00 0.00 175.35 177.01 1bb8 s TYR 29 N -0.10 1.12 -0.21 4.03 1.13 -1.13 -5.02 117.35 117.17 1bb8 s TYR 29 Ca 0.02 -1.30 -0.08 0.00 -1.41 0.00 0.00 57.07 54.29 1bb8 s TYR 29 Cb -0.02 -0.37 -0.04 0.00 -1.10 0.00 0.00 41.96 40.43 1bb8 s TYR 29 CO -0.00 -0.84 0.09 0.42 -2.51 0.00 0.00 175.55 172.71 1bb8 s ILE 30 N -3.80 4.82 0.91 -3.49 -1.09 -1.26 -2.64 121.20 114.64 1bb8 s ILE 30 Ca 0.35 -0.01 -0.14 0.00 -2.23 0.00 0.00 60.65 58.62 1bb8 s ILE 30 Cb 0.03 -3.21 0.17 0.00 -1.58 0.00 0.00 42.46 37.87 1bb8 s ILE 30 CO 0.16 0.40 1.26 -1.81 -1.23 0.00 0.00 174.94 173.72 1bb8 s ASP 31 N 0.87 3.50 0.00 3.58 1.11 -1.22 -4.87 116.67 119.64 1bb8 s ASP 31 Ca 0.05 0.31 0.06 0.00 0.18 0.00 0.00 52.55 53.14 1bb8 s ASP 31 Cb -0.13 -0.47 0.37 0.00 1.07 0.00 0.00 42.92 43.76 1bb8 s ASP 31 CO 0.03 -2.49 0.82 -1.54 1.18 0.00 0.00 175.17 173.16 1bb8 n SER 32 N -3.59 0.00 -0.00 0.27 3.41 0.23 -1.52 113.62 112.42 1bb8 n SER 32 Ca 0.14 -0.22 0.09 0.00 -0.26 0.00 0.00 58.87 58.62 1bb8 n SER 32 Cb 0.60 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.43 1bb8 n SER 32 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1bb8 n PHE 33 N -0.97 0.00 -0.39 7.33 3.01 -1.26 -4.97 117.46 120.21 1bb8 n PHE 33 Ca 0.05 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.51 1bb8 n PHE 33 Cb 0.02 -0.24 0.00 0.00 -0.01 0.00 0.00 39.48 39.25 1bb8 n PHE 33 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1bb8 n GLY 34 N 1.45 0.74 3.82 1.37 0.00 -0.58 -5.05 105.19 106.96 1bb8 n GLY 34 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1bb8 n GLY 34 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1bb8 s GLU 35 N -0.58 4.21 -0.06 1.61 -1.05 -1.26 -4.85 118.70 116.71 1bb8 s GLU 35 Ca 0.00 0.96 -0.30 0.00 -0.15 0.00 0.00 54.97 55.48 1bb8 s GLU 35 Cb 0.00 -2.46 -0.04 0.00 -0.44 0.00 0.00 34.13 31.20 1bb8 s GLU 35 CO 0.00 0.14 1.27 -1.25 0.95 0.00 0.00 175.26 176.37 1bb8 s PRO 36 N -2.77 4.32 0.29 -4.83 0.04 -1.26 -3.41 135.00 127.37 1bb8 s PRO 36 Ca 0.55 1.75 0.09 0.00 0.04 0.00 0.00 61.00 63.43 1bb8 s PRO 36 Cb -0.12 -3.60 -0.06 0.00 0.04 0.00 0.00 34.50 30.77 1bb8 s PRO 36 CO 0.17 -0.52 -0.10 -1.14 0.04 0.00 0.00 177.00 175.45 1bb8 s GLN 37 N 2.46 1.64 0.06 4.56 2.00 -1.08 -5.02 119.66 124.29 1bb8 s GLN 37 Ca 0.58 -1.82 0.02 0.00 -2.00 0.00 0.00 55.36 52.14 1bb8 s GLN 37 Cb -0.26 -1.45 -0.03 0.00 0.80 0.00 0.00 33.01 32.07 1bb8 s GLN 37 CO 0.22 0.14 -0.07 -0.06 -0.50 0.00 0.00 175.29 175.02 1bb8 s PHE 38 N -2.78 0.71 0.06 1.67 0.40 -1.26 -2.82 117.98 113.96 1bb8 s PHE 38 Ca 0.30 -0.66 0.08 0.00 -0.60 0.00 0.00 56.93 56.05 1bb8 s PHE 38 Cb 0.01 -0.43 -0.03 0.00 0.51 0.00 0.00 43.02 43.09 1bb8 s PHE 38 CO 0.14 -0.12 -0.21 0.14 0.70 0.00 0.00 175.22 175.86 1bb8 s VAL 39 N -2.19 1.70 0.06 -0.44 -7.23 -0.78 -5.00 120.40 106.51 1bb8 s VAL 39 Ca -0.03 -1.28 0.05 0.00 -1.81 0.00 0.00 61.98 58.91 1bb8 s VAL 39 Cb -0.04 -1.49 -0.03 0.00 0.56 0.00 0.00 36.38 35.38 1bb8 s VAL 39 CO -0.02 0.15 -0.13 -0.31 -0.31 0.00 0.00 175.10 174.48 1bb8 s TYR 40 N -0.88 1.15 -0.15 2.82 1.51 -1.26 -2.61 117.35 117.92 1bb8 s TYR 40 Ca 0.07 -0.44 -0.31 0.00 -1.01 0.00 0.00 57.07 55.38 1bb8 s TYR 40 Cb -0.09 -0.65 0.13 0.00 -0.11 0.00 0.00 41.96 41.24 1bb8 s TYR 40 CO 0.02 0.04 1.08 0.45 -1.11 0.00 0.00 175.55 176.03 1bb8 s SER 41 N -1.59 -0.26 -0.07 2.29 0.15 -1.18 -4.95 113.70 108.08 1bb8 s SER 41 Ca -0.02 0.16 0.12 0.00 0.70 0.00 0.00 55.95 56.91 1bb8 s SER 41 Cb -0.10 0.24 0.47 0.00 -1.71 0.00 0.00 66.02 64.92 1bb8 s SER 41 CO 0.02 -0.33 1.32 0.79 1.20 0.00 0.00 173.24 176.24 1bb8 n TRP 42 N 0.29 0.97 -4.51 3.44 7.02 -1.26 -0.84 117.44 122.55 1bb8 n TRP 42 Ca -0.06 -0.39 -0.21 0.00 -1.02 0.00 0.00 57.50 55.83 1bb8 n TRP 42 Cb 0.59 -0.17 -0.15 0.00 -2.42 0.00 0.00 31.31 29.15 1bb8 n TRP 42 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 1bb8 s LYS 43 N -1.73 1.02 -0.20 -0.99 1.02 -1.26 -4.66 119.74 112.94 1bb8 s LYS 43 Ca 0.33 -0.40 -0.12 0.00 0.02 0.00 0.00 55.97 55.80 1bb8 s LYS 43 Cb 0.21 -0.96 -0.20 0.00 -0.52 0.00 0.00 37.83 36.36 1bb8 s LYS 43 CO 0.16 0.21 0.09 -0.11 -0.92 0.00 0.00 175.35 174.79 1bb8 n LEU 44 N 2.95 2.32 -4.59 3.17 7.94 -1.26 -3.16 117.00 124.37 1bb8 n LEU 44 Ca -0.15 0.25 -0.27 0.00 -1.11 0.00 0.00 56.01 54.73 1bb8 n LEU 44 Cb 0.55 -0.98 -0.11 0.00 0.53 0.00 0.00 43.42 43.41 1bb8 n LEU 44 CO 0.25 0.63 -0.33 -0.69 -1.11 0.00 0.00 177.39 176.14 1bb8 s VAL 45 N -2.48 2.14 -0.10 1.96 1.01 -1.26 -3.26 120.40 118.41 1bb8 s VAL 45 Ca -0.29 -2.09 0.30 0.00 0.00 0.00 0.00 61.98 59.90 1bb8 s VAL 45 Cb 0.08 -2.83 0.33 0.00 0.00 0.00 0.00 36.38 33.96 1bb8 s VAL 45 CO 0.64 -0.10 1.89 0.00 0.00 0.00 0.00 175.10 177.53 1bb8 h ALA 46 N 1.88 1.00 0.00 5.51 0.00 -1.94 -2.54 119.26 123.17 1bb8 h ALA 46 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1bb8 h ALA 46 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1bb8 h ALA 46 CO 0.75 0.00 -0.41 0.25 0.00 0.00 0.00 179.25 179.84 1bb8 n THR 47 N -2.70 0.16 -1.23 0.00 -2.24 -1.26 -4.91 114.28 102.10 1bb8 n THR 47 Ca 0.01 -0.11 -0.29 0.00 -2.27 0.00 0.00 64.05 61.39 1bb8 n THR 47 Cb 0.24 -0.08 0.17 0.00 -2.10 0.00 0.00 70.33 68.56 1bb8 n THR 47 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1bb8 s ASP 48 N -3.53 2.81 -0.01 3.42 1.01 -0.96 -5.07 116.67 114.35 1bb8 s ASP 48 Ca 0.10 1.17 0.00 0.00 0.71 0.00 0.00 52.55 54.53 1bb8 s ASP 48 Cb 0.16 -1.82 0.01 0.00 1.01 0.00 0.00 42.92 42.27 1bb8 s ASP 48 CO 0.67 -3.01 0.00 -0.60 0.21 0.00 0.00 175.17 172.44 1bb8 s ARG 49 N -5.01 0.05 0.45 8.23 6.06 -1.26 -5.00 118.95 122.46 1bb8 s ARG 49 Ca 0.65 0.03 -0.20 0.00 -2.50 0.00 0.00 55.73 53.71 1bb8 s ARG 49 Cb -0.18 -0.12 -0.10 0.00 0.06 0.00 0.00 34.95 34.61 1bb8 s ARG 49 CO 0.57 -0.03 0.95 0.14 -2.50 0.00 0.00 175.30 174.43 1bb8 s VAL 50 N 0.28 4.43 0.54 7.11 -7.23 -1.26 -4.97 120.40 119.29 1bb8 s VAL 50 Ca -0.02 1.42 -0.19 0.00 -1.81 0.00 0.00 61.98 61.37 1bb8 s VAL 50 Cb -0.04 -3.63 -0.06 0.00 0.56 0.00 0.00 36.38 33.22 1bb8 s VAL 50 CO -0.01 -0.40 1.12 -2.16 -0.31 0.00 0.00 175.10 173.34 1bb8 s PRO 51 N -3.37 3.40 0.46 4.82 0.04 -1.26 -4.92 135.00 134.17 1bb8 s PRO 51 Ca 0.61 1.57 -0.21 0.00 0.04 0.00 0.00 61.00 63.01 1bb8 s PRO 51 Cb -0.09 -2.02 -0.12 0.00 0.04 0.00 0.00 34.50 32.31 1bb8 s PRO 51 CO 0.17 -0.80 0.45 0.00 0.04 0.00 0.00 177.00 176.86 1bb8 n ALA 52 N -1.29 -1.67 0.00 8.56 0.00 -1.26 -2.39 120.51 122.47 1bb8 n ALA 52 Ca 0.11 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1bb8 n ALA 52 Cb 0.51 -1.73 0.00 0.00 0.00 0.00 0.00 19.45 18.23 1bb8 n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bb8 n GLY 53 N 1.89 2.80 3.77 0.00 0.00 -1.26 -5.03 105.19 107.35 1bb8 n GLY 53 Ca 0.11 -0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 1bb8 n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bb8 s LYS 54 N 0.00 4.04 0.44 1.61 -0.14 -1.00 -5.07 119.74 119.62 1bb8 s LYS 54 Ca 0.00 -0.03 -0.22 0.00 -1.36 0.00 0.00 55.97 54.35 1bb8 s LYS 54 Cb 0.00 -3.36 -0.09 0.00 -1.68 0.00 0.00 37.83 32.70 1bb8 s LYS 54 CO 0.00 0.40 1.05 0.50 -0.76 0.00 0.00 175.35 176.54 1bb8 s ARG 55 N 0.01 3.98 0.66 1.68 3.52 -1.26 -4.83 118.95 122.71 1bb8 s ARG 55 Ca 0.14 1.45 -0.17 0.00 -0.13 0.00 0.00 55.73 57.02 1bb8 s ARG 55 Cb -0.12 -2.32 -0.05 0.00 -1.56 0.00 0.00 34.95 30.89 1bb8 s ARG 55 CO 0.03 -0.29 0.64 -0.40 -0.81 0.00 0.00 175.30 174.47 1bb8 n ASP 56 N -0.51 -0.67 -3.95 -2.12 5.68 -1.26 -5.01 116.55 108.71 1bb8 n ASP 56 Ca 0.07 0.67 -0.09 0.00 -0.50 0.00 0.00 54.79 54.94 1bb8 n ASP 56 Cb 0.51 -1.25 -0.07 0.00 -1.14 0.00 0.00 41.12 39.16 1bb8 n ASP 56 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1bb8 s ILE 58 N -3.95 4.62 1.11 0.00 1.01 -1.26 -4.90 121.20 117.83 1bb8 s ILE 58 Ca 0.15 1.93 -0.13 0.00 0.00 0.00 0.00 60.65 62.60 1bb8 s ILE 58 Cb 0.04 -4.26 0.22 0.00 0.01 0.00 0.00 42.46 38.47 1bb8 s ILE 58 CO -0.02 0.31 0.84 -1.20 0.00 0.00 0.00 174.94 174.86 1bb8 n SER 59 N 2.95 -1.50 0.19 3.58 7.64 -1.26 -4.72 113.62 120.50 1bb8 n SER 59 Ca 0.01 -0.02 -0.07 0.00 1.01 0.00 0.00 58.87 59.80 1bb8 n SER 59 Cb 0.50 -1.25 -0.04 0.00 -1.01 0.00 0.00 64.21 62.41 1bb8 n SER 59 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1bb8 h LEU 60 N -2.39 -0.41 -1.56 -3.43 -0.00 -1.52 -1.61 115.31 104.39 1bb8 h LEU 60 Ca -0.56 0.01 0.32 0.00 -0.00 0.00 0.00 57.88 57.65 1bb8 h LEU 60 Cb 1.32 0.11 -0.09 0.00 -0.00 0.00 0.00 40.66 42.00 1bb8 h LEU 60 CO 0.45 -0.25 0.76 0.03 -0.00 0.00 0.00 178.44 179.43 1bb8 h ARG 61 N -0.56 0.22 -0.31 1.13 3.08 -1.91 0.64 114.38 116.67 1bb8 h ARG 61 Ca -0.05 -0.01 -0.18 0.00 0.07 0.00 0.00 59.98 59.81 1bb8 h ARG 61 Cb 0.37 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.37 1bb8 h ARG 61 CO 0.08 0.15 -0.51 0.93 -1.07 0.00 0.00 179.97 179.55 1bb8 h GLU 62 N 0.23 0.89 -0.37 0.04 4.39 -1.85 -2.72 114.58 115.20 1bb8 h GLU 62 Ca 0.63 -0.54 -0.06 0.00 0.34 0.00 0.00 59.36 59.73 1bb8 h GLU 62 Cb 1.93 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 30.62 1bb8 h GLU 62 CO -0.23 1.18 -0.00 0.87 -1.16 0.00 0.00 179.01 179.67 1bb8 h LYS 63 N 0.69 0.65 -0.49 2.33 1.57 0.12 -3.07 116.57 118.37 1bb8 h LYS 63 Ca 0.03 -0.21 0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1bb8 h LYS 63 Cb 1.11 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.34 1bb8 h LYS 63 CO 0.12 0.76 0.33 0.82 -0.57 0.00 0.00 179.45 180.90 1bb8 h ILE 64 N 0.47 1.12 -0.33 1.86 5.03 -1.10 0.84 117.51 125.39 1bb8 h ILE 64 Ca 0.10 -0.23 0.03 0.00 -0.12 0.00 0.00 64.86 64.65 1bb8 h ILE 64 Cb 0.47 0.40 -0.03 0.00 -3.03 0.00 0.00 36.82 34.62 1bb8 h ILE 64 CO 0.02 0.12 0.13 0.00 -0.68 0.00 0.00 178.15 177.74 1bb8 h ALA 65 N 1.18 0.39 0.08 1.87 0.00 -1.45 -2.34 119.26 119.00 1bb8 h ALA 65 Ca 0.18 0.03 -0.26 0.00 0.00 0.00 0.00 54.91 54.86 1bb8 h ALA 65 Cb -0.07 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.72 1bb8 h ALA 65 CO -0.04 -0.26 -1.14 0.93 0.00 0.00 0.00 179.25 178.74 1bb8 h GLU 66 N 0.29 0.43 -0.30 0.00 4.39 -1.41 -2.80 114.58 115.17 1bb8 h GLU 66 Ca 0.15 -0.57 -0.07 0.00 0.34 0.00 0.00 59.36 59.21 1bb8 h GLU 66 Cb 0.10 0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1bb8 h GLU 66 CO -0.13 1.23 -0.08 -0.07 -1.16 0.00 0.00 179.01 178.79 1bb8 h LEU 67 N 0.19 0.59 -0.06 1.33 3.38 -0.75 -1.94 115.31 118.04 1bb8 h LEU 67 Ca -0.13 -0.37 -0.25 0.00 0.09 0.00 0.00 57.88 57.22 1bb8 h LEU 67 Cb 1.81 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 42.41 1bb8 h LEU 67 CO 0.20 0.82 -1.05 1.56 0.09 0.00 0.00 178.44 180.06 1bb8 h GLN 68 N 0.34 0.41 0.00 1.13 4.20 -1.56 0.20 115.11 119.83 1bb8 h GLN 68 Ca 0.07 -0.51 -0.01 0.00 0.06 0.00 0.00 58.65 58.27 1bb8 h GLN 68 Cb 0.57 0.16 -0.00 0.00 0.30 0.00 0.00 27.48 28.51 1bb8 h GLN 68 CO 0.03 1.17 -0.04 0.87 -0.67 0.00 0.00 178.83 180.19 1bb8 h LYS 69 N 0.20 0.00 0.00 1.46 1.57 -1.53 -3.28 116.57 114.99 1bb8 h LYS 69 Ca -0.11 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.47 1bb8 h LYS 69 Cb 1.72 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 34.00 1bb8 h LYS 69 CO 0.18 0.04 -1.55 -3.47 -0.57 0.00 0.00 179.45 174.09 1bb8 n ASP 70 N -3.14 1.30 -1.93 0.86 -0.08 -0.73 -4.65 116.55 108.19 1bb8 n ASP 70 Ca 0.01 0.22 -0.13 0.00 -1.51 0.00 0.00 54.79 53.38 1bb8 n ASP 70 Cb 0.39 -0.52 -0.04 0.00 2.34 0.00 0.00 41.12 43.30 1bb8 n ASP 70 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 1bb8 n ILE 71 N -3.85 2.72 -2.70 5.18 5.41 0.69 -3.95 119.36 122.86 1bb8 n ILE 71 Ca -0.26 -1.57 -0.03 0.00 1.00 0.00 0.00 62.75 61.90 1bb8 n ILE 71 Cb 0.61 -1.58 0.12 0.00 -0.71 0.00 0.00 39.64 38.07 1bb8 n ILE 71 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 176.55 178.12 1bb8 n HIS 72 N 1.26 -1.62 -0.25 1.39 -0.00 -1.24 -0.60 115.22 114.15 1bb8 n HIS 72 Ca 0.28 -1.83 0.00 0.00 0.46 0.00 0.00 57.72 56.63 1bb8 n HIS 72 Cb 0.63 1.29 0.00 0.00 -0.12 0.00 0.00 29.99 31.79 1bb8 n HIS 72 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55