#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bb8 s LYS 4 N 0.00 3.86 -0.18 3.44 2.47 -1.26 -5.01 119.74 123.06 1bb8 s LYS 4 Ca 0.00 0.62 -0.18 0.00 -1.56 0.00 0.00 55.97 54.85 1bb8 s LYS 4 Cb 0.00 -3.80 -0.03 0.00 -1.46 0.00 0.00 37.83 32.54 1bb8 s LYS 4 CO 0.00 -0.94 0.50 1.03 0.16 0.00 0.00 175.35 176.09 1bb8 s ARG 5 N 3.49 4.22 0.29 4.03 1.81 -1.26 -5.05 118.95 126.48 1bb8 s ARG 5 Ca 0.39 0.40 0.07 0.00 -1.72 0.00 0.00 55.73 54.86 1bb8 s ARG 5 Cb -0.12 -3.53 -0.02 0.00 -0.45 0.00 0.00 34.95 30.82 1bb8 s ARG 5 CO 0.18 -0.07 0.24 2.89 -0.68 0.00 0.00 175.30 177.86 1bb8 n ARG 6 N 4.51 0.37 -1.15 3.54 1.85 -1.26 -4.39 116.66 120.12 1bb8 n ARG 6 Ca -0.06 -2.87 -0.30 0.00 -1.00 0.00 0.00 57.85 53.62 1bb8 n ARG 6 Cb 0.51 2.31 0.22 0.00 -1.05 0.00 0.00 32.46 34.45 1bb8 n ARG 6 CO 0.00 0.00 0.00 0.16 -0.01 0.00 0.00 177.63 177.78 1bb8 s ASP 7 N -3.01 1.55 0.14 2.89 -4.77 -0.55 -4.87 116.67 108.05 1bb8 s ASP 7 Ca 0.33 0.78 0.17 0.00 -3.30 0.00 0.00 52.55 50.53 1bb8 s ASP 7 Cb 0.02 -1.15 0.74 0.00 -1.09 0.00 0.00 42.92 41.43 1bb8 s ASP 7 CO 0.24 -3.75 1.51 0.59 0.70 0.00 0.00 175.17 174.46 1bb8 n ASN 8 N -4.53 0.33 0.00 2.11 3.02 -1.26 -3.95 115.26 110.98 1bb8 n ASN 8 Ca 0.11 0.60 0.00 0.00 -0.03 0.00 0.00 54.58 55.26 1bb8 n ASN 8 Cb 0.59 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 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 -1.88 0.00 0.00 3.52 5.12 -1.26 -5.03 116.66 117.12 1bb8 n ARG 9 Ca 0.02 0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 1bb8 n ARG 9 Cb 0.14 -0.24 0.00 0.00 -1.16 0.00 0.00 32.46 31.20 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 2.27 0.10 3.68 -0.13 0.00 -1.25 -5.12 105.19 104.73 1bb8 n GLY 10 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 4.28 -0.43 1.61 0.52 -1.26 -4.85 118.95 118.82 1bb8 s ARG 11 Ca 0.00 0.72 -0.29 0.00 -0.52 0.00 0.00 55.73 55.64 1bb8 s ARG 11 Cb 0.00 -3.54 0.02 0.00 0.52 0.00 0.00 34.95 31.95 1bb8 s ARG 11 CO 0.00 -0.16 1.25 0.42 0.02 0.00 0.00 175.30 176.83 1bb8 s ILE 12 N 1.63 4.11 0.37 1.52 1.01 -1.26 -1.48 121.20 127.09 1bb8 s ILE 12 Ca 0.32 1.15 -0.05 0.00 0.00 0.00 0.00 60.65 62.07 1bb8 s ILE 12 Cb -0.16 -4.41 -0.05 0.00 0.01 0.00 0.00 42.46 37.85 1bb8 s ILE 12 CO 0.12 -0.84 0.65 -1.48 0.00 0.00 0.00 174.94 173.40 1bb8 s LEU 13 N 4.75 3.91 0.00 2.97 0.05 -1.26 -4.96 118.68 124.14 1bb8 s LEU 13 Ca 0.53 0.81 -0.04 0.00 0.05 0.00 0.00 54.13 55.49 1bb8 s LEU 13 Cb -0.11 -3.68 0.12 0.00 -2.05 0.00 0.00 46.19 40.47 1bb8 s LEU 13 CO 0.30 -0.34 0.77 0.29 -0.55 0.00 0.00 176.35 176.82 1bb8 n LYS 14 N -1.44 -0.19 -0.73 1.48 4.76 -1.26 -4.88 118.16 115.90 1bb8 n LYS 14 Ca -0.01 -1.78 -0.32 0.00 -2.87 0.00 0.00 58.31 53.34 1bb8 n LYS 14 Cb 0.55 -0.61 0.15 0.00 -1.84 0.00 0.00 35.03 33.27 1bb8 n LYS 14 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1bb8 n THR 15 N -2.67 0.00 0.00 -0.18 -2.24 -1.26 -2.65 114.28 105.28 1bb8 n THR 15 Ca 0.12 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1bb8 n THR 15 Cb 0.41 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 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 1.24 2.15 3.85 3.38 0.00 -1.26 -4.96 105.19 109.59 1bb8 n GLY 16 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 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 3.96 -0.24 1.61 2.02 -1.08 -3.93 118.70 121.03 1bb8 s GLU 17 Ca 0.00 0.58 -0.17 0.00 0.02 0.00 0.00 54.97 55.40 1bb8 s GLU 17 Cb 0.00 -2.48 0.07 0.00 0.10 0.00 0.00 34.13 31.82 1bb8 s GLU 17 CO 0.00 0.19 0.62 -1.54 0.02 0.00 0.00 175.26 174.55 1bb8 s SER 18 N -2.30 -0.75 -0.23 -0.19 1.04 -0.54 -4.95 113.70 105.78 1bb8 s SER 18 Ca 0.53 1.31 -0.11 0.00 0.48 0.00 0.00 55.95 58.15 1bb8 s SER 18 Cb -0.10 1.24 -0.05 0.00 0.10 0.00 0.00 66.02 67.21 1bb8 s SER 18 CO 0.18 -0.22 0.19 -1.58 0.98 0.00 0.00 173.24 172.79 1bb8 s GLN 19 N 1.07 4.10 0.37 4.02 0.74 -1.26 -1.26 119.66 127.43 1bb8 s GLN 19 Ca -0.06 -0.20 -0.04 0.00 0.05 0.00 0.00 55.36 55.12 1bb8 s GLN 19 Cb -0.05 -3.52 0.08 0.00 1.10 0.00 0.00 33.01 30.62 1bb8 s GLN 19 CO -0.10 0.08 0.50 0.54 -0.55 0.00 0.00 175.29 175.76 1bb8 n ARG 20 N 4.20 -0.16 0.23 1.67 1.74 -1.11 -4.92 116.66 118.30 1bb8 n ARG 20 Ca -0.14 -1.00 0.11 0.00 -0.77 0.00 0.00 57.85 56.05 1bb8 n ARG 20 Cb 0.52 -0.45 0.45 0.00 -1.02 0.00 0.00 32.46 31.96 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 -1.98 -2.71 116.57 123.99 1bb8 h LYS 21 Ca -0.16 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.43 1bb8 h LYS 21 Cb 0.51 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.17 1bb8 h LYS 21 CO 0.14 0.18 -0.20 -0.25 -2.06 0.00 0.00 179.45 177.26 1bb8 n ASP 22 N -3.30 0.30 0.00 0.86 9.92 -1.26 -4.92 116.55 118.16 1bb8 n ASP 22 Ca 0.01 0.26 0.00 0.00 -0.53 0.00 0.00 54.79 54.52 1bb8 n ASP 22 Cb 0.43 -0.26 0.00 0.00 -0.64 0.00 0.00 41.12 40.66 1bb8 n ASP 22 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1bb8 n GLY 23 N 1.46 3.38 3.77 0.44 0.00 -1.02 -5.04 105.19 108.17 1bb8 n GLY 23 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.76 4.14 0.74 1.61 1.70 -1.26 -4.65 118.95 120.47 1bb8 s ARG 24 Ca 0.00 2.53 -0.11 0.00 -0.47 0.00 0.00 55.73 57.68 1bb8 s ARG 24 Cb 0.00 -3.00 0.04 0.00 -0.57 0.00 0.00 34.95 31.42 1bb8 s ARG 24 CO 0.00 -0.53 1.11 0.71 -1.08 0.00 0.00 175.30 175.51 1bb8 s TYR 25 N -0.68 3.17 -0.18 5.89 2.02 0.18 -2.77 117.35 124.99 1bb8 s TYR 25 Ca 0.56 0.90 -0.06 0.00 -0.37 0.00 0.00 57.07 58.10 1bb8 s TYR 25 Cb -0.46 -3.21 0.09 0.00 -0.40 0.00 0.00 41.96 37.97 1bb8 s TYR 25 CO 0.56 -1.39 0.36 -1.17 -1.57 0.00 0.00 175.55 172.34 1bb8 s LEU 26 N -5.42 -0.52 0.25 -1.29 2.96 -0.39 -2.99 118.68 111.28 1bb8 s LEU 26 Ca 0.59 0.78 0.08 0.00 -0.22 0.00 0.00 54.13 55.36 1bb8 s LEU 26 Cb -0.11 1.10 -0.05 0.00 0.50 0.00 0.00 46.19 47.63 1bb8 s LEU 26 CO 0.50 -0.24 -0.11 -0.47 -1.32 0.00 0.00 176.35 174.71 1bb8 s TYR 27 N 2.54 1.89 -0.02 5.38 5.04 -1.00 -1.47 117.35 129.71 1bb8 s TYR 27 Ca 0.01 -0.61 0.03 0.00 -2.44 0.00 0.00 57.07 54.06 1bb8 s TYR 27 Cb -0.12 -0.97 -0.00 0.00 0.35 0.00 0.00 41.96 41.21 1bb8 s TYR 27 CO -0.12 0.36 -0.11 0.21 -1.34 0.00 0.00 175.55 174.56 1bb8 s LYS 28 N -3.67 0.97 0.13 4.97 2.20 -1.25 -1.57 119.74 121.53 1bb8 s LYS 28 Ca 0.27 -0.37 -0.04 0.00 -0.36 0.00 0.00 55.97 55.46 1bb8 s LYS 28 Cb 0.01 -0.92 -0.03 0.00 -1.51 0.00 0.00 37.83 35.38 1bb8 s LYS 28 CO 0.10 0.19 0.13 1.52 -0.36 0.00 0.00 175.35 176.93 1bb8 s TYR 29 N -0.07 0.64 -0.10 4.03 1.13 -1.11 -4.99 117.35 116.88 1bb8 s TYR 29 Ca 0.01 -1.03 -0.03 0.00 -1.41 0.00 0.00 57.07 54.61 1bb8 s TYR 29 Cb -0.06 -0.31 -0.03 0.00 -1.10 0.00 0.00 41.96 40.45 1bb8 s TYR 29 CO 0.00 -0.57 0.03 0.42 -2.51 0.00 0.00 175.55 172.92 1bb8 s ILE 30 N -4.00 4.53 0.71 -3.49 1.01 -1.26 -1.18 121.20 117.52 1bb8 s ILE 30 Ca 0.19 -0.16 -0.06 0.00 0.00 0.00 0.00 60.65 60.62 1bb8 s ILE 30 Cb 0.06 -2.93 0.15 0.00 0.01 0.00 0.00 42.46 39.75 1bb8 s ILE 30 CO -0.01 0.59 0.97 0.47 0.00 0.00 0.00 174.94 176.97 1bb8 n ASP 31 N 2.27 0.72 0.00 3.58 8.00 -1.14 -4.90 116.55 125.09 1bb8 n ASP 31 Ca -0.19 -1.75 0.05 0.00 0.71 0.00 0.00 54.79 53.62 1bb8 n ASP 31 Cb 0.54 -0.68 0.31 0.00 -0.02 0.00 0.00 41.12 41.27 1bb8 n ASP 31 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1bb8 n SER 32 N -3.25 0.00 0.00 -2.24 3.41 -1.23 -1.51 113.62 108.80 1bb8 n SER 32 Ca 0.14 -0.23 0.10 0.00 -0.26 0.00 0.00 58.87 58.63 1bb8 n SER 32 Cb 0.50 -0.07 -0.07 0.00 -0.26 0.00 0.00 64.21 64.31 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 -1.07 0.01 -0.09 7.33 3.01 -1.26 -4.94 117.46 120.44 1bb8 n PHE 33 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.54 1bb8 n PHE 33 Cb 0.05 -0.07 0.00 0.00 -0.01 0.00 0.00 39.48 39.45 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 1.48 1.72 3.79 1.37 0.00 -0.57 -5.02 105.19 107.97 1bb8 n GLY 34 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.37 4.46 0.46 1.61 -1.05 -1.26 -4.82 118.70 117.72 1bb8 s GLU 35 Ca 0.00 1.19 -0.22 0.00 -0.15 0.00 0.00 54.97 55.79 1bb8 s GLU 35 Cb 0.00 -2.74 -0.08 0.00 -0.44 0.00 0.00 34.13 30.87 1bb8 s GLU 35 CO 0.00 0.27 1.07 -1.25 0.95 0.00 0.00 175.26 176.30 1bb8 s PRO 36 N -2.19 3.84 0.26 -4.83 0.04 -1.26 -2.89 135.00 127.97 1bb8 s PRO 36 Ca 0.50 1.51 0.01 0.00 0.04 0.00 0.00 61.00 63.06 1bb8 s PRO 36 Cb -0.17 -2.27 -0.05 0.00 0.04 0.00 0.00 34.50 32.06 1bb8 s PRO 36 CO 0.22 -0.42 0.11 -0.65 0.04 0.00 0.00 177.00 176.30 1bb8 s GLN 37 N -2.93 1.40 0.01 4.56 1.11 -0.32 -4.92 119.66 118.57 1bb8 s GLN 37 Ca 0.65 -1.76 0.00 0.00 0.01 0.00 0.00 55.36 54.26 1bb8 s GLN 37 Cb -0.21 -0.14 -0.01 0.00 -1.01 0.00 0.00 33.01 31.64 1bb8 s GLN 37 CO 0.25 -0.34 -0.03 -0.06 0.01 0.00 0.00 175.29 175.13 1bb8 s PHE 38 N -3.81 0.23 0.06 0.91 0.40 -1.26 -2.77 117.98 111.75 1bb8 s PHE 38 Ca 0.38 -0.32 0.08 0.00 -0.60 0.00 0.00 56.93 56.47 1bb8 s PHE 38 Cb 0.07 -0.16 -0.03 0.00 0.51 0.00 0.00 43.02 43.42 1bb8 s PHE 38 CO 0.14 -0.10 -0.21 0.14 0.70 0.00 0.00 175.22 175.89 1bb8 s VAL 39 N -0.86 1.67 0.09 -0.44 -7.23 -0.61 -5.00 120.40 108.03 1bb8 s VAL 39 Ca -0.09 -1.30 0.06 0.00 -1.81 0.00 0.00 61.98 58.84 1bb8 s VAL 39 Cb -0.06 -1.48 -0.03 0.00 0.56 0.00 0.00 36.38 35.37 1bb8 s VAL 39 CO -0.00 0.12 -0.16 -0.31 -0.31 0.00 0.00 175.10 174.44 1bb8 s TYR 40 N -0.91 1.41 -0.23 2.82 1.51 -1.26 -2.38 117.35 118.30 1bb8 s TYR 40 Ca 0.07 -0.47 -0.28 0.00 -1.01 0.00 0.00 57.07 55.38 1bb8 s TYR 40 Cb -0.09 -0.77 0.15 0.00 -0.11 0.00 0.00 41.96 41.13 1bb8 s TYR 40 CO 0.03 0.12 1.13 0.45 -1.11 0.00 0.00 175.55 176.16 1bb8 s SER 41 N -1.95 -0.29 -0.02 2.29 0.15 -1.16 -4.95 113.70 107.77 1bb8 s SER 41 Ca 0.03 0.42 0.10 0.00 0.70 0.00 0.00 55.95 57.19 1bb8 s SER 41 Cb -0.09 0.37 0.30 0.00 -1.71 0.00 0.00 66.02 64.90 1bb8 s SER 41 CO 0.03 -0.20 1.22 0.79 1.20 0.00 0.00 173.24 176.28 1bb8 n TRP 42 N 1.18 0.51 -4.98 3.44 7.02 -1.26 0.49 117.44 123.84 1bb8 n TRP 42 Ca -0.09 -0.24 -0.27 0.00 -1.02 0.00 0.00 57.50 55.88 1bb8 n TRP 42 Cb 0.57 -0.04 -0.15 0.00 -2.42 0.00 0.00 31.31 29.27 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 -1.59 1.68 -0.24 -0.99 1.02 -1.26 -4.72 119.74 113.64 1bb8 s LYS 43 Ca 0.22 -0.81 -0.09 0.00 0.02 0.00 0.00 55.97 55.32 1bb8 s LYS 43 Cb 0.12 -1.66 -0.17 0.00 -0.52 0.00 0.00 37.83 35.60 1bb8 s LYS 43 CO 0.14 0.45 -0.10 -0.11 -0.92 0.00 0.00 175.35 174.80 1bb8 n LEU 44 N 2.40 2.40 -4.66 3.17 7.94 -1.26 -3.63 117.00 123.37 1bb8 n LEU 44 Ca -0.16 0.17 -0.29 0.00 -1.11 0.00 0.00 56.01 54.62 1bb8 n LEU 44 Cb 0.53 -0.92 -0.10 0.00 0.53 0.00 0.00 43.42 43.45 1bb8 n LEU 44 CO 0.23 0.70 -0.28 0.68 -1.11 0.00 0.00 177.39 177.62 1bb8 s VAL 45 N -2.50 1.70 -0.00 1.96 -7.23 -1.26 -3.28 120.40 109.78 1bb8 s VAL 45 Ca -0.33 -2.00 0.32 0.00 -1.81 0.00 0.00 61.98 58.16 1bb8 s VAL 45 Cb 0.10 -2.72 0.37 0.00 0.56 0.00 0.00 36.38 34.69 1bb8 s VAL 45 CO 0.59 0.00 1.93 0.00 -0.31 0.00 0.00 175.10 177.31 1bb8 h ALA 46 N 1.65 1.00 -0.01 1.32 0.00 -1.94 -2.85 119.26 118.43 1bb8 h ALA 46 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1bb8 h ALA 46 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1bb8 h ALA 46 CO 0.78 0.00 -0.07 0.25 0.00 0.00 0.00 179.25 180.22 1bb8 n THR 47 N -3.00 0.00 -0.78 0.00 -2.24 -1.26 -4.89 114.28 102.11 1bb8 n THR 47 Ca 0.01 -0.13 -0.13 0.00 -2.27 0.00 0.00 64.05 61.53 1bb8 n THR 47 Cb 0.31 0.14 0.11 0.00 -2.10 0.00 0.00 70.33 68.79 1bb8 n THR 47 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1bb8 n ASP 48 N -0.47 -1.36 -3.72 3.42 8.00 -1.08 -5.08 116.55 116.27 1bb8 n ASP 48 Ca 0.18 -0.82 -0.12 0.00 0.71 0.00 0.00 54.79 54.75 1bb8 n ASP 48 Cb 0.29 -0.43 -0.12 0.00 -0.02 0.00 0.00 41.12 40.83 1bb8 n ASP 48 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1bb8 s ARG 49 N -4.08 0.29 -0.01 -1.24 3.00 -1.26 -5.05 118.95 110.60 1bb8 s ARG 49 Ca 0.31 0.63 -0.29 0.00 -1.00 0.00 0.00 55.73 55.38 1bb8 s ARG 49 Cb -0.03 -0.07 -0.03 0.00 0.00 0.00 0.00 34.95 34.82 1bb8 s ARG 49 CO 0.23 -0.16 0.94 0.14 0.00 0.00 0.00 175.30 176.46 1bb8 s VAL 50 N 1.26 4.89 0.51 7.11 -7.23 -1.26 -4.92 120.40 120.76 1bb8 s VAL 50 Ca -0.09 1.97 -0.20 0.00 -1.81 0.00 0.00 61.98 61.85 1bb8 s VAL 50 Cb -0.09 -4.28 -0.10 0.00 0.56 0.00 0.00 36.38 32.47 1bb8 s VAL 50 CO -0.10 0.18 0.60 -2.65 -0.31 0.00 0.00 175.10 172.81 1bb8 n PRO 51 N 3.86 0.63 -1.57 4.82 -0.02 -1.26 -4.74 135.00 136.73 1bb8 n PRO 51 Ca 0.05 0.24 -0.48 0.00 -2.02 0.00 0.00 63.50 61.29 1bb8 n PRO 51 Cb 0.51 -1.70 -0.04 0.00 -0.02 0.00 0.00 33.50 32.26 1bb8 n PRO 51 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bb8 n ALA 52 N -1.32 -0.84 0.00 3.55 0.00 -1.26 -1.78 120.51 118.85 1bb8 n ALA 52 Ca 0.11 0.45 0.00 0.00 0.00 0.00 0.00 53.44 54.01 1bb8 n ALA 52 Cb 0.44 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 17.89 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 1.88 2.16 3.79 0.00 0.00 -1.26 -5.06 105.19 106.71 1bb8 n GLY 53 Ca 0.14 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 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 4.11 0.53 1.61 3.01 -0.74 -5.06 119.74 123.20 1bb8 s LYS 54 Ca 0.00 0.46 -0.19 0.00 -1.01 0.00 0.00 55.97 55.24 1bb8 s LYS 54 Cb 0.00 -3.30 -0.07 0.00 -1.01 0.00 0.00 37.83 33.46 1bb8 s LYS 54 CO 0.00 0.50 1.05 1.03 0.51 0.00 0.00 175.35 178.44 1bb8 s ARG 55 N -0.49 3.61 1.15 1.68 1.81 -1.26 -4.81 118.95 120.64 1bb8 s ARG 55 Ca 0.25 1.31 -0.16 0.00 -1.72 0.00 0.00 55.73 55.41 1bb8 s ARG 55 Cb -0.16 -2.07 0.19 0.00 -0.45 0.00 0.00 34.95 32.46 1bb8 s ARG 55 CO 0.13 -0.58 0.46 -0.25 -0.68 0.00 0.00 175.30 174.38 1bb8 n ASP 56 N -1.37 -2.13 -3.67 0.23 8.00 -1.26 -4.95 116.55 111.39 1bb8 n ASP 56 Ca 0.09 -0.15 -0.06 0.00 0.71 0.00 0.00 54.79 55.38 1bb8 n ASP 56 Cb 0.53 -1.09 -0.02 0.00 -0.02 0.00 0.00 41.12 40.52 1bb8 n ASP 56 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bb8 s ILE 58 N -3.38 4.89 0.81 0.00 1.01 -1.26 -5.00 121.20 118.27 1bb8 s ILE 58 Ca 0.09 1.71 -0.14 0.00 0.00 0.00 0.00 60.65 62.31 1bb8 s ILE 58 Cb -0.02 -4.17 0.05 0.00 0.01 0.00 0.00 42.46 38.33 1bb8 s ILE 58 CO -0.01 0.07 0.92 -1.54 0.00 0.00 0.00 174.94 174.38 1bb8 n SER 59 N 4.85 0.03 -0.11 3.58 3.41 -1.26 -4.51 113.62 119.61 1bb8 n SER 59 Ca 0.04 0.55 -0.06 0.00 -0.26 0.00 0.00 58.87 59.15 1bb8 n SER 59 Cb 0.49 -1.39 0.02 0.00 -0.26 0.00 0.00 64.21 63.07 1bb8 n SER 59 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1bb8 h LEU 60 N -0.88 0.07 -0.30 1.04 4.07 -1.61 0.41 115.31 118.12 1bb8 h LEU 60 Ca -0.46 0.05 0.06 0.00 0.08 0.00 0.00 57.88 57.62 1bb8 h LEU 60 Cb 1.31 0.06 -0.06 0.00 1.08 0.00 0.00 40.66 43.04 1bb8 h LEU 60 CO 0.43 0.08 -0.11 0.03 -1.08 0.00 0.00 178.44 177.79 1bb8 h ARG 61 N 0.24 -0.05 -0.03 1.13 2.47 -1.90 0.28 114.38 116.53 1bb8 h ARG 61 Ca 0.17 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.67 1bb8 h ARG 61 Cb 0.18 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.51 1bb8 h ARG 61 CO -0.20 -0.03 -0.91 0.93 0.56 0.00 0.00 179.97 180.31 1bb8 h GLU 62 N -0.05 0.49 -0.36 0.04 5.08 -1.80 -2.98 114.58 115.01 1bb8 h GLU 62 Ca 0.15 -0.49 -0.05 0.00 -1.00 0.00 0.00 59.36 57.96 1bb8 h GLU 62 Cb 0.28 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1bb8 h GLU 62 CO -0.34 1.13 0.01 -0.22 -1.00 0.00 0.00 179.01 178.60 1bb8 h LYS 63 N 0.29 0.62 -0.12 2.33 3.64 0.28 -2.51 116.57 121.11 1bb8 h LYS 63 Ca -0.08 -0.19 -0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1bb8 h LYS 63 Cb 1.54 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.29 1bb8 h LYS 63 CO 0.16 0.72 0.07 0.82 -2.27 0.00 0.00 179.45 178.96 1bb8 h ILE 64 N 0.44 1.06 -0.80 2.00 5.03 -0.52 0.19 117.51 124.91 1bb8 h ILE 64 Ca 0.10 -0.14 0.09 0.00 -0.12 0.00 0.00 64.86 64.79 1bb8 h ILE 64 Cb 0.43 0.94 -0.07 0.00 -3.03 0.00 0.00 36.82 35.09 1bb8 h ILE 64 CO 0.02 0.05 0.45 0.00 -0.68 0.00 0.00 178.15 177.99 1bb8 h ALA 65 N 1.01 1.12 0.09 1.87 0.00 -1.45 0.54 119.26 122.44 1bb8 h ALA 65 Ca 0.04 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1bb8 h ALA 65 Cb 0.02 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1bb8 h ALA 65 CO -0.01 0.09 -0.04 1.49 0.00 0.00 0.00 179.25 180.78 1bb8 h GLU 66 N 0.77 -0.12 0.00 0.00 4.81 -1.03 -3.08 114.58 115.93 1bb8 h GLU 66 Ca 0.38 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.56 1bb8 h GLU 66 Cb 0.32 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1bb8 h GLU 66 CO -0.24 0.34 -0.26 -0.07 -0.73 0.00 0.00 179.01 178.05 1bb8 h LEU 67 N -0.64 0.00 0.02 1.64 3.38 -0.70 -2.83 115.31 116.18 1bb8 h LEU 67 Ca -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1bb8 h LEU 67 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1bb8 h LEU 67 CO 0.02 0.26 -0.01 -0.61 0.09 0.00 0.00 178.44 178.19 1bb8 h GLN 68 N 0.00 -0.03 -0.05 1.13 4.15 0.07 -3.29 115.11 117.10 1bb8 h GLN 68 Ca -0.00 0.00 -0.24 0.00 0.77 0.00 0.00 58.65 59.17 1bb8 h GLN 68 Cb 0.61 0.01 0.01 0.00 0.21 0.00 0.00 27.48 28.32 1bb8 h GLN 68 CO 0.03 -0.02 -0.94 1.57 -1.93 0.00 0.00 178.83 177.55 1bb8 h LYS 69 N -0.14 0.68 -0.33 1.69 2.10 -1.68 -2.97 116.57 115.91 1bb8 h LYS 69 Ca -0.00 -0.66 -0.01 0.00 -2.00 0.00 0.00 60.65 57.98 1bb8 h LYS 69 Cb 0.02 0.17 -0.02 0.00 -0.90 0.00 0.00 32.23 31.51 1bb8 h LYS 69 CO 0.00 1.26 0.17 0.22 -2.00 0.00 0.00 179.45 179.11 1bb8 h ASP 70 N 0.41 0.40 0.22 7.07 1.82 -1.67 1.67 116.42 126.34 1bb8 h ASP 70 Ca -0.10 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.52 1bb8 h ASP 70 Cb 1.58 -0.10 0.00 0.00 0.68 0.00 0.00 39.33 41.49 1bb8 h ASP 70 CO 0.18 0.33 -0.09 -0.38 -1.61 0.00 0.00 179.24 177.68 1bb8 n ILE 71 N -4.44 0.00 0.17 2.25 2.08 -1.22 -4.64 119.36 113.56 1bb8 n ILE 71 Ca 0.02 -0.10 0.00 0.00 0.56 0.00 0.00 62.75 63.23 1bb8 n ILE 71 Cb 0.10 0.03 0.00 0.00 -0.75 0.00 0.00 39.64 39.02 1bb8 n ILE 71 CO 0.00 0.00 0.00 1.41 0.56 0.00 0.00 176.55 178.52 1bb8 n HIS 72 N -0.69 -3.18 -0.25 1.39 8.25 -0.23 -3.51 115.22 117.00 1bb8 n HIS 72 Ca 0.16 0.77 0.00 0.00 -0.26 0.00 0.00 57.72 58.39 1bb8 n HIS 72 Cb 0.28 1.47 0.00 0.00 1.12 0.00 0.00 29.99 32.85 1bb8 n HIS 72 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51