#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 0.76 0.40 3.49 2.20 -1.26 -5.16 119.74 120.17 1bb8 s LYS 4 Ca 0.00 0.56 -0.14 0.00 -0.36 0.00 0.00 55.97 56.02 1bb8 s LYS 4 Cb 0.00 0.36 -0.08 0.00 -1.51 0.00 0.00 37.83 36.60 1bb8 s LYS 4 CO 0.00 -0.15 0.82 0.50 -0.36 0.00 0.00 175.35 176.16 1bb8 s ARG 5 N -0.23 3.93 0.38 4.03 3.52 -1.26 -5.08 118.95 124.24 1bb8 s ARG 5 Ca -0.04 0.70 0.06 0.00 -0.13 0.00 0.00 55.73 56.31 1bb8 s ARG 5 Cb -0.03 -2.33 -0.02 0.00 -1.56 0.00 0.00 34.95 31.00 1bb8 s ARG 5 CO 0.03 -0.02 0.21 0.54 -0.81 0.00 0.00 175.30 175.26 1bb8 n ARG 6 N -0.99 0.50 0.00 5.12 1.74 -1.26 -4.56 116.66 117.20 1bb8 n ARG 6 Ca 0.04 -3.49 0.00 0.00 -0.77 0.00 0.00 57.85 53.63 1bb8 n ARG 6 Cb 0.54 2.33 0.00 0.00 -1.02 0.00 0.00 32.46 34.31 1bb8 n ARG 6 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1bb8 n ASP 7 N -1.58 -0.41 0.18 0.55 5.75 -0.33 -4.86 116.55 115.86 1bb8 n ASP 7 Ca 0.00 -0.53 0.14 0.00 -0.01 0.00 0.00 54.79 54.39 1bb8 n ASP 7 Cb 0.62 0.00 0.59 0.00 -1.03 0.00 0.00 41.12 41.30 1bb8 n ASP 7 CO 0.00 0.00 0.00 0.78 -0.11 0.00 0.00 177.20 177.87 1bb8 h ASN 8 N -0.41 0.00 0.00 -1.12 2.35 -1.94 -3.37 115.58 111.08 1bb8 h ASN 8 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1bb8 h ASN 8 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1bb8 h ASN 8 CO 0.00 0.00 0.00 0.54 -1.65 0.00 0.00 177.43 176.32 1bb8 n ARG 9 N -2.51 0.00 -0.26 0.81 3.00 -1.26 -5.04 116.66 111.41 1bb8 n ARG 9 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.85 1bb8 n ARG 9 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.68 1bb8 n ARG 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1bb8 n GLY 10 N 2.98 0.52 3.80 -0.13 0.00 -1.26 -5.06 105.19 106.04 1bb8 n GLY 10 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 4.19 0.03 1.61 0.52 -1.26 -4.78 118.95 119.26 1bb8 s ARG 11 Ca 0.00 0.68 -0.30 0.00 -0.52 0.00 0.00 55.73 55.59 1bb8 s ARG 11 Cb 0.00 -3.26 -0.04 0.00 0.52 0.00 0.00 34.95 32.16 1bb8 s ARG 11 CO 0.00 0.57 1.07 0.42 0.02 0.00 0.00 175.30 177.38 1bb8 s ILE 12 N -0.85 4.52 0.19 1.52 -1.09 -1.26 -1.18 121.20 123.04 1bb8 s ILE 12 Ca 0.29 1.82 -0.06 0.00 -2.23 0.00 0.00 60.65 60.46 1bb8 s ILE 12 Cb -0.19 -4.17 -0.06 0.00 -1.58 0.00 0.00 42.46 36.47 1bb8 s ILE 12 CO 0.18 0.15 0.45 -0.76 -1.23 0.00 0.00 174.94 173.73 1bb8 s LEU 13 N 0.97 4.21 0.67 2.97 1.43 -1.26 -4.96 118.68 122.71 1bb8 s LEU 13 Ca 0.54 0.71 -0.04 0.00 -1.03 0.00 0.00 54.13 54.31 1bb8 s LEU 13 Cb -0.24 -3.46 0.06 0.00 0.03 0.00 0.00 46.19 42.58 1bb8 s LEU 13 CO 0.29 -0.02 0.96 -0.54 0.23 0.00 0.00 176.35 177.26 1bb8 s LYS 14 N -2.83 2.19 0.31 1.70 1.02 -1.26 -4.96 119.74 115.92 1bb8 s LYS 14 Ca 0.43 -0.47 -0.29 0.00 0.02 0.00 0.00 55.97 55.66 1bb8 s LYS 14 Cb -0.12 -2.26 -0.12 0.00 -0.52 0.00 0.00 37.83 34.82 1bb8 s LYS 14 CO 0.24 -1.15 1.48 2.41 -0.92 0.00 0.00 175.35 177.41 1bb8 n THR 15 N -2.79 1.43 0.00 2.17 -1.04 -1.26 -1.97 114.28 110.83 1bb8 n THR 15 Ca 0.09 -0.36 0.00 0.00 -2.04 0.00 0.00 64.05 61.74 1bb8 n THR 15 Cb 0.60 -1.81 0.00 0.00 -1.82 0.00 0.00 70.33 67.30 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 1.48 3.11 3.87 3.41 0.00 -1.26 -5.02 105.19 110.77 1bb8 n GLY 16 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.36 3.74 -0.10 1.61 8.01 -0.83 -3.91 118.70 126.86 1bb8 s GLU 17 Ca 0.00 0.70 -0.28 0.00 0.01 0.00 0.00 54.97 55.40 1bb8 s GLU 17 Cb 0.00 -2.19 0.07 0.00 -4.31 0.00 0.00 34.13 27.69 1bb8 s GLU 17 CO 0.00 -0.33 0.65 0.45 0.01 0.00 0.00 175.26 176.04 1bb8 s SER 18 N -3.61 -0.64 -0.14 -0.19 0.15 -0.45 -4.88 113.70 103.94 1bb8 s SER 18 Ca 0.55 0.83 -0.04 0.00 0.70 0.00 0.00 55.95 57.98 1bb8 s SER 18 Cb -0.10 0.73 -0.03 0.00 -1.71 0.00 0.00 66.02 64.90 1bb8 s SER 18 CO 0.41 -0.51 0.01 -1.58 1.20 0.00 0.00 173.24 172.78 1bb8 s GLN 19 N -0.82 3.58 0.68 5.44 0.74 -1.26 -0.91 119.66 127.10 1bb8 s GLN 19 Ca -0.09 -0.42 -0.09 0.00 0.05 0.00 0.00 55.36 54.82 1bb8 s GLN 19 Cb -0.02 -2.99 0.03 0.00 1.10 0.00 0.00 33.01 31.13 1bb8 s GLN 19 CO 0.07 0.40 1.02 1.03 -0.55 0.00 0.00 175.29 177.26 1bb8 s ARG 20 N -0.03 2.69 0.42 1.67 1.81 -0.40 -4.89 118.95 120.22 1bb8 s ARG 20 Ca 0.04 0.15 0.29 0.00 -1.72 0.00 0.00 55.73 54.49 1bb8 s ARG 20 Cb -0.13 -2.12 1.51 0.00 -0.45 0.00 0.00 34.95 33.76 1bb8 s ARG 20 CO 0.02 -1.01 1.88 0.87 -0.68 0.00 0.00 175.30 176.38 1bb8 h LYS 21 N -0.52 0.00 0.00 3.54 6.56 -1.99 0.24 116.57 124.40 1bb8 h LYS 21 Ca -0.45 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.14 1bb8 h LYS 21 Cb 1.27 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.93 1bb8 h LYS 21 CO 0.62 0.00 -0.35 -0.25 -2.06 0.00 0.00 179.45 177.41 1bb8 n ASP 22 N -2.53 0.36 0.00 0.86 8.00 -1.26 -4.94 116.55 117.05 1bb8 n ASP 22 Ca -0.01 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.48 1bb8 n ASP 22 Cb 0.08 0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 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 1.49 2.88 3.62 0.44 0.00 0.84 -5.06 105.19 109.40 1bb8 n GLY 23 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1bb8 n GLY 23 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1bb8 n ARG 24 N -0.15 0.01 -3.33 1.61 1.85 -1.26 -4.51 116.66 110.87 1bb8 n ARG 24 Ca 0.00 0.07 -0.18 0.00 -1.00 0.00 0.00 57.85 56.74 1bb8 n ARG 24 Cb 0.00 -2.28 -0.00 0.00 -1.05 0.00 0.00 32.46 29.13 1bb8 n ARG 24 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1bb8 s TYR 25 N -2.23 3.00 -0.15 2.89 2.02 -0.47 -1.28 117.35 121.12 1bb8 s TYR 25 Ca 0.69 -0.29 -0.16 0.00 -0.37 0.00 0.00 57.07 56.94 1bb8 s TYR 25 Cb -0.28 -2.12 0.04 0.00 -0.40 0.00 0.00 41.96 39.21 1bb8 s TYR 25 CO 0.55 -0.14 0.46 -1.17 -1.57 0.00 0.00 175.55 173.68 1bb8 s LEU 26 N -4.22 0.26 0.04 -1.29 0.20 -0.08 -2.88 118.68 110.70 1bb8 s LEU 26 Ca 0.48 0.84 0.03 0.00 0.69 0.00 0.00 54.13 56.17 1bb8 s LEU 26 Cb -0.09 1.59 -0.02 0.00 -0.43 0.00 0.00 46.19 47.23 1bb8 s LEU 26 CO 0.31 -0.20 -0.08 -0.47 -0.29 0.00 0.00 176.35 175.62 1bb8 s TYR 27 N 0.05 0.73 -0.08 5.38 5.04 -1.04 -1.34 117.35 126.09 1bb8 s TYR 27 Ca -0.02 -0.46 0.02 0.00 -2.44 0.00 0.00 57.07 54.17 1bb8 s TYR 27 Cb -0.03 -0.43 -0.02 0.00 0.35 0.00 0.00 41.96 41.82 1bb8 s TYR 27 CO 0.01 -0.06 -0.15 0.21 -1.34 0.00 0.00 175.55 174.22 1bb8 s LYS 28 N -1.49 2.86 0.13 4.97 2.36 -1.25 -1.00 119.74 126.32 1bb8 s LYS 28 Ca -0.08 -0.72 -0.04 0.00 -2.55 0.00 0.00 55.97 52.59 1bb8 s LYS 28 Cb -0.09 -2.45 -0.03 0.00 -1.05 0.00 0.00 37.83 34.21 1bb8 s LYS 28 CO 0.01 0.43 0.12 1.52 1.55 0.00 0.00 175.35 178.98 1bb8 s TYR 29 N -0.23 0.68 -0.08 4.03 1.13 -1.02 -5.00 117.35 116.85 1bb8 s TYR 29 Ca 0.01 -1.06 -0.01 0.00 -1.41 0.00 0.00 57.07 54.59 1bb8 s TYR 29 Cb -0.13 -0.34 -0.03 0.00 -1.10 0.00 0.00 41.96 40.36 1bb8 s TYR 29 CO 0.03 -0.57 -0.02 0.42 -2.51 0.00 0.00 175.55 172.90 1bb8 s ILE 30 N -4.01 4.13 0.58 -3.49 1.01 -1.26 -1.20 121.20 116.97 1bb8 s ILE 30 Ca 0.20 -0.31 -0.10 0.00 0.00 0.00 0.00 60.65 60.44 1bb8 s ILE 30 Cb 0.06 -2.73 -0.04 0.00 0.01 0.00 0.00 42.46 39.77 1bb8 s ILE 30 CO 0.00 0.60 0.97 -1.81 0.00 0.00 0.00 174.94 174.70 1bb8 s ASP 31 N -0.82 6.24 0.00 3.58 1.01 -0.53 -4.87 116.67 121.29 1bb8 s ASP 31 Ca 0.12 1.30 0.00 0.00 0.71 0.00 0.00 52.55 54.68 1bb8 s ASP 31 Cb -0.11 -2.42 0.00 0.00 1.01 0.00 0.00 42.92 41.40 1bb8 s ASP 31 CO 0.02 -0.80 0.56 -1.20 0.21 0.00 0.00 175.17 173.97 1bb8 n SER 32 N -2.62 0.00 0.02 0.27 7.64 -1.26 0.06 113.62 117.74 1bb8 n SER 32 Ca 0.05 0.10 0.11 0.00 1.01 0.00 0.00 58.87 60.14 1bb8 n SER 32 Cb 0.54 -0.10 -0.02 0.00 -1.01 0.00 0.00 64.21 63.62 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 -1.06 0.25 0.00 1.43 3.72 -1.26 -4.96 117.46 115.58 1bb8 n PHE 33 Ca 0.00 0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.47 1bb8 n PHE 33 Cb 0.01 -0.44 0.00 0.00 -0.94 0.00 0.00 39.48 38.11 1bb8 n PHE 33 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bb8 n GLY 34 N 1.35 0.39 3.81 1.37 0.00 0.11 -5.08 105.19 107.14 1bb8 n GLY 34 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.85 4.33 0.17 1.61 -1.05 -1.26 -4.80 118.70 116.86 1bb8 s GLU 35 Ca 0.00 0.96 -0.26 0.00 -0.15 0.00 0.00 54.97 55.53 1bb8 s GLU 35 Cb 0.00 -2.91 -0.08 0.00 -0.44 0.00 0.00 34.13 30.70 1bb8 s GLU 35 CO 0.00 0.40 0.79 -1.25 0.95 0.00 0.00 175.26 176.15 1bb8 s PRO 36 N -1.90 4.60 0.27 -4.83 0.04 -1.26 -1.45 135.00 130.47 1bb8 s PRO 36 Ca 0.43 1.19 0.02 0.00 0.04 0.00 0.00 61.00 62.68 1bb8 s PRO 36 Cb -0.18 -3.27 -0.04 0.00 0.04 0.00 0.00 34.50 31.06 1bb8 s PRO 36 CO 0.22 0.56 0.15 -0.65 0.04 0.00 0.00 177.00 177.31 1bb8 s GLN 37 N -1.12 1.47 -0.00 4.56 1.11 -0.34 -4.95 119.66 120.39 1bb8 s GLN 37 Ca 0.36 -1.82 0.01 0.00 0.01 0.00 0.00 55.36 53.93 1bb8 s GLN 37 Cb -0.23 -0.02 -0.00 0.00 -1.01 0.00 0.00 33.01 31.75 1bb8 s GLN 37 CO 0.27 -0.42 -0.04 -0.06 0.01 0.00 0.00 175.29 175.05 1bb8 s PHE 38 N -3.76 0.35 0.17 0.91 0.40 -1.26 -2.42 117.98 112.37 1bb8 s PHE 38 Ca 0.37 -0.06 0.08 0.00 -0.60 0.00 0.00 56.93 56.72 1bb8 s PHE 38 Cb 0.06 -0.24 -0.04 0.00 0.51 0.00 0.00 43.02 43.31 1bb8 s PHE 38 CO 0.16 -0.01 -0.05 0.14 0.70 0.00 0.00 175.22 176.16 1bb8 s VAL 39 N -0.04 3.47 0.11 -0.44 -7.23 -0.17 -4.97 120.40 111.13 1bb8 s VAL 39 Ca 0.01 -1.52 0.08 0.00 -1.81 0.00 0.00 61.98 58.74 1bb8 s VAL 39 Cb -0.02 -2.73 -0.04 0.00 0.56 0.00 0.00 36.38 34.16 1bb8 s VAL 39 CO -0.00 -0.10 -0.19 -0.31 -0.31 0.00 0.00 175.10 174.19 1bb8 s TYR 40 N -1.69 1.69 -0.28 2.82 1.51 -1.26 -2.49 117.35 117.65 1bb8 s TYR 40 Ca 0.26 -0.44 -0.22 0.00 -1.01 0.00 0.00 57.07 55.66 1bb8 s TYR 40 Cb -0.09 -0.91 0.13 0.00 -0.11 0.00 0.00 41.96 40.98 1bb8 s TYR 40 CO 0.17 0.21 1.01 0.45 -1.11 0.00 0.00 175.55 176.27 1bb8 s SER 41 N -2.07 -0.48 -0.03 2.29 0.15 -1.14 -4.98 113.70 107.44 1bb8 s SER 41 Ca 0.07 0.87 0.08 0.00 0.70 0.00 0.00 55.95 57.67 1bb8 s SER 41 Cb -0.09 0.99 0.27 0.00 -1.71 0.00 0.00 66.02 65.48 1bb8 s SER 41 CO 0.04 -0.15 1.14 0.79 1.20 0.00 0.00 173.24 176.27 1bb8 n TRP 42 N 2.74 0.50 -4.45 3.44 7.02 -1.26 -1.37 117.44 124.06 1bb8 n TRP 42 Ca -0.15 -0.21 -0.22 0.00 -1.02 0.00 0.00 57.50 55.90 1bb8 n TRP 42 Cb 0.56 -0.08 -0.16 0.00 -2.42 0.00 0.00 31.31 29.22 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 -1.64 1.22 -0.14 -0.99 1.02 -1.26 -4.71 119.74 113.25 1bb8 s LYS 43 Ca 0.20 -0.33 -0.13 0.00 0.02 0.00 0.00 55.97 55.73 1bb8 s LYS 43 Cb 0.12 -1.09 -0.25 0.00 -0.52 0.00 0.00 37.83 36.09 1bb8 s LYS 43 CO 0.11 0.07 0.37 1.25 -0.92 0.00 0.00 175.35 176.23 1bb8 h LEU 44 N 6.65 0.30-10.18 3.17 5.85 -1.96 -3.15 115.31 116.00 1bb8 h LEU 44 Ca -0.33 -0.81 -0.58 0.00 0.84 0.00 0.00 57.88 56.99 1bb8 h LEU 44 Cb 1.17 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 42.04 1bb8 h LEU 44 CO 0.48 1.72 -0.38 -0.69 -0.34 0.00 0.00 178.44 179.22 1bb8 s VAL 45 N -2.49 1.88 -0.53 1.05 1.01 -1.26 -3.53 120.40 116.53 1bb8 s VAL 45 Ca -0.24 -1.58 0.24 0.00 0.00 0.00 0.00 61.98 60.40 1bb8 s VAL 45 Cb 0.06 -2.46 0.31 0.00 0.00 0.00 0.00 36.38 34.29 1bb8 s VAL 45 CO 0.72 0.00 1.64 0.00 0.00 0.00 0.00 175.10 177.46 1bb8 h ALA 46 N 1.02 0.98 -0.38 5.51 0.00 -1.95 -3.23 119.26 121.21 1bb8 h ALA 46 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1bb8 h ALA 46 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1bb8 h ALA 46 CO 0.62 0.00 0.00 0.25 0.00 0.00 0.00 179.25 180.12 1bb8 n THR 47 N -2.81 0.50 -1.01 0.00 -2.24 -1.26 -4.94 114.28 102.52 1bb8 n THR 47 Ca 0.04 -0.59 -0.30 0.00 -2.27 0.00 0.00 64.05 60.94 1bb8 n THR 47 Cb 0.50 0.48 0.25 0.00 -2.10 0.00 0.00 70.33 69.46 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 0.88 -2.17 -3.63 3.42 8.00 -1.22 -5.06 116.55 116.77 1bb8 n ASP 48 Ca 0.17 -1.15 -0.20 0.00 0.71 0.00 0.00 54.79 54.32 1bb8 n ASP 48 Cb 0.43 -0.99 -0.16 0.00 -0.02 0.00 0.00 41.12 40.38 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 -5.44 0.03 0.32 -1.24 3.00 -1.26 -5.07 118.95 109.29 1bb8 s ARG 49 Ca 0.70 0.35 -0.16 0.00 -1.00 0.00 0.00 55.73 55.62 1bb8 s ARG 49 Cb -0.07 -0.75 -0.09 0.00 0.00 0.00 0.00 34.95 34.04 1bb8 s ARG 49 CO 0.54 -0.43 0.75 0.14 0.00 0.00 0.00 175.30 176.30 1bb8 s VAL 50 N 2.24 4.65 0.18 7.11 -7.23 -1.26 -5.00 120.40 121.09 1bb8 s VAL 50 Ca 0.04 1.01 -0.33 0.00 -1.81 0.00 0.00 61.98 60.89 1bb8 s VAL 50 Cb -0.13 -3.63 -0.15 0.00 0.56 0.00 0.00 36.38 33.02 1bb8 s VAL 50 CO -0.06 -0.15 1.21 -2.65 -0.31 0.00 0.00 175.10 173.13 1bb8 n PRO 51 N -0.28 1.32 0.11 4.82 -0.02 -1.26 -4.75 135.00 134.95 1bb8 n PRO 51 Ca 0.03 0.47 0.19 0.00 -2.02 0.00 0.00 63.50 62.17 1bb8 n PRO 51 Cb 0.53 -2.00 0.61 0.00 -0.02 0.00 0.00 33.50 32.61 1bb8 n PRO 51 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bb8 h ALA 52 N 3.55 2.11 0.00 3.55 0.00 -2.00 2.09 119.26 128.56 1bb8 h ALA 52 Ca -0.44 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 1bb8 h ALA 52 Cb 1.33 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1bb8 h ALA 52 CO 0.71 -0.87 -0.20 0.78 0.00 0.00 0.00 179.25 179.67 1bb8 h GLY 53 N 0.00 0.00 -5.83 0.00 0.00 -2.04 -3.41 103.07 91.79 1bb8 h GLY 53 Ca 0.19 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.88 1bb8 h GLY 53 CO -0.00 0.00 -0.56 0.54 0.00 0.00 0.00 176.54 176.51 1bb8 s LYS 54 N -4.02 3.66 0.49 4.80 -0.14 0.71 -5.09 119.74 120.15 1bb8 s LYS 54 Ca -0.02 -0.32 -0.18 0.00 -1.36 0.00 0.00 55.97 54.08 1bb8 s LYS 54 Cb 0.12 -3.11 -0.09 0.00 -1.68 0.00 0.00 37.83 33.08 1bb8 s LYS 54 CO 0.62 0.46 0.99 1.03 -0.76 0.00 0.00 175.35 177.69 1bb8 s ARG 55 N -0.16 3.96 0.75 1.68 0.52 -1.26 -4.55 118.95 119.89 1bb8 s ARG 55 Ca 0.07 1.07 -0.17 0.00 -0.52 0.00 0.00 55.73 56.18 1bb8 s ARG 55 Cb -0.12 -2.14 -0.11 0.00 0.52 0.00 0.00 34.95 33.10 1bb8 s ARG 55 CO 0.01 -0.26 -0.13 -3.47 0.02 0.00 0.00 175.30 171.47 1bb8 n ASP 56 N -1.27 -3.66 -3.97 0.23 2.03 -1.26 -4.99 116.55 103.66 1bb8 n ASP 56 Ca 0.07 0.47 -0.10 0.00 0.52 0.00 0.00 54.79 55.75 1bb8 n ASP 56 Cb 0.54 -0.94 -0.06 0.00 -0.72 0.00 0.00 41.12 39.93 1bb8 n ASP 56 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bb8 s ILE 58 N -3.99 5.03 1.13 0.00 1.01 -1.26 -4.95 121.20 118.17 1bb8 s ILE 58 Ca 0.20 1.40 -0.13 0.00 0.00 0.00 0.00 60.65 62.12 1bb8 s ILE 58 Cb 0.01 -4.03 0.24 0.00 0.01 0.00 0.00 42.46 38.70 1bb8 s ILE 58 CO 0.04 0.20 0.88 -1.54 0.00 0.00 0.00 174.94 174.53 1bb8 n SER 59 N 4.16 -1.57 0.06 3.58 3.41 -1.26 -4.69 113.62 117.31 1bb8 n SER 59 Ca -0.01 -0.07 -0.13 0.00 -0.26 0.00 0.00 58.87 58.41 1bb8 n SER 59 Cb 0.51 -1.25 -0.09 0.00 -0.26 0.00 0.00 64.21 63.12 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 -2.48 -0.13 -0.78 1.04 3.38 -1.59 -0.69 115.31 114.06 1bb8 h LEU 60 Ca -0.58 -0.31 0.18 0.00 0.09 0.00 0.00 57.88 57.26 1bb8 h LEU 60 Cb 1.33 0.03 -0.13 0.00 0.09 0.00 0.00 40.66 41.98 1bb8 h LEU 60 CO 0.46 0.26 0.11 0.03 0.09 0.00 0.00 178.44 179.38 1bb8 h ARG 61 N -0.55 0.17 -0.35 1.13 2.47 -1.90 0.53 114.38 115.88 1bb8 h ARG 61 Ca -0.02 -0.01 -0.17 0.00 -1.26 0.00 0.00 59.98 58.53 1bb8 h ARG 61 Cb 0.44 -0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 28.71 1bb8 h ARG 61 CO 0.03 0.11 -0.44 0.93 0.56 0.00 0.00 179.97 181.16 1bb8 h GLU 62 N 0.17 0.90 -0.16 0.04 4.39 -1.88 -3.12 114.58 114.92 1bb8 h GLU 62 Ca 0.44 -0.50 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 1bb8 h GLU 62 Cb 0.81 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.48 1bb8 h GLU 62 CO -0.62 1.15 0.01 0.87 -1.16 0.00 0.00 179.01 179.26 1bb8 h LYS 63 N 0.72 0.27 -0.45 2.33 1.57 0.85 -2.20 116.57 119.66 1bb8 h LYS 63 Ca 0.05 -0.08 0.07 0.00 -1.87 0.00 0.00 60.65 58.82 1bb8 h LYS 63 Cb 1.03 -0.03 -0.09 0.00 0.08 0.00 0.00 32.23 33.22 1bb8 h LYS 63 CO 0.10 0.49 -0.43 0.82 -0.57 0.00 0.00 179.45 179.86 1bb8 h ILE 64 N 0.03 0.11 -0.62 1.86 5.03 -0.09 0.98 117.51 124.79 1bb8 h ILE 64 Ca 0.05 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.79 1bb8 h ILE 64 Cb 0.36 0.11 -0.03 0.00 -3.03 0.00 0.00 36.82 34.23 1bb8 h ILE 64 CO 0.01 0.00 0.41 0.00 -0.68 0.00 0.00 178.15 177.88 1bb8 h ALA 65 N 0.48 1.54 0.05 1.87 0.00 -1.52 -2.74 119.26 118.96 1bb8 h ALA 65 Ca 0.15 -0.05 -0.25 0.00 0.00 0.00 0.00 54.91 54.76 1bb8 h ALA 65 Cb 0.58 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.12 1bb8 h ALA 65 CO -0.61 0.42 -1.06 0.93 0.00 0.00 0.00 179.25 178.93 1bb8 h GLU 66 N 0.85 0.39 -0.44 0.00 5.08 0.02 -2.28 114.58 118.20 1bb8 h GLU 66 Ca 0.23 -0.49 -0.11 0.00 -1.00 0.00 0.00 59.36 57.98 1bb8 h GLU 66 Cb -0.09 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1bb8 h GLU 66 CO -0.05 1.17 -0.15 -0.07 -1.00 0.00 0.00 179.01 178.91 1bb8 h LEU 67 N 0.19 0.90 -0.19 1.33 -0.00 0.11 0.85 115.31 118.49 1bb8 h LEU 67 Ca -0.11 -0.38 -0.21 0.00 -0.00 0.00 0.00 57.88 57.18 1bb8 h LEU 67 Cb 1.73 -0.25 -0.01 0.00 -0.00 0.00 0.00 40.66 42.13 1bb8 h LEU 67 CO 0.18 1.07 -0.94 1.56 -0.00 0.00 0.00 178.44 180.31 1bb8 h GLN 68 N 0.71 0.20 0.17 1.13 4.20 -1.59 -3.19 115.11 116.74 1bb8 h GLN 68 Ca 0.11 -0.24 -0.36 0.00 0.06 0.00 0.00 58.65 58.22 1bb8 h GLN 68 Cb 0.70 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.56 1bb8 h GLN 68 CO 0.05 1.00 -1.83 -0.22 -0.67 0.00 0.00 178.83 177.16 1bb8 h LYS 69 N 0.10 0.35 0.00 1.46 3.64 -1.32 -3.37 116.57 117.43 1bb8 h LYS 69 Ca -0.06 -0.60 0.00 0.00 -1.27 0.00 0.00 60.65 58.73 1bb8 h LYS 69 Cb 1.60 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 33.64 1bb8 h LYS 69 CO 0.14 1.28 0.00 0.22 -2.27 0.00 0.00 179.45 178.82 1bb8 h ASP 70 N 0.10 0.00 0.52 4.20 3.58 0.60 1.31 116.42 126.72 1bb8 h ASP 70 Ca -0.37 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.08 1bb8 h ASP 70 Cb 2.08 0.00 0.00 0.00 1.72 0.00 0.00 39.33 43.13 1bb8 h ASP 70 CO 0.15 0.00 -0.25 -0.38 -2.88 0.00 0.00 179.24 175.88 1bb8 n ILE 71 N -2.65 0.00 0.00 2.25 2.08 -1.20 -4.53 119.36 115.31 1bb8 n ILE 71 Ca 0.03 -0.04 0.00 0.00 0.56 0.00 0.00 62.75 63.30 1bb8 n ILE 71 Cb 0.35 0.02 0.00 0.00 -0.75 0.00 0.00 39.64 39.27 1bb8 n ILE 71 CO 0.00 0.00 0.00 1.57 0.56 0.00 0.00 176.55 178.68 1bb8 n HIS 72 N -1.21 0.00 -0.34 1.39 -0.00 -1.14 -4.79 115.22 109.14 1bb8 n HIS 72 Ca 0.09 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.27 1bb8 n HIS 72 Cb 0.32 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.19 1bb8 n HIS 72 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33