#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 4.22 -0.05 5.31 2.47 -1.26 -5.03 119.74 125.39 1bb8 s LYS 4 Ca 0.00 0.87 -0.26 0.00 -1.56 0.00 0.00 55.97 55.02 1bb8 s LYS 4 Cb 0.00 -2.72 -0.03 0.00 -1.46 0.00 0.00 37.83 33.62 1bb8 s LYS 4 CO 0.00 0.30 0.84 1.03 0.16 0.00 0.00 175.35 177.68 1bb8 s ARG 5 N -2.31 4.47 0.05 4.03 1.81 -1.26 -5.04 118.95 120.69 1bb8 s ARG 5 Ca 0.48 1.13 -0.02 0.00 -1.72 0.00 0.00 55.73 55.59 1bb8 s ARG 5 Cb -0.15 -3.47 -0.03 0.00 -0.45 0.00 0.00 34.95 30.85 1bb8 s ARG 5 CO 0.20 -0.04 0.01 1.03 -0.68 0.00 0.00 175.30 175.82 1bb8 s ARG 6 N 1.09 0.57 0.99 3.54 0.52 -1.26 -4.37 118.95 120.03 1bb8 s ARG 6 Ca 0.44 -1.01 -0.17 0.00 -0.52 0.00 0.00 55.73 54.47 1bb8 s ARG 6 Cb -0.19 0.21 0.23 0.00 0.52 0.00 0.00 34.95 35.72 1bb8 s ARG 6 CO 0.21 -0.12 1.32 -0.25 0.02 0.00 0.00 175.30 176.49 1bb8 n ASP 7 N 0.47 0.03 0.13 0.23 8.00 -0.72 -4.89 116.55 119.81 1bb8 n ASP 7 Ca -0.17 -1.47 0.11 0.00 0.71 0.00 0.00 54.79 53.98 1bb8 n ASP 7 Cb 0.60 -1.02 0.51 0.00 -0.02 0.00 0.00 41.12 41.19 1bb8 n ASP 7 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1bb8 n ASN 8 N -3.89 0.61 -1.55 -2.24 0.23 -1.26 -2.00 115.26 105.16 1bb8 n ASN 8 Ca 0.17 0.69 0.09 0.00 -0.53 0.00 0.00 54.58 54.99 1bb8 n ASN 8 Cb 0.58 -0.80 0.35 0.00 -2.08 0.00 0.00 39.78 37.82 1bb8 n ASN 8 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1bb8 n ARG 9 N -2.22 3.65 -1.41 -3.83 5.12 -1.26 -4.89 116.66 111.82 1bb8 n ARG 9 Ca 0.01 -2.75 -0.11 0.00 -1.93 0.00 0.00 57.85 53.07 1bb8 n ARG 9 Cb 0.17 -1.88 -0.04 0.00 -1.16 0.00 0.00 32.46 29.54 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 1.11 1.13 3.68 -0.13 0.00 -0.85 -4.97 105.19 105.16 1bb8 n GLY 10 Ca 0.25 -0.50 -0.39 0.00 0.00 0.00 0.00 46.02 45.38 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 -3.11 4.26 -0.83 1.61 0.52 -1.26 -4.84 118.95 115.30 1bb8 s ARG 11 Ca 0.00 0.51 -0.25 0.00 -0.52 0.00 0.00 55.73 55.46 1bb8 s ARG 11 Cb 0.00 -3.52 0.02 0.00 0.52 0.00 0.00 34.95 31.97 1bb8 s ARG 11 CO 0.00 -0.06 1.49 0.42 0.02 0.00 0.00 175.30 177.17 1bb8 s ILE 12 N 1.32 3.71 0.41 1.52 1.01 -1.26 -1.76 121.20 126.15 1bb8 s ILE 12 Ca 0.27 -0.09 -0.08 0.00 0.00 0.00 0.00 60.65 60.75 1bb8 s ILE 12 Cb -0.16 -4.74 -0.05 0.00 0.01 0.00 0.00 42.46 37.52 1bb8 s ILE 12 CO 0.11 -1.66 0.74 -1.48 0.00 0.00 0.00 174.94 172.65 1bb8 s LEU 13 N 6.41 3.81 0.00 2.97 2.34 -1.26 -5.02 118.68 127.92 1bb8 s LEU 13 Ca 0.47 1.02 -0.00 0.00 0.06 0.00 0.00 54.13 55.67 1bb8 s LEU 13 Cb -0.06 -3.91 0.09 0.00 -0.56 0.00 0.00 46.19 41.75 1bb8 s LEU 13 CO 0.06 -0.42 0.63 0.29 -1.06 0.00 0.00 176.35 175.85 1bb8 n LYS 14 N -1.49 0.13 -1.72 1.48 4.01 -1.26 -4.93 118.16 114.38 1bb8 n LYS 14 Ca 0.01 -1.67 -0.40 0.00 -0.51 0.00 0.00 58.31 55.74 1bb8 n LYS 14 Cb 0.54 -0.43 0.02 0.00 -0.51 0.00 0.00 35.03 34.66 1bb8 n LYS 14 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 1bb8 n THR 15 N -2.33 3.01 0.00 -0.18 -1.04 -1.26 -3.03 114.28 109.46 1bb8 n THR 15 Ca 0.10 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.61 1bb8 n THR 15 Cb 0.37 -1.61 0.00 0.00 -1.82 0.00 0.00 70.33 67.27 1bb8 n THR 15 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1bb8 n GLY 16 N 0.79 2.17 3.69 3.41 0.00 -1.26 -4.99 105.19 109.01 1bb8 n GLY 16 Ca 0.08 -0.36 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 1bb8 n GLY 16 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1bb8 n GLU 17 N 0.00 1.13 -3.43 1.61 1.02 -1.17 -4.47 120.64 115.33 1bb8 n GLU 17 Ca 0.00 0.44 -0.12 0.00 -0.02 0.00 0.00 57.16 57.46 1bb8 n GLU 17 Cb 0.00 -2.42 -0.02 0.00 -0.02 0.00 0.00 31.44 28.98 1bb8 n GLU 17 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1bb8 s SER 18 N -1.26 -0.54 -0.05 1.62 0.01 -0.47 -4.85 113.70 108.15 1bb8 s SER 18 Ca 0.79 0.02 -0.10 0.00 1.31 0.00 0.00 55.95 57.97 1bb8 s SER 18 Cb -0.40 0.57 -0.05 0.00 0.21 0.00 0.00 66.02 66.35 1bb8 s SER 18 CO 0.44 -0.91 0.26 0.00 0.41 0.00 0.00 173.24 173.43 1bb8 s GLN 19 N -3.60 3.64 0.35 12.44 -2.07 -1.26 -1.29 119.66 127.86 1bb8 s GLN 19 Ca 0.01 0.07 -0.03 0.00 -1.82 0.00 0.00 55.36 53.60 1bb8 s GLN 19 Cb -0.01 -3.18 0.07 0.00 -1.09 0.00 0.00 33.01 28.81 1bb8 s GLN 19 CO -0.12 0.72 0.48 0.54 -1.32 0.00 0.00 175.29 175.59 1bb8 n ARG 20 N 1.76 -0.02 0.09 9.60 5.12 -0.61 -4.95 116.66 127.66 1bb8 n ARG 20 Ca -0.16 -1.05 -0.05 0.00 -1.93 0.00 0.00 57.85 54.66 1bb8 n ARG 20 Cb 0.54 -0.39 -0.00 0.00 -1.16 0.00 0.00 32.46 31.44 1bb8 n ARG 20 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 1bb8 h LYS 21 N 0.00 0.00 0.00 5.56 6.56 -1.99 -3.22 116.57 123.48 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 0.84 -0.59 -0.25 -2.06 0.00 0.00 179.45 177.54 1bb8 n ASP 22 N -3.52 0.57 0.00 0.86 8.00 -1.26 -4.96 116.55 116.24 1bb8 n ASP 22 Ca -0.00 -0.14 0.00 0.00 0.71 0.00 0.00 54.79 55.36 1bb8 n ASP 22 Cb 0.81 0.28 0.00 0.00 -0.02 0.00 0.00 41.12 42.19 1bb8 n ASP 22 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bb8 n GLY 23 N 1.44 1.17 3.78 0.44 0.00 -1.22 -5.09 105.19 105.71 1bb8 n GLY 23 Ca 0.04 0.00 -0.41 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 -0.03 3.97 0.82 1.61 1.70 -1.26 -4.49 118.95 121.27 1bb8 s ARG 24 Ca 0.00 2.53 -0.12 0.00 -0.47 0.00 0.00 55.73 57.67 1bb8 s ARG 24 Cb 0.00 -2.87 0.09 0.00 -0.57 0.00 0.00 34.95 31.60 1bb8 s ARG 24 CO 0.00 -0.63 1.19 0.71 -1.08 0.00 0.00 175.30 175.49 1bb8 s TYR 25 N -1.15 2.86 -0.18 5.89 2.02 0.15 -1.57 117.35 125.37 1bb8 s TYR 25 Ca 0.55 0.72 -0.09 0.00 -0.37 0.00 0.00 57.07 57.89 1bb8 s TYR 25 Cb -0.46 -3.54 0.07 0.00 -0.40 0.00 0.00 41.96 37.63 1bb8 s TYR 25 CO 0.61 -1.84 0.41 -1.17 -1.57 0.00 0.00 175.55 172.00 1bb8 s LEU 26 N -5.60 -0.25 0.14 -1.29 2.96 -0.41 -3.11 118.68 111.12 1bb8 s LEU 26 Ca 0.63 0.92 0.06 0.00 -0.22 0.00 0.00 54.13 55.51 1bb8 s LEU 26 Cb -0.10 1.35 -0.04 0.00 0.50 0.00 0.00 46.19 47.89 1bb8 s LEU 26 CO 0.49 -0.20 -0.13 -0.47 -1.32 0.00 0.00 176.35 174.72 1bb8 s TYR 27 N 1.73 1.41 0.03 5.38 5.04 -1.01 -1.37 117.35 128.56 1bb8 s TYR 27 Ca -0.07 -0.62 0.06 0.00 -2.44 0.00 0.00 57.07 54.00 1bb8 s TYR 27 Cb -0.09 -0.71 -0.02 0.00 0.35 0.00 0.00 41.96 41.48 1bb8 s TYR 27 CO -0.13 0.16 -0.17 0.21 -1.34 0.00 0.00 175.55 174.28 1bb8 s LYS 28 N -3.16 1.24 0.34 4.97 2.20 -1.26 -1.60 119.74 122.47 1bb8 s LYS 28 Ca 0.13 -0.78 -0.05 0.00 -0.36 0.00 0.00 55.97 54.91 1bb8 s LYS 28 Cb -0.02 -1.27 0.02 0.00 -1.51 0.00 0.00 37.83 35.05 1bb8 s LYS 28 CO 0.03 0.33 0.53 2.48 -0.36 0.00 0.00 175.35 178.36 1bb8 n TYR 29 N 2.11 -1.64 -4.35 4.03 4.11 -1.13 -5.01 117.16 115.29 1bb8 n TYR 29 Ca -0.17 -2.06 -0.32 0.00 -0.00 0.00 0.00 57.90 55.36 1bb8 n TYR 29 Cb 0.54 0.61 -0.09 0.00 -0.00 0.00 0.00 39.34 40.40 1bb8 n TYR 29 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.86 177.28 1bb8 s ILE 30 N -2.62 3.89 0.65 -3.48 1.09 -1.26 -1.98 121.20 117.50 1bb8 s ILE 30 Ca 0.24 -0.73 -0.08 0.00 -1.10 0.00 0.00 60.65 58.98 1bb8 s ILE 30 Cb -0.02 -2.73 0.02 0.00 -1.06 0.00 0.00 42.46 38.68 1bb8 s ILE 30 CO 0.17 0.36 0.99 -1.81 -0.10 0.00 0.00 174.94 174.55 1bb8 s ASP 31 N -1.56 5.36 0.00 3.58 1.01 -0.43 -4.88 116.67 119.75 1bb8 s ASP 31 Ca 0.19 0.79 0.00 0.00 0.71 0.00 0.00 52.55 54.24 1bb8 s ASP 31 Cb -0.11 -1.64 0.00 0.00 1.01 0.00 0.00 42.92 42.17 1bb8 s ASP 31 CO 0.10 -1.28 0.50 -1.20 0.21 0.00 0.00 175.17 173.50 1bb8 n SER 32 N -2.80 0.00 -0.00 0.27 7.64 -1.26 -0.70 113.62 116.77 1bb8 n SER 32 Ca 0.06 0.02 0.06 0.00 1.01 0.00 0.00 58.87 60.02 1bb8 n SER 32 Cb 0.58 -0.02 -0.08 0.00 -1.01 0.00 0.00 64.21 63.68 1bb8 n SER 32 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1bb8 n PHE 33 N -1.00 0.00 0.00 1.43 3.01 -1.26 -4.70 117.46 114.93 1bb8 n PHE 33 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1bb8 n PHE 33 Cb 0.00 -0.11 0.00 0.00 -0.01 0.00 0.00 39.48 39.36 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 1.49 0.31 3.83 1.37 0.00 0.12 -5.08 105.19 107.22 1bb8 n GLY 34 Ca 0.00 0.00 -0.33 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 -0.82 4.17 0.24 1.61 -1.05 -1.26 -4.74 118.70 116.84 1bb8 s GLU 35 Ca 0.00 0.99 -0.23 0.00 -0.15 0.00 0.00 54.97 55.58 1bb8 s GLU 35 Cb 0.00 -2.26 -0.09 0.00 -0.44 0.00 0.00 34.13 31.35 1bb8 s GLU 35 CO 0.00 0.03 0.80 -1.25 0.95 0.00 0.00 175.26 175.79 1bb8 s PRO 36 N -3.11 4.42 0.25 -4.83 0.04 -1.26 -1.31 135.00 129.20 1bb8 s PRO 36 Ca 0.60 1.07 0.01 0.00 0.04 0.00 0.00 61.00 62.72 1bb8 s PRO 36 Cb -0.09 -2.93 -0.03 0.00 0.04 0.00 0.00 34.50 31.48 1bb8 s PRO 36 CO 0.14 0.40 0.21 -0.65 0.04 0.00 0.00 177.00 177.14 1bb8 s GLN 37 N -1.83 1.43 0.05 4.56 1.11 -0.84 -4.93 119.66 119.22 1bb8 s GLN 37 Ca 0.44 -1.76 0.01 0.00 0.01 0.00 0.00 55.36 54.06 1bb8 s GLN 37 Cb -0.19 0.30 -0.03 0.00 -1.01 0.00 0.00 33.01 32.09 1bb8 s GLN 37 CO 0.23 -0.50 -0.05 -0.06 0.01 0.00 0.00 175.29 174.91 1bb8 s PHE 38 N -3.87 0.58 0.02 0.91 0.40 -1.26 -2.81 117.98 111.94 1bb8 s PHE 38 Ca 0.39 -0.72 0.05 0.00 -0.60 0.00 0.00 56.93 56.05 1bb8 s PHE 38 Cb 0.05 -0.37 -0.02 0.00 0.51 0.00 0.00 43.02 43.19 1bb8 s PHE 38 CO 0.18 -0.19 -0.16 0.14 0.70 0.00 0.00 175.22 175.89 1bb8 s VAL 39 N -2.43 1.23 0.08 -0.44 -7.23 -0.62 -4.99 120.40 106.00 1bb8 s VAL 39 Ca -0.03 -0.92 0.09 0.00 -1.81 0.00 0.00 61.98 59.31 1bb8 s VAL 39 Cb -0.03 -1.08 -0.03 0.00 0.56 0.00 0.00 36.38 35.80 1bb8 s VAL 39 CO -0.03 0.15 -0.24 -0.31 -0.31 0.00 0.00 175.10 174.36 1bb8 s TYR 40 N -0.68 2.07 -0.19 2.82 1.51 -1.26 -2.42 117.35 119.20 1bb8 s TYR 40 Ca 0.04 -0.40 -0.30 0.00 -1.01 0.00 0.00 57.07 55.40 1bb8 s TYR 40 Cb -0.07 -1.17 0.14 0.00 -0.11 0.00 0.00 41.96 40.75 1bb8 s TYR 40 CO 0.01 0.20 1.09 0.45 -1.11 0.00 0.00 175.55 176.19 1bb8 s SER 41 N -1.64 -0.28 -0.01 2.29 0.15 -1.18 -4.98 113.70 108.05 1bb8 s SER 41 Ca 0.10 0.28 0.16 0.00 0.70 0.00 0.00 55.95 57.19 1bb8 s SER 41 Cb -0.10 0.23 0.48 0.00 -1.71 0.00 0.00 66.02 64.92 1bb8 s SER 41 CO 0.04 -0.27 1.39 0.79 1.20 0.00 0.00 173.24 176.39 1bb8 n TRP 42 N 0.60 0.75 -4.79 3.44 7.02 -1.26 0.29 117.44 123.49 1bb8 n TRP 42 Ca -0.07 -0.36 -0.25 0.00 -1.02 0.00 0.00 57.50 55.80 1bb8 n TRP 42 Cb 0.58 -0.02 -0.15 0.00 -2.42 0.00 0.00 31.31 29.30 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 -1.33 1.44 -0.19 -0.99 1.02 -1.26 -4.82 119.74 113.61 1bb8 s LYS 43 Ca 0.36 -0.59 -0.11 0.00 0.02 0.00 0.00 55.97 55.65 1bb8 s LYS 43 Cb 0.19 -1.35 -0.21 0.00 -0.52 0.00 0.00 37.83 35.94 1bb8 s LYS 43 CO 0.24 0.33 0.13 -0.11 -0.92 0.00 0.00 175.35 175.01 1bb8 n LEU 44 N 2.79 2.36 -4.58 3.17 7.94 -1.26 -3.26 117.00 124.16 1bb8 n LEU 44 Ca -0.15 0.24 -0.26 0.00 -1.11 0.00 0.00 56.01 54.72 1bb8 n LEU 44 Cb 0.54 -1.00 -0.10 0.00 0.53 0.00 0.00 43.42 43.39 1bb8 n LEU 44 CO 0.24 0.66 -0.34 0.68 -1.11 0.00 0.00 177.39 177.51 1bb8 s VAL 45 N -2.49 2.22 -0.47 1.96 -7.23 -1.26 -3.24 120.40 109.89 1bb8 s VAL 45 Ca -0.29 -2.11 0.22 0.00 -1.81 0.00 0.00 61.98 57.99 1bb8 s VAL 45 Cb 0.08 -2.77 0.23 0.00 0.56 0.00 0.00 36.38 34.48 1bb8 s VAL 45 CO 0.65 -0.14 1.67 0.00 -0.31 0.00 0.00 175.10 176.97 1bb8 n ALA 46 N -0.87 1.52 1.20 1.32 0.00 -1.26 -2.23 120.51 120.18 1bb8 n ALA 46 Ca -0.05 0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.62 1bb8 n ALA 46 Cb 0.64 -1.35 0.36 0.00 0.00 0.00 0.00 19.45 19.10 1bb8 n ALA 46 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1bb8 n THR 47 N -2.17 0.00 -1.32 0.00 -2.24 -1.26 -4.91 114.28 102.37 1bb8 n THR 47 Ca 0.01 -0.10 -0.31 0.00 -2.27 0.00 0.00 64.05 61.39 1bb8 n THR 47 Cb 0.18 0.35 0.09 0.00 -2.10 0.00 0.00 70.33 68.85 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 -2.60 4.59 -0.08 3.42 1.11 -0.95 -5.05 116.67 117.10 1bb8 s ASP 48 Ca 0.22 1.74 0.01 0.00 0.18 0.00 0.00 52.55 54.70 1bb8 s ASP 48 Cb 0.19 -2.47 0.02 0.00 1.07 0.00 0.00 42.92 41.72 1bb8 s ASP 48 CO 0.55 -1.97 -0.11 -0.60 1.18 0.00 0.00 175.17 174.23 1bb8 s ARG 49 N -4.94 1.67 0.45 8.23 3.00 -1.26 -5.01 118.95 121.08 1bb8 s ARG 49 Ca 0.61 -0.37 -0.21 0.00 -1.00 0.00 0.00 55.73 54.76 1bb8 s ARG 49 Cb -0.16 -1.50 -0.10 0.00 0.00 0.00 0.00 34.95 33.19 1bb8 s ARG 49 CO 0.56 -0.08 0.97 0.14 0.00 0.00 0.00 175.30 176.89 1bb8 s VAL 50 N 1.05 4.24 0.60 7.11 -7.23 -1.26 -5.03 120.40 119.87 1bb8 s VAL 50 Ca -0.07 1.39 -0.18 0.00 -1.81 0.00 0.00 61.98 61.30 1bb8 s VAL 50 Cb -0.15 -3.56 -0.03 0.00 0.56 0.00 0.00 36.38 33.20 1bb8 s VAL 50 CO -0.01 -0.31 1.16 -2.16 -0.31 0.00 0.00 175.10 173.48 1bb8 s PRO 51 N -3.21 3.02 0.96 4.82 0.04 -1.26 -4.91 135.00 134.45 1bb8 s PRO 51 Ca 0.63 1.67 -0.15 0.00 0.04 0.00 0.00 61.00 63.19 1bb8 s PRO 51 Cb -0.11 -1.95 -0.07 0.00 0.04 0.00 0.00 34.50 32.41 1bb8 s PRO 51 CO 0.15 -1.13 -0.26 0.00 0.04 0.00 0.00 177.00 175.80 1bb8 n ALA 52 N -1.71 -4.16 0.00 8.56 0.00 -1.26 -2.27 120.51 119.67 1bb8 n ALA 52 Ca 0.12 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.94 1bb8 n ALA 52 Cb 0.51 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.52 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 2.61 2.22 3.81 0.00 0.00 -1.26 -4.98 105.19 107.59 1bb8 n GLY 53 Ca 0.02 -0.26 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 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 3.94 0.44 1.61 -0.14 -0.96 -5.07 119.74 119.55 1bb8 s LYS 54 Ca 0.00 0.24 -0.21 0.00 -1.36 0.00 0.00 55.97 54.65 1bb8 s LYS 54 Cb 0.00 -3.28 -0.11 0.00 -1.68 0.00 0.00 37.83 32.77 1bb8 s LYS 54 CO 0.00 0.57 0.96 1.03 -0.76 0.00 0.00 175.35 177.14 1bb8 s ARG 55 N -0.59 4.20 1.11 1.68 1.81 -1.26 -4.82 118.95 121.08 1bb8 s ARG 55 Ca 0.21 1.11 -0.16 0.00 -1.72 0.00 0.00 55.73 55.16 1bb8 s ARG 55 Cb -0.15 -2.17 0.19 0.00 -0.45 0.00 0.00 34.95 32.37 1bb8 s ARG 55 CO 0.09 -0.06 0.34 -0.25 -0.68 0.00 0.00 175.30 174.74 1bb8 n ASP 56 N -0.73 -3.01 -3.72 0.23 8.00 -1.26 -5.00 116.55 111.06 1bb8 n ASP 56 Ca 0.07 -0.40 -0.03 0.00 0.71 0.00 0.00 54.79 55.15 1bb8 n ASP 56 Cb 0.54 -0.86 -0.01 0.00 -0.02 0.00 0.00 41.12 40.77 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 -3.11 4.87 0.89 0.00 -1.09 -1.26 -4.98 121.20 116.53 1bb8 s ILE 58 Ca 0.12 1.61 -0.11 0.00 -2.23 0.00 0.00 60.65 60.05 1bb8 s ILE 58 Cb -0.00 -4.13 0.12 0.00 -1.58 0.00 0.00 42.46 36.86 1bb8 s ILE 58 CO 0.01 0.01 1.06 -1.54 -1.23 0.00 0.00 174.94 173.25 1bb8 n SER 59 N 5.38 0.19 -0.07 3.58 3.41 -1.26 -4.59 113.62 120.26 1bb8 n SER 59 Ca 0.05 0.45 -0.07 0.00 -0.26 0.00 0.00 58.87 59.04 1bb8 n SER 59 Cb 0.48 -1.45 -0.01 0.00 -0.26 0.00 0.00 64.21 62.97 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 -1.59 -0.23 -0.56 1.04 -0.00 -1.53 0.41 115.31 112.85 1bb8 h LEU 60 Ca -0.44 0.08 0.11 0.00 -0.00 0.00 0.00 57.88 57.63 1bb8 h LEU 60 Cb 1.28 0.16 -0.09 0.00 -0.00 0.00 0.00 40.66 42.01 1bb8 h LEU 60 CO 0.41 -0.08 0.06 0.03 -0.00 0.00 0.00 178.44 178.87 1bb8 h ARG 61 N 0.01 0.18 -0.20 1.13 -0.00 -1.89 0.43 114.38 114.04 1bb8 h ARG 61 Ca 0.13 -0.01 -0.11 0.00 -0.50 0.00 0.00 59.98 59.49 1bb8 h ARG 61 Cb 0.20 -0.04 -0.00 0.00 0.00 0.00 0.00 29.97 30.13 1bb8 h ARG 61 CO -0.27 0.12 -0.32 0.93 0.00 0.00 0.00 179.97 180.43 1bb8 h GLU 62 N 0.18 0.57 -0.55 0.04 4.39 -1.72 -2.72 114.58 114.78 1bb8 h GLU 62 Ca 0.29 -0.35 -0.08 0.00 0.34 0.00 0.00 59.36 59.57 1bb8 h GLU 62 Cb 0.44 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.11 1bb8 h GLU 62 CO -0.42 0.95 0.03 -0.22 -1.16 0.00 0.00 179.01 178.19 1bb8 h LYS 63 N 0.25 0.95 -0.64 2.33 3.64 -0.31 -2.71 116.57 120.07 1bb8 h LYS 63 Ca 0.02 -0.29 -0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1bb8 h LYS 63 Cb 0.90 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.60 1bb8 h LYS 63 CO 0.07 0.94 0.39 0.82 -2.27 0.00 0.00 179.45 179.40 1bb8 h ILE 64 N 0.83 1.18 0.01 2.00 5.03 -0.17 -1.29 117.51 125.09 1bb8 h ILE 64 Ca 0.16 -0.39 0.02 0.00 -0.12 0.00 0.00 64.86 64.53 1bb8 h ILE 64 Cb 0.49 0.27 -0.02 0.00 -3.03 0.00 0.00 36.82 34.53 1bb8 h ILE 64 CO 0.02 0.18 -0.10 0.00 -0.68 0.00 0.00 178.15 177.57 1bb8 h ALA 65 N 1.55 -0.12 -0.14 1.87 0.00 -1.15 -1.27 119.26 120.01 1bb8 h ALA 65 Ca 0.23 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.95 1bb8 h ALA 65 Cb -0.04 0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1bb8 h ALA 65 CO -0.04 -0.60 -0.68 0.93 0.00 0.00 0.00 179.25 178.86 1bb8 h GLU 66 N -0.18 0.71 -0.28 0.00 5.08 -1.44 -3.06 114.58 115.40 1bb8 h GLU 66 Ca 0.04 -0.57 -0.07 0.00 -1.00 0.00 0.00 59.36 57.75 1bb8 h GLU 66 Cb 0.22 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1bb8 h GLU 66 CO -0.10 1.19 -0.11 -0.07 -1.00 0.00 0.00 179.01 178.92 1bb8 h LEU 67 N 0.40 0.59 -1.05 1.33 3.38 -1.19 -2.16 115.31 116.61 1bb8 h LEU 67 Ca -0.05 -0.39 -0.10 0.00 0.09 0.00 0.00 57.88 57.43 1bb8 h LEU 67 Cb 1.32 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 1bb8 h LEU 67 CO 0.14 0.85 -0.47 1.56 0.09 0.00 0.00 178.44 180.62 1bb8 h GLN 68 N 0.33 0.01 0.06 1.13 4.20 -1.34 -3.06 115.11 116.44 1bb8 h GLN 68 Ca 0.07 -0.01 -0.28 0.00 0.06 0.00 0.00 58.65 58.49 1bb8 h GLN 68 Cb 0.62 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.42 1bb8 h GLN 68 CO 0.04 0.48 -1.13 0.87 -0.67 0.00 0.00 178.83 178.42 1bb8 h LYS 69 N 0.01 0.63 0.00 1.46 1.57 -1.52 -2.93 116.57 115.79 1bb8 h LYS 69 Ca -0.00 -0.75 0.00 0.00 -1.87 0.00 0.00 60.65 58.02 1bb8 h LYS 69 Cb 0.83 0.23 0.00 0.00 0.08 0.00 0.00 32.23 33.37 1bb8 h LYS 69 CO 0.06 1.33 0.14 -0.25 -0.57 0.00 0.00 179.45 180.16 1bb8 n ASP 70 N -3.81 0.11 -4.58 0.86 8.00 -0.82 -4.20 116.55 112.12 1bb8 n ASP 70 Ca -0.12 0.45 -0.42 0.00 0.71 0.00 0.00 54.79 55.41 1bb8 n ASP 70 Cb 0.93 -0.44 -0.02 0.00 -0.02 0.00 0.00 41.12 41.56 1bb8 n ASP 70 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1bb8 s ILE 71 N -2.93 4.02 0.23 0.53 -1.09 -1.11 -4.56 121.20 116.29 1bb8 s ILE 71 Ca -0.00 0.92 -0.14 0.00 -2.23 0.00 0.00 60.65 59.19 1bb8 s ILE 71 Cb 0.01 -4.72 0.00 0.00 -1.58 0.00 0.00 42.46 36.18 1bb8 s ILE 71 CO 0.04 -1.32 0.49 -1.38 -1.23 0.00 0.00 174.94 171.53 1bb8 s HIS 72 N 4.96 0.21 0.00 3.97 -3.43 -1.26 -5.00 115.29 114.74 1bb8 s HIS 72 Ca 0.43 -0.58 0.00 0.00 -0.80 0.00 0.00 55.06 54.12 1bb8 s HIS 72 Cb -0.07 0.25 0.00 0.00 -1.43 0.00 0.00 32.58 31.33 1bb8 s HIS 72 CO 0.26 -0.97 0.00 -3.47 -2.00 0.00 0.00 174.74 168.56