#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hb5 n GLY 8 N 0.00 -1.63 0.21 0.00 0.00 -1.26 -4.31 105.19 98.21 2hb5 n GLY 8 Ca 0.00 -1.80 0.01 0.00 0.00 0.00 0.00 46.02 44.24 2hb5 n GLY 8 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2hb5 h THR 9 N 0.00 1.24 -3.22 2.61 1.35 -1.79 -3.37 112.91 109.72 2hb5 h THR 9 Ca 0.00 -1.12 -0.73 0.00 -0.55 0.00 0.00 66.41 64.01 2hb5 h THR 9 Cb 0.00 1.47 -0.22 0.00 -1.73 0.00 0.00 68.15 67.67 2hb5 h THR 9 CO 0.00 0.33 -0.19 -0.60 -0.25 0.00 0.00 175.52 174.81 2hb5 s ARG 10 N -4.42 3.02 0.36 4.72 3.52 -1.26 -4.98 118.95 119.91 2hb5 s ARG 10 Ca -0.04 -1.31 0.14 0.00 -0.13 0.00 0.00 55.73 54.39 2hb5 s ARG 10 Cb 0.15 -4.16 1.01 0.00 -1.56 0.00 0.00 34.95 30.39 2hb5 s ARG 10 CO 0.74 -1.16 1.73 -1.35 -0.81 0.00 0.00 175.30 174.45 2hb5 h PRO 11 N 8.86 0.45 -0.11 5.12 0.11 -1.83 -2.24 132.00 142.37 2hb5 h PRO 11 Ca -0.29 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2hb5 h PRO 11 Cb 1.10 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2hb5 h PRO 11 CO 0.94 0.30 0.00 -0.40 -0.21 0.00 0.00 178.00 178.63 2hb5 n ASP 12 N -4.80 1.54 -4.68 -2.05 5.68 -1.26 -2.85 116.55 108.13 2hb5 n ASP 12 Ca 0.27 -1.61 -0.42 0.00 -0.50 0.00 0.00 54.79 52.53 2hb5 n ASP 12 Cb 0.85 -0.06 -0.03 0.00 -1.14 0.00 0.00 41.12 40.74 2hb5 n ASP 12 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 2hb5 s LEU 13 N -1.73 4.40 0.31 -2.12 2.96 -0.84 -4.81 118.68 116.85 2hb5 s LEU 13 Ca 0.34 2.66 0.08 0.00 -0.22 0.00 0.00 54.13 56.99 2hb5 s LEU 13 Cb 0.19 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.29 2hb5 s LEU 13 CO 0.29 -1.00 0.13 0.42 -1.32 0.00 0.00 176.35 174.87 2hb5 s THR 14 N 3.42 3.39 -1.04 3.68 -4.23 -1.11 -4.06 115.64 115.69 2hb5 s THR 14 Ca 0.82 -1.66 0.11 0.00 -1.18 0.00 0.00 61.69 59.78 2hb5 s THR 14 Cb -0.43 -3.03 0.01 0.00 1.34 0.00 0.00 72.50 70.38 2hb5 s THR 14 CO 0.37 -0.25 0.69 -0.90 -0.54 0.00 0.00 174.62 173.99 2hb5 n ASP 15 N -1.12 1.35 -4.63 3.99 5.75 -1.26 -1.99 116.55 118.64 2hb5 n ASP 15 Ca -0.04 -1.18 -0.34 0.00 -0.01 0.00 0.00 54.79 53.22 2hb5 n ASP 15 Cb 0.60 0.41 -0.10 0.00 -1.03 0.00 0.00 41.12 41.00 2hb5 n ASP 15 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2hb5 s GLN 16 N -1.37 2.80 0.25 0.11 -0.21 -1.26 -4.53 119.66 115.45 2hb5 s GLN 16 Ca 0.09 -0.53 -0.30 0.00 0.02 0.00 0.00 55.36 54.64 2hb5 s GLN 16 Cb 0.09 -2.65 -0.14 0.00 1.00 0.00 0.00 33.01 31.31 2hb5 s GLN 16 CO 0.26 0.67 1.28 -0.35 -2.12 0.00 0.00 175.29 175.02 2hb5 n PRO 17 N 2.03 1.79 -2.37 2.91 -0.04 -1.26 -4.85 135.00 133.21 2hb5 n PRO 17 Ca -0.17 0.63 -0.41 0.00 -0.04 0.00 0.00 63.50 63.51 2hb5 n PRO 17 Cb 0.53 -2.20 -0.04 0.00 -0.04 0.00 0.00 33.50 31.75 2hb5 n PRO 17 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2hb5 s LEU 18 N 0.05 4.50 0.29 1.53 1.43 -1.26 -4.92 118.68 120.30 2hb5 s LEU 18 Ca 0.65 2.37 0.25 0.00 -1.03 0.00 0.00 54.13 56.37 2hb5 s LEU 18 Cb -0.68 -3.63 0.99 0.00 0.03 0.00 0.00 46.19 42.91 2hb5 s LEU 18 CO 0.54 -0.28 1.75 -0.65 0.23 0.00 0.00 176.35 177.94 2hb5 h PRO 19 N 3.99 0.00 -1.70 1.29 0.11 -2.03 -3.33 132.00 130.32 2hb5 h PRO 19 Ca -0.47 0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.17 2hb5 h PRO 19 Cb 1.22 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 31.92 2hb5 h PRO 19 CO 0.68 0.00 -1.06 -0.40 -0.21 0.00 0.00 178.00 177.01 2hb5 n ASP 20 N -2.37 1.98 -4.81 -2.05 5.75 -1.26 -5.11 116.55 108.69 2hb5 n ASP 20 Ca 0.02 -3.10 -0.35 0.00 -0.01 0.00 0.00 54.79 51.36 2hb5 n ASP 20 Cb 0.28 -0.57 -0.07 0.00 -1.03 0.00 0.00 41.12 39.73 2hb5 n ASP 20 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2hb5 s ALA 21 N -2.91 3.19 0.04 2.12 0.00 -1.25 -4.91 121.76 118.04 2hb5 s ALA 21 Ca 0.38 0.37 0.10 0.00 0.00 0.00 0.00 51.96 52.81 2hb5 s ALA 21 Cb 0.38 -3.07 -0.16 0.00 0.00 0.00 0.00 23.12 20.27 2hb5 s ALA 21 CO -0.07 0.20 1.23 -0.44 0.00 0.00 0.00 175.76 176.68 2hb5 h ASP 22 N 2.62 0.00 -3.88 0.00 3.32 -0.92 -3.46 116.42 114.10 2hb5 h ASP 22 Ca -0.48 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.30 2hb5 h ASP 22 Cb 1.19 0.00 -0.28 0.00 0.22 0.00 0.00 39.33 40.46 2hb5 h ASP 22 CO 0.64 0.89 -0.74 -1.00 -1.72 0.00 0.00 179.24 177.30 2hb5 s HIS 23 N -2.76 0.26 -0.32 4.55 3.76 -0.93 -5.01 115.29 114.84 2hb5 s HIS 23 Ca 0.01 -0.07 0.02 0.00 -0.15 0.00 0.00 55.06 54.86 2hb5 s HIS 23 Cb 0.09 -0.17 0.10 0.00 1.11 0.00 0.00 32.58 33.71 2hb5 s HIS 23 CO 0.81 -0.01 0.07 0.99 -0.85 0.00 0.00 174.74 175.74 2hb5 s THR 24 N -0.14 1.57 0.27 1.30 2.01 -1.26 -1.42 115.64 117.96 2hb5 s THR 24 Ca 0.00 -1.83 0.11 0.00 0.31 0.00 0.00 61.69 60.28 2hb5 s THR 24 Cb -0.02 -2.15 -0.05 0.00 0.01 0.00 0.00 72.50 70.30 2hb5 s THR 24 CO -0.00 -0.60 -0.10 0.26 -0.69 0.00 0.00 174.62 173.48 2hb5 s TRP 25 N 1.27 2.50 -0.04 4.92 0.51 -0.46 -4.50 118.94 123.14 2hb5 s TRP 25 Ca 0.09 -0.27 0.05 0.00 -2.12 0.00 0.00 56.10 53.84 2hb5 s TRP 25 Cb -0.18 -1.10 -0.01 0.00 -0.81 0.00 0.00 33.47 31.38 2hb5 s TRP 25 CO -0.16 0.67 -0.17 0.71 -0.51 0.00 0.00 176.95 177.48 2hb5 s TYR 26 N -2.40 1.69 0.15 -1.98 1.51 0.58 -0.84 117.35 116.05 2hb5 s TYR 26 Ca 0.31 -0.45 0.09 0.00 -1.01 0.00 0.00 57.07 56.01 2hb5 s TYR 26 Cb -0.06 -1.13 -0.04 0.00 -0.11 0.00 0.00 41.96 40.63 2hb5 s TYR 26 CO 0.17 -0.13 -0.20 0.95 -1.11 0.00 0.00 175.55 175.23 2hb5 s THR 27 N -0.07 1.85 -0.11 -0.71 -4.23 -0.53 -0.73 115.64 111.10 2hb5 s THR 27 Ca -0.01 -1.83 -0.29 0.00 -1.18 0.00 0.00 61.69 58.38 2hb5 s THR 27 Cb -0.10 -1.80 0.07 0.00 1.34 0.00 0.00 72.50 72.01 2hb5 s THR 27 CO 0.01 -0.22 0.69 -0.62 -0.54 0.00 0.00 174.62 173.94 2hb5 s ASP 28 N -2.45 -0.68 -0.02 3.99 -1.08 -0.92 -4.43 116.67 111.08 2hb5 s ASP 28 Ca 0.14 0.91 0.06 0.00 -0.52 0.00 0.00 52.55 53.14 2hb5 s ASP 28 Cb -0.07 0.79 -0.01 0.00 -1.46 0.00 0.00 42.92 42.17 2hb5 s ASP 28 CO 0.06 -0.51 -0.20 -0.83 0.52 0.00 0.00 175.17 174.21 2hb5 s GLY 29 N -0.76 1.00 0.04 2.66 0.00 -1.26 -1.51 107.32 107.49 2hb5 s GLY 29 Ca -0.08 -0.87 0.05 0.00 0.00 0.00 0.00 44.72 43.82 2hb5 s GLY 29 CO 0.07 -0.69 -0.14 -0.45 0.00 0.00 0.00 173.10 171.90 2hb5 s SER 30 N -0.41 1.65 -0.22 1.64 0.15 0.01 -4.61 113.70 111.91 2hb5 s SER 30 Ca 0.06 -0.46 -0.03 0.00 0.70 0.00 0.00 55.95 56.22 2hb5 s SER 30 Cb -0.09 -0.10 0.10 0.00 -1.71 0.00 0.00 66.02 64.22 2hb5 s SER 30 CO -0.00 0.03 0.23 -0.55 1.20 0.00 0.00 173.24 174.15 2hb5 s SER 31 N -1.14 1.45 0.09 5.45 0.15 -1.26 -1.24 113.70 117.21 2hb5 s SER 31 Ca 0.01 -0.31 0.10 0.00 0.70 0.00 0.00 55.95 56.45 2hb5 s SER 31 Cb -0.08 0.40 -0.04 0.00 -1.71 0.00 0.00 66.02 64.59 2hb5 s SER 31 CO 0.01 -0.34 -0.25 -0.76 1.20 0.00 0.00 173.24 173.11 2hb5 s LEU 32 N 2.33 2.36 -0.44 3.45 1.43 0.18 -4.80 118.68 123.20 2hb5 s LEU 32 Ca 0.08 -0.64 -0.18 0.00 -1.03 0.00 0.00 54.13 52.35 2hb5 s LEU 32 Cb -0.16 -1.32 0.03 0.00 0.03 0.00 0.00 46.19 44.77 2hb5 s LEU 32 CO -0.16 0.21 0.52 -0.22 0.23 0.00 0.00 176.35 176.93 2hb5 s LEU 33 N -1.75 4.79 -0.44 1.79 2.96 -1.26 -1.21 118.68 123.56 2hb5 s LEU 33 Ca 0.14 -0.63 -0.07 0.00 -0.22 0.00 0.00 54.13 53.35 2hb5 s LEU 33 Cb -0.10 -2.49 0.11 0.00 0.50 0.00 0.00 46.19 44.21 2hb5 s LEU 33 CO 0.05 -0.68 0.29 -1.58 -1.32 0.00 0.00 176.35 173.11 2hb5 s GLN 34 N 2.38 2.34 -1.29 1.98 0.74 0.19 -4.65 119.66 121.35 2hb5 s GLN 34 Ca 0.15 -1.75 -0.03 0.00 0.05 0.00 0.00 55.36 53.78 2hb5 s GLN 34 Cb -0.17 -3.80 -0.00 0.00 1.10 0.00 0.00 33.01 30.14 2hb5 s GLN 34 CO 0.15 -1.13 0.66 0.39 -0.55 0.00 0.00 175.29 174.81 2hb5 n GLU 35 N 4.81 -3.95 -0.50 1.67 1.02 -1.26 -1.66 120.64 120.76 2hb5 n GLU 35 Ca -0.06 0.56 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 2hb5 n GLU 35 Cb 0.41 -4.92 0.00 0.00 -0.02 0.00 0.00 31.44 26.91 2hb5 n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2hb5 n GLY 36 N -1.66 1.83 3.61 0.62 0.00 -1.26 -5.00 105.19 103.32 2hb5 n GLY 36 Ca -0.27 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 2hb5 n GLY 36 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2hb5 s GLN 37 N -0.04 3.93 -0.47 1.61 0.74 -0.67 -5.07 119.66 119.70 2hb5 s GLN 37 Ca 0.00 -0.37 -0.27 0.00 0.05 0.00 0.00 55.36 54.77 2hb5 s GLN 37 Cb 0.00 -3.19 0.03 0.00 1.10 0.00 0.00 33.01 30.95 2hb5 s GLN 37 CO 0.00 0.25 1.03 0.50 -0.55 0.00 0.00 175.29 176.52 2hb5 s ARG 38 N 0.42 3.62 0.00 1.67 6.06 -1.26 -0.63 118.95 128.84 2hb5 s ARG 38 Ca 0.02 0.36 0.03 0.00 -2.50 0.00 0.00 55.73 53.65 2hb5 s ARG 38 Cb -0.13 -3.92 -0.03 0.00 0.06 0.00 0.00 34.95 30.93 2hb5 s ARG 38 CO 0.01 -1.31 -0.08 0.15 -2.50 0.00 0.00 175.30 171.57 2hb5 s LYS 39 N 4.12 2.51 0.04 5.12 1.02 -0.35 -3.13 119.74 129.08 2hb5 s LYS 39 Ca 0.42 -0.74 -0.03 0.00 0.02 0.00 0.00 55.97 55.65 2hb5 s LYS 39 Cb -0.09 -2.47 -0.02 0.00 -0.52 0.00 0.00 37.83 34.73 2hb5 s LYS 39 CO 0.29 0.60 0.04 0.00 -0.92 0.00 0.00 175.35 175.36 2hb5 s ALA 40 N -0.98 0.15 0.24 5.17 0.00 -1.26 -0.64 121.76 124.44 2hb5 s ALA 40 Ca 0.17 -0.78 -0.19 0.00 0.00 0.00 0.00 51.96 51.15 2hb5 s ALA 40 Cb -0.11 0.25 0.03 0.00 0.00 0.00 0.00 23.12 23.28 2hb5 s ALA 40 CO 0.07 -0.31 0.62 0.20 0.00 0.00 0.00 175.76 176.33 2hb5 s GLY 41 N -2.30 -0.07 0.00 0.00 0.00 -0.37 -0.94 107.32 103.65 2hb5 s GLY 41 Ca -0.03 -0.26 -0.11 0.00 0.00 0.00 0.00 44.72 44.33 2hb5 s GLY 41 CO -0.06 -0.18 0.21 0.00 0.00 0.00 0.00 173.10 173.08 2hb5 s ALA 42 N -3.90 -0.51 0.05 3.20 0.00 -0.68 -0.81 121.76 119.11 2hb5 s ALA 42 Ca 0.11 0.02 -0.19 0.00 0.00 0.00 0.00 51.96 51.89 2hb5 s ALA 42 Cb -0.03 0.13 0.04 0.00 0.00 0.00 0.00 23.12 23.26 2hb5 s ALA 42 CO 0.02 -0.25 0.44 0.00 0.00 0.00 0.00 175.76 175.97 2hb5 s ALA 43 N -1.56 -1.09 -0.06 0.00 0.00 -0.57 -1.87 121.76 116.62 2hb5 s ALA 43 Ca -0.13 0.37 0.02 0.00 0.00 0.00 0.00 51.96 52.22 2hb5 s ALA 43 Cb -0.06 0.38 0.02 0.00 0.00 0.00 0.00 23.12 23.46 2hb5 s ALA 43 CO 0.02 -0.48 -0.09 0.08 0.00 0.00 0.00 175.76 175.29 2hb5 s VAL 44 N -2.54 0.87 0.16 0.00 1.01 -0.16 -2.15 120.40 117.59 2hb5 s VAL 44 Ca -0.05 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 61.60 2hb5 s VAL 44 Cb -0.01 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 2hb5 s VAL 44 CO -0.03 0.30 0.12 0.42 0.00 0.00 0.00 175.10 175.91 2hb5 s THR 45 N 0.83 0.06 0.00 3.92 -4.23 0.09 -1.85 115.64 114.46 2hb5 s THR 45 Ca -0.12 -1.87 0.00 0.00 -1.18 0.00 0.00 61.69 58.52 2hb5 s THR 45 Cb -0.15 -2.18 0.00 0.00 1.34 0.00 0.00 72.50 71.51 2hb5 s THR 45 CO 0.02 -0.28 0.00 0.35 -0.54 0.00 0.00 174.62 174.17 2hb5 n THR 46 N -0.17 0.00 -0.02 3.99 -2.24 0.22 -0.31 114.28 115.75 2hb5 n THR 46 Ca -0.03 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.87 2hb5 n THR 46 Cb 0.64 -1.15 0.53 0.00 -2.10 0.00 0.00 70.33 68.26 2hb5 n THR 46 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2hb5 h GLU 47 N 0.00 0.32 0.00 -0.78 4.81 -1.91 -3.33 114.58 113.68 2hb5 h GLU 47 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2hb5 h GLU 47 Cb 0.00 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.31 2hb5 h GLU 47 CO 0.00 0.21 0.00 0.25 -0.73 0.00 0.00 179.01 178.74 2hb5 n THR 48 N -4.47 0.00 -4.74 0.32 -2.24 -1.26 -4.02 114.28 97.87 2hb5 n THR 48 Ca 0.07 -0.14 -0.24 0.00 -2.27 0.00 0.00 64.05 61.47 2hb5 n THR 48 Cb 0.33 1.39 -0.15 0.00 -2.10 0.00 0.00 70.33 69.79 2hb5 n THR 48 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2hb5 s GLU 49 N -0.13 1.29 -0.13 -0.78 2.12 -1.25 -5.12 118.70 114.71 2hb5 s GLU 49 Ca 0.00 -0.59 -0.26 0.00 0.36 0.00 0.00 54.97 54.48 2hb5 s GLU 49 Cb 0.00 -1.26 -0.02 0.00 0.26 0.00 0.00 34.13 33.11 2hb5 s GLU 49 CO 0.00 0.34 0.83 0.08 -0.54 0.00 0.00 175.26 175.98 2hb5 s VAL 50 N -0.41 4.90 -0.66 3.70 1.01 -1.26 -0.61 120.40 127.08 2hb5 s VAL 50 Ca 0.06 1.66 0.10 0.00 0.00 0.00 0.00 61.98 63.81 2hb5 s VAL 50 Cb -0.06 -4.15 -0.07 0.00 0.00 0.00 0.00 36.38 32.10 2hb5 s VAL 50 CO -0.00 0.08 0.51 2.30 0.00 0.00 0.00 175.10 177.99 2hb5 n ILE 51 N 4.47 0.00 -3.64 2.22 -5.35 -0.77 -4.98 119.36 111.30 2hb5 n ILE 51 Ca 0.04 -0.31 -0.04 0.00 -0.27 0.00 0.00 62.75 62.17 2hb5 n ILE 51 Cb 0.49 1.05 -0.07 0.00 -1.74 0.00 0.00 39.64 39.37 2hb5 n ILE 51 CO 0.00 0.00 0.00 0.86 -1.76 0.00 0.00 176.55 175.65 2hb5 s TRP 52 N -1.77 -0.61 -0.26 4.28 -0.00 -1.09 -4.99 118.94 114.49 2hb5 s TRP 52 Ca 0.06 1.26 -0.25 0.00 -0.00 0.00 0.00 56.10 57.16 2hb5 s TRP 52 Cb 0.08 0.38 0.09 0.00 -0.00 0.00 0.00 33.47 34.02 2hb5 s TRP 52 CO 0.37 -0.30 0.85 0.00 -0.00 0.00 0.00 176.95 177.86 2hb5 s ALA 53 N 1.19 -1.86 0.05 5.86 0.00 -1.26 -0.98 121.76 124.76 2hb5 s ALA 53 Ca -0.07 1.92 -0.27 0.00 0.00 0.00 0.00 51.96 53.54 2hb5 s ALA 53 Cb -0.04 -1.21 0.08 0.00 0.00 0.00 0.00 23.12 21.95 2hb5 s ALA 53 CO -0.14 -0.30 0.71 -1.59 0.00 0.00 0.00 175.76 174.44 2hb5 s LYS 54 N 0.20 1.08 0.31 0.00 -2.85 -0.78 -5.02 119.74 112.69 2hb5 s LYS 54 Ca 0.01 -0.22 -0.22 0.00 -1.00 0.00 0.00 55.97 54.54 2hb5 s LYS 54 Cb -0.05 0.50 -0.10 0.00 -2.06 0.00 0.00 37.83 36.13 2hb5 s LYS 54 CO -0.01 -0.44 0.87 0.00 0.10 0.00 0.00 175.35 175.87 2hb5 s ALA 55 N -2.81 3.24 0.26 0.59 0.00 -1.26 -1.68 121.76 120.10 2hb5 s ALA 55 Ca -0.01 0.36 0.09 0.00 0.00 0.00 0.00 51.96 52.39 2hb5 s ALA 55 Cb -0.01 -3.04 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 2hb5 s ALA 55 CO -0.06 0.22 0.08 -0.51 0.00 0.00 0.00 175.76 175.49 2hb5 s LEU 56 N -2.32 3.44 0.36 0.00 1.43 -0.11 -4.42 118.68 117.06 2hb5 s LEU 56 Ca 0.51 -0.49 -0.26 0.00 -1.03 0.00 0.00 54.13 52.86 2hb5 s LEU 56 Cb -0.16 -1.96 -0.12 0.00 0.03 0.00 0.00 46.19 43.98 2hb5 s LEU 56 CO 0.20 -0.02 0.94 -2.65 0.23 0.00 0.00 176.35 175.06 2hb5 n PRO 57 N -1.01 1.24 -1.66 1.29 -0.02 -1.26 -4.33 135.00 129.24 2hb5 n PRO 57 Ca -0.07 0.44 -0.44 0.00 -2.02 0.00 0.00 63.50 61.41 2hb5 n PRO 57 Cb 0.59 -1.87 -0.02 0.00 -0.02 0.00 0.00 33.50 32.17 2hb5 n PRO 57 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hb5 n ALA 58 N -0.22 0.89 0.00 3.55 0.00 -1.26 -1.87 120.51 121.60 2hb5 n ALA 58 Ca 0.10 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.93 2hb5 n ALA 58 Cb 0.36 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.59 2hb5 n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hb5 n GLY 59 N 1.61 1.68 3.70 0.00 0.00 -1.18 -5.04 105.19 105.96 2hb5 n GLY 59 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2hb5 n GLY 59 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hb5 s THR 60 N -2.43 2.57 0.78 2.61 2.01 -0.78 -4.98 115.64 115.43 2hb5 s THR 60 Ca 0.00 0.19 -0.11 0.00 0.31 0.00 0.00 61.69 62.07 2hb5 s THR 60 Cb 0.00 -3.12 0.06 0.00 0.01 0.00 0.00 72.50 69.45 2hb5 s THR 60 CO 0.00 0.00 1.10 -0.94 -0.69 0.00 0.00 174.62 174.09 2hb5 s SER 61 N 2.21 4.67 0.18 3.53 1.04 -1.26 -4.67 113.70 119.40 2hb5 s SER 61 Ca 0.77 1.29 -0.11 0.00 0.48 0.00 0.00 55.95 58.38 2hb5 s SER 61 Cb -0.45 -2.03 0.09 0.00 0.10 0.00 0.00 66.02 63.72 2hb5 s SER 61 CO 0.34 -1.85 1.72 0.00 0.98 0.00 0.00 173.24 174.43 2hb5 h ALA 62 N -1.01 0.83 -0.34 5.32 0.00 -1.87 -1.66 119.26 120.54 2hb5 h ALA 62 Ca -0.47 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.16 2hb5 h ALA 62 Cb 1.26 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2hb5 h ALA 62 CO 0.60 0.48 -0.17 1.96 0.00 0.00 0.00 179.25 182.12 2hb5 h GLN 63 N 0.91 0.62 -0.39 0.00 4.20 -1.93 0.03 115.11 118.54 2hb5 h GLN 63 Ca 0.21 -0.21 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 2hb5 h GLN 63 Cb 0.26 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 2hb5 h GLN 63 CO -0.01 0.76 -0.07 -0.09 -0.67 0.00 0.00 178.83 178.75 2hb5 h ARG 64 N 0.56 0.74 -0.47 1.46 2.43 -1.89 -2.41 114.38 114.80 2hb5 h ARG 64 Ca 0.09 -0.27 -0.05 0.00 -0.81 0.00 0.00 59.98 58.93 2hb5 h ARG 64 Cb 0.61 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 2hb5 h ARG 64 CO 0.04 0.87 0.06 0.00 -1.51 0.00 0.00 179.97 179.43 2hb5 h ALA 65 N 0.85 1.24 -0.65 2.80 0.00 -0.99 -1.90 119.26 120.61 2hb5 h ALA 65 Ca 0.10 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 2hb5 h ALA 65 Cb 0.58 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2hb5 h ALA 65 CO 0.03 0.52 0.19 0.93 0.00 0.00 0.00 179.25 180.92 2hb5 h GLU 66 N 0.70 0.99 -0.28 0.00 5.08 -0.78 -1.58 114.58 118.70 2hb5 h GLU 66 Ca 0.15 -0.20 -0.15 0.00 -1.00 0.00 0.00 59.36 58.16 2hb5 h GLU 66 Cb 0.34 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 2hb5 h GLU 66 CO 0.01 0.86 -0.39 -0.07 -1.00 0.00 0.00 179.01 178.41 2hb5 h LEU 67 N 0.96 0.83 -0.73 1.33 3.38 -1.06 -2.67 115.31 117.35 2hb5 h LEU 67 Ca 0.21 -0.50 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 2hb5 h LEU 67 Cb 0.29 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 2hb5 h LEU 67 CO -0.01 1.18 0.44 0.40 0.09 0.00 0.00 178.44 180.54 2hb5 h ILE 68 N 0.52 1.21 -0.23 1.22 2.04 -1.13 -0.56 117.51 120.58 2hb5 h ILE 68 Ca 0.03 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.41 2hb5 h ILE 68 Cb 0.99 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 2hb5 h ILE 68 CO 0.09 0.21 0.04 0.00 0.00 0.00 0.00 178.15 178.50 2hb5 h ALA 69 N 1.23 0.30 -0.82 1.87 0.00 -1.28 -1.52 119.26 119.04 2hb5 h ALA 69 Ca 0.26 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2hb5 h ALA 69 Cb -0.04 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2hb5 h ALA 69 CO -0.05 -0.03 0.38 1.25 0.00 0.00 0.00 179.25 180.80 2hb5 h LEU 70 N 0.18 1.08 -0.76 0.00 5.85 -1.30 -2.39 115.31 117.96 2hb5 h LEU 70 Ca 0.07 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 2hb5 h LEU 70 Cb 0.31 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 2hb5 h LEU 70 CO 0.00 0.92 0.35 0.74 -0.34 0.00 0.00 178.44 180.11 2hb5 h THR 71 N 1.16 1.25 -0.85 1.05 2.02 -0.94 -2.26 112.91 114.33 2hb5 h THR 71 Ca 0.28 -0.72 -0.02 0.00 0.77 0.00 0.00 66.41 66.71 2hb5 h THR 71 Cb 0.14 0.31 -0.04 0.00 -1.74 0.00 0.00 68.15 66.81 2hb5 h THR 71 CO -0.03 0.30 0.45 -0.61 0.37 0.00 0.00 175.52 176.00 2hb5 h GLN 72 N 1.09 1.20 -0.39 6.66 5.75 -0.95 -1.39 115.11 127.07 2hb5 h GLN 72 Ca 0.26 -0.15 -0.01 0.00 -0.15 0.00 0.00 58.65 58.59 2hb5 h GLN 72 Cb 0.15 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 2hb5 h GLN 72 CO -0.03 0.90 0.18 0.00 -2.65 0.00 0.00 178.83 177.23 2hb5 h ALA 73 N 1.24 0.50 -0.60 3.38 0.00 -1.03 -2.85 119.26 119.90 2hb5 h ALA 73 Ca 0.30 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2hb5 h ALA 73 Cb 0.06 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2hb5 h ALA 73 CO -0.04 0.06 0.39 -0.07 0.00 0.00 0.00 179.25 179.58 2hb5 h LEU 74 N 0.48 0.69 -1.82 0.00 3.38 -1.08 -2.32 115.31 114.65 2hb5 h LEU 74 Ca 0.13 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2hb5 h LEU 74 Cb 0.12 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2hb5 h LEU 74 CO -0.02 0.51 0.00 0.29 0.09 0.00 0.00 178.44 179.32 2hb5 n LYS 75 N -4.66 0.15 0.00 1.13 5.02 -0.56 -3.08 118.16 116.17 2hb5 n LYS 75 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2hb5 n LYS 75 Cb 0.03 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 2hb5 n LYS 75 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2hb5 n ALA 77 N 0.83 0.00 -1.65 7.82 0.00 -0.87 -4.96 120.51 121.68 2hb5 n ALA 77 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 53.44 52.96 2hb5 n ALA 77 Cb 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.47 2hb5 n ALA 77 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2hb5 n GLU 78 N 0.00 1.92 -0.99 0.00 2.13 -1.18 -1.28 120.64 121.25 2hb5 n GLU 78 Ca 0.00 0.69 0.00 0.00 0.66 0.00 0.00 57.16 58.51 2hb5 n GLU 78 Cb 0.00 -2.44 0.00 0.00 0.27 0.00 0.00 31.44 29.27 2hb5 n GLU 78 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2hb5 n GLY 79 N 3.27 0.86 3.64 8.31 0.00 -0.17 -4.88 105.19 116.22 2hb5 n GLY 79 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 2hb5 n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hb5 s LYS 80 N -0.03 1.99 -0.29 1.61 -0.14 -0.41 -4.39 119.74 118.07 2hb5 s LYS 80 Ca 0.00 -2.16 -0.17 0.00 -1.36 0.00 0.00 55.97 52.28 2hb5 s LYS 80 Cb 0.00 -1.55 -0.02 0.00 -1.68 0.00 0.00 37.83 34.57 2hb5 s LYS 80 CO 0.00 -0.13 0.48 0.15 -0.76 0.00 0.00 175.35 175.09 2hb5 s LYS 81 N -3.75 3.92 -0.06 1.68 1.02 -1.26 -0.20 119.74 121.08 2hb5 s LYS 81 Ca 0.29 0.10 0.05 0.00 0.02 0.00 0.00 55.97 56.43 2hb5 s LYS 81 Cb 0.08 -3.70 -0.01 0.00 -0.52 0.00 0.00 37.83 33.68 2hb5 s LYS 81 CO 0.15 -0.42 -0.23 -1.17 -0.92 0.00 0.00 175.35 172.76 2hb5 s LEU 82 N 2.27 2.02 -0.28 3.17 2.96 -0.35 -0.14 118.68 128.34 2hb5 s LEU 82 Ca 0.19 -0.48 -0.04 0.00 -0.22 0.00 0.00 54.13 53.57 2hb5 s LEU 82 Cb -0.16 -1.28 0.02 0.00 0.50 0.00 0.00 46.19 45.28 2hb5 s LEU 82 CO 0.11 0.20 0.02 0.20 -1.32 0.00 0.00 176.35 175.56 2hb5 s ASN 83 N 0.01 4.81 -0.06 3.68 0.01 -0.51 -1.38 114.94 121.51 2hb5 s ASN 83 Ca -0.07 -0.85 0.05 0.00 -0.71 0.00 0.00 52.86 51.28 2hb5 s ASN 83 Cb -0.14 -1.78 -0.00 0.00 0.41 0.00 0.00 41.25 39.73 2hb5 s ASN 83 CO 0.04 -0.18 -0.20 0.54 -1.51 0.00 0.00 177.10 175.79 2hb5 s VAL 84 N 1.41 1.68 0.07 1.60 0.11 -0.35 -1.35 120.40 123.57 2hb5 s VAL 84 Ca 0.01 -0.85 0.02 0.00 -2.93 0.00 0.00 61.98 58.24 2hb5 s VAL 84 Cb -0.17 -1.44 -0.04 0.00 -1.53 0.00 0.00 36.38 33.20 2hb5 s VAL 84 CO -0.00 0.48 0.09 -0.31 -3.33 0.00 0.00 175.10 172.02 2hb5 s TYR 85 N 0.05 3.23 -0.12 1.54 1.51 -0.02 -0.70 117.35 122.84 2hb5 s TYR 85 Ca -0.06 0.10 -0.11 0.00 -1.01 0.00 0.00 57.07 55.99 2hb5 s TYR 85 Cb -0.13 -1.64 0.03 0.00 -0.11 0.00 0.00 41.96 40.11 2hb5 s TYR 85 CO 0.04 0.53 0.32 -0.08 -1.11 0.00 0.00 175.55 175.25 2hb5 s THR 86 N -1.38 -0.00 -1.61 -0.71 -1.32 -0.60 -1.46 115.64 108.56 2hb5 s THR 86 Ca 0.29 0.00 0.21 0.00 -1.21 0.00 0.00 61.69 60.98 2hb5 s THR 86 Cb -0.12 -0.45 0.66 0.00 -1.51 0.00 0.00 72.50 71.08 2hb5 s THR 86 CO 0.22 0.00 1.56 -0.90 -2.21 0.00 0.00 174.62 173.29 2hb5 n ASP 87 N 2.91 4.23 -4.51 8.08 3.85 -1.26 -1.99 116.55 127.86 2hb5 n ASP 87 Ca -0.13 -2.17 -0.42 0.00 -0.71 0.00 0.00 54.79 51.36 2hb5 n ASP 87 Cb 0.58 -0.52 -0.10 0.00 -1.35 0.00 0.00 41.12 39.73 2hb5 n ASP 87 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 2hb5 s SER 88 N -0.98 6.12 0.25 -1.12 0.15 -1.26 -4.94 113.70 111.93 2hb5 s SER 88 Ca 0.49 -0.56 -0.04 0.00 0.70 0.00 0.00 55.95 56.54 2hb5 s SER 88 Cb 0.28 -2.17 0.30 0.00 -1.71 0.00 0.00 66.02 62.72 2hb5 s SER 88 CO 0.29 -0.36 1.79 -0.09 1.20 0.00 0.00 173.24 176.07 2hb5 h ARG 89 N 8.56 0.96 -0.11 5.44 2.43 -1.99 -1.69 114.38 127.97 2hb5 h ARG 89 Ca -0.29 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 2hb5 h ARG 89 Cb 1.14 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.54 2hb5 h ARG 89 CO 0.69 0.84 0.07 -0.92 -1.51 0.00 0.00 179.97 179.15 2hb5 h TYR 90 N 0.92 0.14 -0.58 2.20 3.20 -1.99 0.46 116.97 121.33 2hb5 h TYR 90 Ca 0.20 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.02 2hb5 h TYR 90 Cb 0.30 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 2hb5 h TYR 90 CO 0.02 0.09 0.15 0.00 -1.64 0.00 0.00 178.16 176.78 2hb5 h ALA 91 N 1.04 0.76 -0.25 1.82 0.00 -1.88 -0.39 119.26 120.36 2hb5 h ALA 91 Ca 0.04 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 2hb5 h ALA 91 Cb -0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2hb5 h ALA 91 CO -0.01 0.46 0.15 0.35 0.00 0.00 0.00 179.25 180.20 2hb5 h PHE 92 N 0.83 0.33 -0.40 0.00 3.04 -1.11 -2.03 116.94 117.62 2hb5 h PHE 92 Ca 0.18 -0.00 -0.10 0.00 3.98 0.00 0.00 57.97 62.03 2hb5 h PHE 92 Cb 0.34 -0.11 -0.02 0.00 2.56 0.00 0.00 35.95 38.72 2hb5 h PHE 92 CO 0.02 0.26 -0.17 0.00 -2.02 0.00 0.00 178.31 176.41 2hb5 h ALA 93 N 1.04 0.96 -0.61 2.41 0.00 -0.78 -2.98 119.26 119.30 2hb5 h ALA 93 Ca 0.09 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 2hb5 h ALA 93 Cb 0.03 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2hb5 h ALA 93 CO -0.02 0.61 0.13 1.15 0.00 0.00 0.00 179.25 181.12 2hb5 h THR 94 N 0.66 1.25 0.00 0.00 2.02 -0.87 -1.70 112.91 114.27 2hb5 h THR 94 Ca 0.10 -0.92 0.00 0.00 0.77 0.00 0.00 66.41 66.37 2hb5 h THR 94 Cb 0.65 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 2hb5 h THR 94 CO 0.05 0.34 0.00 0.00 0.37 0.00 0.00 175.52 176.28 2hb5 n ALA 95 N -2.46 1.29 0.41 6.16 0.00 -0.78 -1.50 120.51 123.63 2hb5 n ALA 95 Ca 0.04 0.10 0.09 0.00 0.00 0.00 0.00 53.44 53.68 2hb5 n ALA 95 Cb 0.25 -1.27 0.14 0.00 0.00 0.00 0.00 19.45 18.57 2hb5 n ALA 95 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2hb5 n HIS 96 N -2.03 0.26 -2.28 0.00 -0.00 -0.65 -4.58 115.22 105.94 2hb5 n HIS 96 Ca 0.00 -0.17 -0.41 0.00 -0.00 0.00 0.00 57.72 57.14 2hb5 n HIS 96 Cb 0.10 -0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.06 2hb5 n HIS 96 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2hb5 s LEU 97 N -1.35 4.45 -0.01 2.41 1.43 -0.56 -4.15 118.68 120.90 2hb5 s LEU 97 Ca 0.27 2.39 0.11 0.00 -1.03 0.00 0.00 54.13 55.87 2hb5 s LEU 97 Cb 0.17 -3.62 -0.14 0.00 0.03 0.00 0.00 46.19 42.63 2hb5 s LEU 97 CO 0.24 -0.43 0.38 0.35 0.23 0.00 0.00 176.35 177.12 2hb5 n THR 98 N 2.05 0.00 -3.63 5.49 -2.24 -1.26 -3.94 114.28 110.75 2hb5 n THR 98 Ca 0.03 -0.25 -0.11 0.00 -2.27 0.00 0.00 64.05 61.45 2hb5 n THR 98 Cb 0.43 0.71 -0.07 0.00 -2.10 0.00 0.00 70.33 69.30 2hb5 n THR 98 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2hb5 s SER 99 N -2.51 -0.68 0.15 3.42 0.15 -1.26 -4.93 113.70 108.03 2hb5 s SER 99 Ca 0.01 1.27 -0.21 0.00 0.70 0.00 0.00 55.95 57.72 2hb5 s SER 99 Cb 0.08 1.29 0.06 0.00 -1.71 0.00 0.00 66.02 65.74 2hb5 s SER 99 CO 0.45 -0.22 0.54 -1.83 1.20 0.00 0.00 173.24 173.39 2hb5 s GLU 100 N 0.52 1.21 0.83 5.44 1.03 -1.26 -5.18 118.70 121.29 2hb5 s GLU 100 Ca -0.01 -0.53 -0.07 0.00 0.03 0.00 0.00 54.97 54.39 2hb5 s GLU 100 Cb -0.05 0.55 0.17 0.00 -0.80 0.00 0.00 34.13 34.00 2hb5 s GLU 100 CO -0.04 -0.52 1.14 0.20 -1.33 0.00 0.00 175.26 174.72 2hb5 s GLY 101 N -2.75 1.77 0.25 -3.83 0.00 -1.26 -5.00 107.32 96.50 2hb5 s GLY 101 Ca 0.01 -1.58 0.14 0.00 0.00 0.00 0.00 44.72 43.29 2hb5 s GLY 101 CO -0.13 -0.90 1.42 1.70 0.00 0.00 0.00 173.10 175.20 2hb5 h LYS 102 N -1.03 0.00 -3.44 2.90 3.64 -2.03 -3.37 116.57 113.23 2hb5 h LYS 102 Ca -0.39 0.00 -0.71 0.00 -1.27 0.00 0.00 60.65 58.28 2hb5 h LYS 102 Cb 1.25 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.02 2hb5 h LYS 102 CO 0.37 0.60 3.07 0.39 -2.27 0.00 0.00 179.45 181.62 2hb5 n GLU 103 N -3.26 3.46 -4.04 1.90 -0.58 -1.26 -4.88 120.64 111.98 2hb5 n GLU 103 Ca 0.02 -2.75 -0.11 0.00 -0.42 0.00 0.00 57.16 53.89 2hb5 n GLU 103 Cb 0.77 -3.00 -0.11 0.00 -0.57 0.00 0.00 31.44 28.53 2hb5 n GLU 103 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 2hb5 s ILE 104 N 1.86 0.39 0.49 -3.67 -4.36 -1.26 -5.15 121.20 109.51 2hb5 s ILE 104 Ca 0.53 -1.09 -0.20 0.00 -0.26 0.00 0.00 60.65 59.63 2hb5 s ILE 104 Cb 0.15 -0.58 -0.08 0.00 1.25 0.00 0.00 42.46 43.20 2hb5 s ILE 104 CO -0.06 -0.47 1.03 -0.54 0.24 0.00 0.00 174.94 175.14 2hb5 s LYS 105 N -1.74 3.81 -1.43 0.37 3.01 -1.26 -3.63 119.74 118.87 2hb5 s LYS 105 Ca -0.10 1.30 -0.07 0.00 -1.01 0.00 0.00 55.97 56.09 2hb5 s LYS 105 Cb -0.09 -2.10 0.01 0.00 -1.01 0.00 0.00 37.83 34.64 2hb5 s LYS 105 CO -0.01 -0.42 0.95 0.09 0.51 0.00 0.00 175.35 176.47 2hb5 n ASN 106 N -1.06 -6.26 -0.17 2.83 3.02 -1.26 -4.90 115.26 107.46 2hb5 n ASN 106 Ca 0.09 -0.43 -0.02 0.00 -0.03 0.00 0.00 54.58 54.18 2hb5 n ASN 106 Cb 0.53 -4.96 0.07 0.00 -0.61 0.00 0.00 39.78 34.81 2hb5 n ASN 106 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 2hb5 h LYS 107 N -2.16 0.33 -0.68 3.52 2.10 -1.93 -0.78 116.57 116.98 2hb5 h LYS 107 Ca -0.55 -0.02 -0.05 0.00 -2.00 0.00 0.00 60.65 58.03 2hb5 h LYS 107 Cb 1.36 -0.08 -0.03 0.00 -0.90 0.00 0.00 32.23 32.59 2hb5 h LYS 107 CO 0.56 0.22 0.24 -0.44 -2.00 0.00 0.00 179.45 178.03 2hb5 h ASP 108 N 0.34 0.96 -0.24 7.07 5.19 -1.92 -1.97 116.42 125.85 2hb5 h ASP 108 Ca 0.25 -0.19 -0.12 0.00 -0.62 0.00 0.00 57.03 56.35 2hb5 h ASP 108 Cb 0.29 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.54 2hb5 h ASP 108 CO -0.27 0.89 -0.28 -0.33 -3.12 0.00 0.00 179.24 176.13 2hb5 h GLU 109 N 0.97 0.73 -0.46 3.56 3.07 -1.85 -2.22 114.58 118.38 2hb5 h GLU 109 Ca 0.22 -0.32 -0.06 0.00 -0.50 0.00 0.00 59.36 58.70 2hb5 h GLU 109 Cb 0.26 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.13 2hb5 h GLU 109 CO -0.01 0.92 0.04 0.82 -1.40 0.00 0.00 179.01 179.38 2hb5 h ILE 110 N 0.63 1.25 -0.86 3.13 2.04 -0.99 -1.44 117.51 121.27 2hb5 h ILE 110 Ca 0.08 -0.97 0.01 0.00 1.00 0.00 0.00 64.86 64.97 2hb5 h ILE 110 Cb 0.79 0.99 -0.04 0.00 -0.74 0.00 0.00 36.82 37.81 2hb5 h ILE 110 CO 0.07 0.34 0.57 0.25 0.00 0.00 0.00 178.15 179.37 2hb5 h LEU 111 N 0.64 0.99 -0.76 1.44 5.85 -1.21 -0.88 115.31 121.39 2hb5 h LEU 111 Ca 0.14 -0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.73 2hb5 h LEU 111 Cb 0.44 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 2hb5 h LEU 111 CO 0.02 0.72 -0.07 0.00 -0.34 0.00 0.00 178.44 178.76 2hb5 h ALA 112 N 1.31 0.95 -0.07 1.25 0.00 -1.22 -2.44 119.26 119.05 2hb5 h ALA 112 Ca 0.31 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2hb5 h ALA 112 Cb -0.13 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 2hb5 h ALA 112 CO -0.07 0.62 0.01 1.25 0.00 0.00 0.00 179.25 181.06 2hb5 h LEU 113 N 0.80 0.11 -1.38 0.00 5.85 -0.72 -1.15 115.31 118.82 2hb5 h LEU 113 Ca 0.14 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.65 2hb5 h LEU 113 Cb 0.57 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 2hb5 h LEU 113 CO 0.03 0.35 0.47 -0.07 -0.34 0.00 0.00 178.44 178.88 2hb5 h LEU 114 N -0.14 0.67 -0.15 2.25 3.38 -1.10 -1.43 115.31 118.80 2hb5 h LEU 114 Ca 0.02 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 2hb5 h LEU 114 Cb 0.29 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.90 2hb5 h LEU 114 CO 0.00 0.44 -0.56 0.11 0.09 0.00 0.00 178.44 178.53 2hb5 h LYS 115 N 0.77 0.64 0.00 1.13 1.57 -1.33 -3.22 116.57 116.13 2hb5 h LYS 115 Ca 0.30 -0.49 -0.02 0.00 -1.87 0.00 0.00 60.65 58.57 2hb5 h LYS 115 Cb 0.21 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 2hb5 h LYS 115 CO -0.10 1.11 -0.10 0.00 -0.57 0.00 0.00 179.45 179.79 2hb5 h ALA 116 N 0.53 1.43 -0.76 3.86 0.00 -0.47 -2.86 119.26 120.99 2hb5 h ALA 116 Ca -0.03 -0.09 0.21 0.00 0.00 0.00 0.00 54.91 55.00 2hb5 h ALA 116 Cb 1.19 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 2hb5 h ALA 116 CO 0.12 0.13 0.54 -0.07 0.00 0.00 0.00 179.25 179.97 2hb5 h LEU 117 N 0.00 0.06 -0.57 0.00 3.38 -1.30 -1.08 115.31 115.80 2hb5 h LEU 117 Ca -0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2hb5 h LEU 117 Cb 0.25 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2hb5 h LEU 117 CO 0.01 0.03 -0.07 0.49 0.09 0.00 0.00 178.44 178.99 2hb5 n PHE 118 N -4.34 0.00 -0.01 1.13 3.72 -1.08 -4.32 117.46 112.57 2hb5 n PHE 118 Ca 0.15 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.38 2hb5 n PHE 118 Cb 0.79 -0.06 -0.10 0.00 -0.94 0.00 0.00 39.48 39.18 2hb5 n PHE 118 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2hb5 h LEU 119 N 1.40 0.68-10.11 4.37 3.38 -1.37 -3.46 115.31 110.21 2hb5 h LEU 119 Ca 0.00 -0.70 -0.51 0.00 0.09 0.00 0.00 57.88 56.76 2hb5 h LEU 119 Cb 0.39 -0.20 0.09 0.00 0.09 0.00 0.00 40.66 41.03 2hb5 h LEU 119 CO 0.00 1.27 0.44 -2.84 0.09 0.00 0.00 178.44 177.40 2hb5 s PRO 120 N -3.47 3.12 0.05 1.13 0.02 -1.26 -1.00 135.00 133.59 2hb5 s PRO 120 Ca -0.12 1.67 -0.22 0.00 0.02 0.00 0.00 61.00 62.35 2hb5 s PRO 120 Cb 0.05 -1.97 -0.13 0.00 0.02 0.00 0.00 34.50 32.48 2hb5 s PRO 120 CO 0.85 -1.05 1.49 -0.22 -0.33 0.00 0.00 177.00 177.74 2hb5 h LYS 121 N 0.91 0.22 -4.40 5.54 3.64 -0.79 -3.43 116.57 118.25 2hb5 h LYS 121 Ca -0.50 -0.07 -0.27 0.00 -1.27 0.00 0.00 60.65 58.55 2hb5 h LYS 121 Cb 1.27 -0.02 -0.23 0.00 -0.41 0.00 0.00 32.23 32.84 2hb5 h LYS 121 CO 0.56 0.44 -0.73 0.50 -2.27 0.00 0.00 179.45 177.95 2hb5 s ARG 122 N -5.03 0.46 -0.12 1.90 3.52 -1.14 -4.98 118.95 113.56 2hb5 s ARG 122 Ca -0.14 -0.58 -0.10 0.00 -0.13 0.00 0.00 55.73 54.78 2hb5 s ARG 122 Cb 0.05 -0.26 0.03 0.00 -1.56 0.00 0.00 34.95 33.22 2hb5 s ARG 122 CO 0.71 0.05 0.31 -1.17 -0.81 0.00 0.00 175.30 174.38 2hb5 s LEU 123 N -1.17 0.73 -0.08 -0.88 2.96 -1.26 -1.20 118.68 117.77 2hb5 s LEU 123 Ca -0.08 0.62 0.00 0.00 -0.22 0.00 0.00 54.13 54.46 2hb5 s LEU 123 Cb -0.08 1.03 0.02 0.00 0.50 0.00 0.00 46.19 47.67 2hb5 s LEU 123 CO 0.00 -0.12 -0.07 -0.44 -1.32 0.00 0.00 176.35 174.40 2hb5 s SER 124 N 0.36 1.69 -0.23 3.68 0.01 -0.48 -2.73 113.70 116.01 2hb5 s SER 124 Ca -0.02 -0.22 -0.05 0.00 1.31 0.00 0.00 55.95 56.97 2hb5 s SER 124 Cb -0.03 -0.68 -0.01 0.00 0.21 0.00 0.00 66.02 65.50 2hb5 s SER 124 CO -0.01 -0.08 -0.02 -0.63 0.41 0.00 0.00 173.24 172.91 2hb5 s ILE 125 N 1.30 3.58 -0.11 1.44 1.01 -0.84 -1.21 121.20 126.38 2hb5 s ILE 125 Ca -0.04 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.19 2hb5 s ILE 125 Cb -0.14 -2.64 -0.02 0.00 0.01 0.00 0.00 42.46 39.67 2hb5 s ILE 125 CO -0.03 0.40 -0.14 -0.63 0.00 0.00 0.00 174.94 174.54 2hb5 s ILE 126 N 1.51 2.97 -0.39 2.92 1.09 0.13 -4.34 121.20 125.08 2hb5 s ILE 126 Ca 0.06 -0.71 -0.20 0.00 -1.10 0.00 0.00 60.65 58.71 2hb5 s ILE 126 Cb -0.14 -2.22 0.01 0.00 -1.06 0.00 0.00 42.46 39.05 2hb5 s ILE 126 CO -0.02 0.54 0.58 -2.28 -0.10 0.00 0.00 174.94 173.67 2hb5 s HIS 127 N 0.11 3.13 0.38 3.97 2.46 -1.26 -1.56 115.29 122.52 2hb5 s HIS 127 Ca -0.07 0.08 0.00 0.00 0.47 0.00 0.00 55.06 55.54 2hb5 s HIS 127 Cb -0.15 -3.13 0.00 0.00 -0.13 0.00 0.00 32.58 29.17 2hb5 s HIS 127 CO 0.05 -0.70 0.00 0.00 -2.47 0.00 0.00 174.74 171.62 2hb5 n GLY 134 N -3.95 2.70 0.13 0.00 0.00 -1.26 -5.08 105.19 97.73 2hb5 n GLY 134 Ca -0.02 -2.00 0.07 0.00 0.00 0.00 0.00 46.02 44.07 2hb5 n GLY 134 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2hb5 n HIS 135 N -0.04 0.00 -2.05 1.61 8.25 -1.26 -4.77 115.22 116.96 2hb5 n HIS 135 Ca 0.00 -0.75 -0.28 0.00 -0.26 0.00 0.00 57.72 56.43 2hb5 n HIS 135 Cb 0.00 -0.12 0.11 0.00 1.12 0.00 0.00 29.99 31.11 2hb5 n HIS 135 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2hb5 s SER 136 N -2.28 4.17 0.27 0.41 1.04 -1.26 -4.86 113.70 111.19 2hb5 s SER 136 Ca 0.22 0.45 -0.03 0.00 0.48 0.00 0.00 55.95 57.08 2hb5 s SER 136 Cb 0.19 -0.84 0.36 0.00 0.10 0.00 0.00 66.02 65.83 2hb5 s SER 136 CO 0.02 -2.06 1.82 0.00 0.98 0.00 0.00 173.24 174.01 2hb5 h ALA 137 N -1.06 1.19 -0.10 5.32 0.00 -1.99 -0.71 119.26 121.92 2hb5 h ALA 137 Ca -0.44 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.12 2hb5 h ALA 137 Cb 1.29 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2hb5 h ALA 137 CO 0.54 0.57 -0.59 1.05 0.00 0.00 0.00 179.25 180.82 2hb5 h GLU 138 N 0.89 0.32 -0.46 0.00 4.11 -1.99 -0.58 114.58 116.87 2hb5 h GLU 138 Ca 0.20 -0.22 -0.11 0.00 0.07 0.00 0.00 59.36 59.30 2hb5 h GLU 138 Cb 0.26 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 2hb5 h GLU 138 CO -0.01 0.82 -0.14 0.00 0.07 0.00 0.00 179.01 179.75 2hb5 h ALA 139 N 1.13 0.64 -0.61 1.06 0.00 -1.79 -1.61 119.26 118.08 2hb5 h ALA 139 Ca -0.00 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 2hb5 h ALA 139 Cb 1.10 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2hb5 h ALA 139 CO 0.10 0.57 0.07 0.00 0.00 0.00 0.00 179.25 179.98 2hb5 h ARG 140 N 0.76 1.04 -0.30 0.00 3.08 -0.97 -1.74 114.38 116.24 2hb5 h ARG 140 Ca 0.11 -0.29 -0.03 0.00 0.07 0.00 0.00 59.98 59.84 2hb5 h ARG 140 Cb 0.70 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 2hb5 h ARG 140 CO 0.05 0.98 0.07 0.78 -1.07 0.00 0.00 179.97 180.78 2hb5 h GLY 141 N 0.94 0.52 1.10 0.04 0.00 -0.97 -2.87 103.07 101.83 2hb5 h GLY 141 Ca 0.18 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.17 2hb5 h GLY 141 CO 0.02 0.31 0.49 3.43 0.00 0.00 0.00 176.54 180.78 2hb5 h ASN 142 N 0.32 1.05 0.00 0.19 2.35 -1.20 -1.86 115.58 116.43 2hb5 h ASN 142 Ca 0.09 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2hb5 h ASN 142 Cb 0.30 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.40 2hb5 h ASN 142 CO 0.00 0.83 0.00 -1.14 -1.65 0.00 0.00 177.43 175.47 2hb5 n ARG 143 N -4.35 0.36 0.00 0.81 0.63 -0.66 -1.87 116.66 111.57 2hb5 n ARG 143 Ca 0.09 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.02 2hb5 n ARG 143 Cb 0.08 -1.32 0.00 0.00 0.45 0.00 0.00 32.46 31.68 2hb5 n ARG 143 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2hb5 n ALA 145 N 0.80 0.00 -0.04 5.13 0.00 -0.70 -1.43 120.51 124.28 2hb5 n ALA 145 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 2hb5 n ALA 145 Cb 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.57 2hb5 n ALA 145 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2hb5 h ASP 146 N 0.00 0.21 -0.89 0.00 3.32 -1.64 -1.43 116.42 115.98 2hb5 h ASP 146 Ca 0.00 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 56.80 2hb5 h ASP 146 Cb 0.00 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.45 2hb5 h ASP 146 CO 0.00 0.39 0.50 -0.61 -1.72 0.00 0.00 179.24 177.81 2hb5 h GLN 147 N 0.01 1.23 -0.45 3.56 4.15 -1.52 -1.62 115.11 120.48 2hb5 h GLN 147 Ca 0.04 -0.13 -0.11 0.00 0.77 0.00 0.00 58.65 59.21 2hb5 h GLN 147 Cb 0.27 -0.25 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 2hb5 h GLN 147 CO 0.00 0.89 -0.18 0.00 -1.93 0.00 0.00 178.83 177.61 2hb5 h ALA 148 N 1.27 0.84 -0.39 3.38 0.00 -1.79 -0.27 119.26 122.32 2hb5 h ALA 148 Ca 0.32 -0.36 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 2hb5 h ALA 148 Cb 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2hb5 h ALA 148 CO -0.05 0.64 -0.20 0.00 0.00 0.00 0.00 179.25 179.63 2hb5 h ALA 149 N 1.03 0.55 -0.49 0.00 0.00 -1.00 -1.94 119.26 117.41 2hb5 h ALA 149 Ca 0.11 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 2hb5 h ALA 149 Cb 0.71 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2hb5 h ALA 149 CO 0.05 0.51 -0.16 0.00 0.00 0.00 0.00 179.25 179.65 2hb5 h ARG 150 N 0.63 0.96 -0.55 0.00 3.08 -1.20 -2.04 114.38 115.26 2hb5 h ARG 150 Ca 0.08 -0.38 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 2hb5 h ARG 150 Cb 0.76 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.74 2hb5 h ARG 150 CO 0.06 1.04 0.29 -0.22 -1.07 0.00 0.00 179.97 180.07 2hb5 h LYS 151 N 0.84 0.77 -0.48 0.04 3.64 -0.95 -1.47 116.57 118.96 2hb5 h LYS 151 Ca 0.12 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2hb5 h LYS 151 Cb 0.72 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 2hb5 h LYS 151 CO 0.06 0.61 0.23 0.00 -2.27 0.00 0.00 179.45 178.07 2hb5 h ALA 152 N 1.12 0.62 -0.77 5.00 0.00 -1.22 0.17 119.26 124.18 2hb5 h ALA 152 Ca 0.19 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2hb5 h ALA 152 Cb 0.07 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2hb5 h ALA 152 CO -0.03 0.18 0.38 0.00 0.00 0.00 0.00 179.25 179.78 2hb5 h ALA 153 N 1.07 0.99 0.07 0.00 0.00 -1.13 -1.58 119.26 118.68 2hb5 h ALA 153 Ca 0.16 -0.15 -0.28 0.00 0.00 0.00 0.00 54.91 54.64 2hb5 h ALA 153 Cb 0.13 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2hb5 h ALA 153 CO -0.02 0.55 -1.44 0.82 0.00 0.00 0.00 179.25 179.17 2hb5 h ILE 154 N 1.09 1.23 -0.01 0.00 2.04 -1.14 -3.41 117.51 117.31 2hb5 h ILE 154 Ca 0.27 -2.93 0.00 0.00 1.00 0.00 0.00 64.86 63.20 2hb5 h ILE 154 Cb 0.11 2.72 0.00 0.00 -0.74 0.00 0.00 36.82 38.90 2hb5 h ILE 154 CO -0.03 0.79 -0.34 0.35 0.00 0.00 0.00 178.15 178.92 2hb5 n THR 155 N -3.35 0.00 -4.44 -0.27 -2.24 0.04 -5.03 114.28 98.98 2hb5 n THR 155 Ca -0.13 -0.33 -0.24 0.00 -2.27 0.00 0.00 64.05 61.08 2hb5 n THR 155 Cb 1.02 1.10 -0.10 0.00 -2.10 0.00 0.00 70.33 70.25 2hb5 n THR 155 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2hb5 s GLU 156 N -1.69 1.81 -0.14 -0.78 2.02 -0.59 -5.04 118.70 114.28 2hb5 s GLU 156 Ca 0.08 -1.72 -0.07 0.00 0.02 0.00 0.00 54.97 53.28 2hb5 s GLU 156 Cb 0.09 -1.84 -0.04 0.00 0.10 0.00 0.00 34.13 32.44 2hb5 s GLU 156 CO 0.35 0.32 0.12 0.99 0.02 0.00 0.00 175.26 177.06 2hb5 s THR 157 N -2.48 5.35 0.71 3.63 2.01 -1.26 -4.79 115.64 118.80 2hb5 s THR 157 Ca 0.31 0.15 -0.11 0.00 0.31 0.00 0.00 61.69 62.35 2hb5 s THR 157 Cb -0.05 -3.35 0.02 0.00 0.01 0.00 0.00 72.50 69.13 2hb5 s THR 157 CO 0.16 0.57 1.07 -2.16 -0.69 0.00 0.00 174.62 173.56 2hb5 s PRO 158 N -0.62 2.82 0.24 4.92 0.04 -1.26 -4.68 135.00 136.46 2hb5 s PRO 158 Ca 0.13 0.88 0.26 0.00 0.04 0.00 0.00 61.00 62.31 2hb5 s PRO 158 Cb -0.12 -1.98 0.76 0.00 0.04 0.00 0.00 34.50 33.20 2hb5 s PRO 158 CO 0.02 -1.16 1.75 -0.44 0.04 0.00 0.00 177.00 177.22 2hb5 h ASP 159 N -0.76 0.00 -4.52 6.66 3.32 -1.92 -3.45 116.42 115.74 2hb5 h ASP 159 Ca -0.44 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.28 2hb5 h ASP 159 Cb 1.22 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.58 2hb5 h ASP 159 CO 0.58 0.00 -0.74 0.42 -1.72 0.00 0.00 179.24 177.77 2hb5 s THR 160 N -3.13 0.85 0.00 0.35 -4.23 -1.26 -5.11 115.64 103.11 2hb5 s THR 160 Ca 0.10 -1.42 0.00 0.00 -1.18 0.00 0.00 61.69 59.19 2hb5 s THR 160 Cb 0.11 -1.10 0.00 0.00 1.34 0.00 0.00 72.50 72.85 2hb5 s THR 160 CO 0.60 -0.45 0.00 -1.20 -0.54 0.00 0.00 174.62 173.03