#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bh5 s PRO 3 N 0.00 4.44 0.29 5.31 0.04 -1.26 -4.96 135.00 138.86 1bh5 s PRO 3 Ca 0.00 1.88 -0.30 0.00 0.04 0.00 0.00 61.00 62.62 1bh5 s PRO 3 Cb 0.00 -3.28 -0.11 0.00 0.04 0.00 0.00 34.50 31.15 1bh5 s PRO 3 CO 0.00 -0.21 1.55 -1.14 0.04 0.00 0.00 177.00 177.24 1bh5 s GLN 4 N 0.42 4.16 0.46 4.56 0.74 -1.26 -4.96 119.66 123.78 1bh5 s GLN 4 Ca 0.57 2.51 -0.25 0.00 0.05 0.00 0.00 55.36 58.24 1bh5 s GLN 4 Cb -0.32 -3.04 -0.08 0.00 1.10 0.00 0.00 33.01 30.67 1bh5 s GLN 4 CO 0.33 -0.57 1.36 -1.25 -0.55 0.00 0.00 175.29 174.60 1bh5 s PRO 5 N -0.55 3.67 0.51 1.67 0.04 -1.26 -4.96 135.00 134.12 1bh5 s PRO 5 Ca 0.62 2.26 -0.22 0.00 0.04 0.00 0.00 61.00 63.69 1bh5 s PRO 5 Cb -0.46 -2.59 -0.07 0.00 0.04 0.00 0.00 34.50 31.41 1bh5 s PRO 5 CO 0.48 -0.77 1.20 -0.35 0.04 0.00 0.00 177.00 177.59 1bh5 n PRO 6 N -0.27 1.52 -2.41 0.56 -0.04 -1.26 -4.91 135.00 128.19 1bh5 n PRO 6 Ca 0.06 0.56 -0.40 0.00 -0.04 0.00 0.00 63.50 63.68 1bh5 n PRO 6 Cb 0.43 -2.36 -0.04 0.00 -0.04 0.00 0.00 33.50 31.50 1bh5 n PRO 6 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1bh5 s SER 7 N -0.86 7.06 0.00 3.54 0.01 -1.26 -5.02 113.70 117.16 1bh5 s SER 7 Ca 0.69 2.31 0.00 0.00 1.31 0.00 0.00 55.95 60.26 1bh5 s SER 7 Cb -0.46 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.15 1bh5 s SER 7 CO 0.52 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 174.48 1bh5 n GLY 8 N 0.98 3.83 3.89 3.44 0.00 -1.26 -5.11 105.19 110.96 1bh5 n GLY 8 Ca 0.00 -1.78 -0.29 0.00 0.00 0.00 0.00 46.02 43.96 1bh5 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bh5 s GLY 9 N 0.00 1.84 0.59 -0.02 0.00 -1.26 -5.04 107.32 103.42 1bh5 s GLY 9 Ca 0.00 -0.35 -0.19 0.00 0.00 0.00 0.00 44.72 44.19 1bh5 s GLY 9 CO 0.00 -0.18 1.17 1.08 0.00 0.00 0.00 173.10 175.17 1bh5 s LEU 10 N -3.94 3.66 0.83 0.66 1.43 -1.26 -5.02 118.68 115.04 1bh5 s LEU 10 Ca 0.49 2.29 -0.12 0.00 -1.03 0.00 0.00 54.13 55.76 1bh5 s LEU 10 Cb -0.10 -4.59 0.09 0.00 0.03 0.00 0.00 46.19 41.61 1bh5 s LEU 10 CO 0.33 -1.50 1.12 0.42 0.23 0.00 0.00 176.35 176.95 1bh5 s THR 11 N -1.72 2.66 0.29 5.49 -4.23 -1.26 -4.86 115.64 112.01 1bh5 s THR 11 Ca 0.75 0.22 -0.02 0.00 -1.18 0.00 0.00 61.69 61.46 1bh5 s THR 11 Cb -0.27 -3.01 0.27 0.00 1.34 0.00 0.00 72.50 70.83 1bh5 s THR 11 CO 0.32 -0.28 1.93 0.44 -0.54 0.00 0.00 174.62 176.49 1bh5 h ASP 12 N -1.18 0.98 -0.43 3.99 3.32 -2.00 -2.17 116.42 118.93 1bh5 h ASP 12 Ca -0.48 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1bh5 h ASP 12 Cb 1.29 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.60 1bh5 h ASP 12 CO 0.61 0.67 0.27 -0.33 -1.72 0.00 0.00 179.24 178.74 1bh5 h GLU 13 N 1.13 0.57 -0.58 3.56 3.07 -1.99 -0.88 114.58 119.46 1bh5 h GLU 13 Ca 0.37 -0.04 -0.06 0.00 -0.50 0.00 0.00 59.36 59.13 1bh5 h GLU 13 Cb 0.04 -0.13 -0.03 0.00 -0.84 0.00 0.00 28.75 27.80 1bh5 h GLU 13 CO -0.11 0.39 0.13 0.00 -1.40 0.00 0.00 179.01 178.02 1bh5 h ALA 14 N 1.14 1.14 -0.23 3.43 0.00 -1.82 0.33 119.26 123.26 1bh5 h ALA 14 Ca 0.16 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1bh5 h ALA 14 Cb -0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1bh5 h ALA 14 CO -0.03 0.58 0.01 0.00 0.00 0.00 0.00 179.25 179.80 1bh5 h ALA 15 N 1.28 0.31 -0.47 0.00 0.00 -1.02 -2.58 119.26 116.78 1bh5 h ALA 15 Ca 0.19 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1bh5 h ALA 15 Cb 0.32 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1bh5 h ALA 15 CO 0.00 0.03 0.05 -0.07 0.00 0.00 0.00 179.25 179.26 1bh5 h LEU 16 N 0.18 0.69 -2.70 0.00 3.38 -0.77 -1.92 115.31 114.18 1bh5 h LEU 16 Ca 0.07 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1bh5 h LEU 16 Cb 0.39 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1bh5 h LEU 16 CO 0.01 0.73 -0.01 0.77 0.09 0.00 0.00 178.44 180.03 1bh5 h SER 17 N 0.70 0.00 -0.22 -0.43 4.64 0.05 -0.64 113.55 117.65 1bh5 h SER 17 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1bh5 h SER 17 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1bh5 h SER 17 CO 0.01 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 175.98 1bh5 s SER 20 N 0.43 4.99 0.67 0.00 0.01 -1.26 -5.01 113.70 113.53 1bh5 s SER 20 Ca 0.09 -0.13 -0.17 0.00 1.31 0.00 0.00 55.95 57.04 1bh5 s SER 20 Cb -0.11 -1.21 0.00 0.00 0.21 0.00 0.00 66.02 64.91 1bh5 s SER 20 CO -0.01 0.21 1.27 -1.81 0.41 0.00 0.00 173.24 173.32 1bh5 s ASP 21 N -2.01 4.50 0.11 2.44 1.01 -1.26 -4.89 116.67 116.56 1bh5 s ASP 21 Ca 0.23 2.56 -0.31 0.00 0.71 0.00 0.00 52.55 55.74 1bh5 s ASP 21 Cb -0.12 -2.61 -0.08 0.00 1.01 0.00 0.00 42.92 41.12 1bh5 s ASP 21 CO 0.15 -2.07 1.49 0.00 0.21 0.00 0.00 175.17 174.94 1bh5 s ALA 22 N -1.53 3.66 0.50 5.23 0.00 -1.26 -4.97 121.76 123.39 1bh5 s ALA 22 Ca 0.81 1.18 -0.23 0.00 0.00 0.00 0.00 51.96 53.72 1bh5 s ALA 22 Cb -0.36 -3.59 -0.06 0.00 0.00 0.00 0.00 23.12 19.11 1bh5 s ALA 22 CO 0.41 -0.78 1.31 0.34 0.00 0.00 0.00 175.76 177.05 1bh5 s ASP 23 N 1.41 5.67 0.61 0.00 2.15 -1.26 -4.88 116.67 120.38 1bh5 s ASP 23 Ca 0.68 2.66 0.36 0.00 0.43 0.00 0.00 52.55 56.68 1bh5 s ASP 23 Cb -0.39 -2.63 2.02 0.00 -0.30 0.00 0.00 42.92 41.63 1bh5 s ASP 23 CO 0.30 -1.29 2.27 -0.65 -0.17 0.00 0.00 175.17 175.64 1bh5 h PRO 24 N 1.84 0.00 0.00 4.34 0.11 -2.01 -0.06 132.00 136.22 1bh5 h PRO 24 Ca -0.50 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 1bh5 h PRO 24 Cb 1.28 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.39 1bh5 h PRO 24 CO 0.59 0.01 -0.01 0.66 -0.21 0.00 0.00 178.00 179.04 1bh5 h SER 25 N 0.00 0.00 -0.52 -2.05 4.64 -2.03 -2.37 113.55 111.22 1bh5 h SER 25 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1bh5 h SER 25 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1bh5 h SER 25 CO 0.00 0.01 0.00 0.35 -0.87 0.00 0.00 176.83 176.32 1bh5 n THR 26 N -3.12 0.81 -0.31 2.95 -2.24 -0.04 -4.67 114.28 107.67 1bh5 n THR 26 Ca -0.00 -0.73 0.14 0.00 -2.27 0.00 0.00 64.05 61.19 1bh5 n THR 26 Cb 0.26 0.29 0.29 0.00 -2.10 0.00 0.00 70.33 69.07 1bh5 n THR 26 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1bh5 h LYS 27 N 3.04 0.11 -0.32 -0.78 1.63 -1.49 -2.44 116.57 116.31 1bh5 h LYS 27 Ca 0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1bh5 h LYS 27 Cb 0.77 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.38 1bh5 h LYS 27 CO 0.03 0.07 0.00 -0.25 -3.45 0.00 0.00 179.45 175.85 1bh5 n ASP 28 N -5.33 3.06 -4.76 4.20 8.00 -1.26 -5.00 116.55 115.45 1bh5 n ASP 28 Ca 0.22 -2.17 -0.39 0.00 0.71 0.00 0.00 54.79 53.16 1bh5 n ASP 28 Cb 0.72 -0.28 0.03 0.00 -0.02 0.00 0.00 41.12 41.57 1bh5 n ASP 28 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1bh5 s PHE 29 N -1.30 2.39 0.04 1.24 0.40 -0.92 -5.02 117.98 114.81 1bh5 s PHE 29 Ca 0.26 1.30 0.01 0.00 -0.60 0.00 0.00 56.93 57.90 1bh5 s PHE 29 Cb 0.15 -3.89 -0.03 0.00 0.51 0.00 0.00 43.02 39.77 1bh5 s PHE 29 CO 0.14 -2.95 -0.06 -0.48 0.70 0.00 0.00 175.22 172.58 1bh5 s LEU 30 N -3.01 2.31 -0.76 -0.37 0.05 -1.26 -5.09 118.68 110.55 1bh5 s LEU 30 Ca 0.65 -0.64 -0.22 0.00 0.05 0.00 0.00 54.13 53.97 1bh5 s LEU 30 Cb -0.43 -0.05 0.08 0.00 -2.05 0.00 0.00 46.19 43.74 1bh5 s LEU 30 CO 0.53 -0.30 1.07 -0.22 -0.55 0.00 0.00 176.35 176.89 1bh5 s LEU 31 N -1.86 4.37 -0.00 1.48 2.96 -1.26 -4.87 118.68 119.50 1bh5 s LEU 31 Ca -0.07 -1.25 0.00 0.00 -0.22 0.00 0.00 54.13 52.59 1bh5 s LEU 31 Cb -0.06 -2.44 -0.26 0.00 0.50 0.00 0.00 46.19 43.92 1bh5 s LEU 31 CO -0.01 -1.39 0.83 -0.61 -1.32 0.00 0.00 176.35 173.85 1bh5 h GLN 32 N 9.45 0.19 -3.40 1.98 -0.00 -1.94 -2.98 115.11 118.40 1bh5 h GLN 32 Ca -0.13 -0.32 -0.04 0.00 -0.00 0.00 0.00 58.65 58.15 1bh5 h GLN 32 Cb 1.05 0.12 -0.11 0.00 0.00 0.00 0.00 27.48 28.54 1bh5 h GLN 32 CO 1.19 1.01 -0.05 -1.83 0.00 0.00 0.00 178.83 179.16 1bh5 s GLU 33 N -2.62 1.25 -0.08 1.69 -1.05 -1.26 -0.89 118.70 115.74 1bh5 s GLU 33 Ca -0.08 -0.85 0.01 0.00 -0.15 0.00 0.00 54.97 53.90 1bh5 s GLU 33 Cb 0.07 0.49 0.02 0.00 -0.44 0.00 0.00 34.13 34.27 1bh5 s GLU 33 CO 0.84 -0.51 -0.11 0.99 0.95 0.00 0.00 175.26 177.42 1bh5 s THR 34 N -3.86 1.09 -0.18 1.83 2.01 -0.71 -4.93 115.64 110.88 1bh5 s THR 34 Ca 0.08 -0.41 -0.05 0.00 0.31 0.00 0.00 61.69 61.62 1bh5 s THR 34 Cb 0.00 -1.03 -0.03 0.00 0.01 0.00 0.00 72.50 71.46 1bh5 s THR 34 CO -0.06 0.35 -0.00 -0.32 -0.69 0.00 0.00 174.62 173.90 1bh5 s MET 35 N 0.98 3.69 -0.02 4.92 1.75 -1.26 0.10 119.30 129.46 1bh5 s MET 35 Ca -0.09 -0.49 0.05 0.00 -1.25 0.00 0.00 55.69 53.91 1bh5 s MET 35 Cb -0.15 -3.04 -0.01 0.00 2.84 0.00 0.00 34.83 34.47 1bh5 s MET 35 CO 0.00 0.13 -0.16 -0.51 -0.65 0.00 0.00 175.02 173.83 1bh5 s LEU 36 N 0.68 1.99 0.00 4.11 1.43 -0.15 -4.98 118.68 121.76 1bh5 s LEU 36 Ca -0.00 -0.31 -0.24 0.00 -1.03 0.00 0.00 54.13 52.54 1bh5 s LEU 36 Cb -0.14 -0.87 -0.05 0.00 0.03 0.00 0.00 46.19 45.17 1bh5 s LEU 36 CO 0.02 0.19 0.75 -0.13 0.23 0.00 0.00 176.35 177.41 1bh5 s ARG 37 N -0.27 4.47 -0.04 1.70 0.52 -1.26 -1.03 118.95 123.04 1bh5 s ARG 37 Ca 0.04 1.01 0.06 0.00 -0.52 0.00 0.00 55.73 56.32 1bh5 s ARG 37 Cb -0.08 -3.40 -0.02 0.00 0.52 0.00 0.00 34.95 31.98 1bh5 s ARG 37 CO 0.00 0.19 -0.23 0.14 0.02 0.00 0.00 175.30 175.42 1bh5 s VAL 38 N 0.30 2.26 0.03 3.52 -7.23 0.06 -4.87 120.40 114.47 1bh5 s VAL 38 Ca 0.39 -1.02 -0.24 0.00 -1.81 0.00 0.00 61.98 59.30 1bh5 s VAL 38 Cb -0.19 -1.82 -0.17 0.00 0.56 0.00 0.00 36.38 34.76 1bh5 s VAL 38 CO 0.21 0.58 1.47 0.50 -0.31 0.00 0.00 175.10 177.55 1bh5 h LYS 39 N 5.65 0.06 -3.76 4.82 3.64 -1.94 -3.40 116.57 121.64 1bh5 h LYS 39 Ca -0.40 -0.02 -0.56 0.00 -1.27 0.00 0.00 60.65 58.40 1bh5 h LYS 39 Cb 1.14 -0.01 -0.40 0.00 -0.41 0.00 0.00 32.23 32.56 1bh5 h LYS 39 CO 0.48 0.33 -0.77 0.34 -2.27 0.00 0.00 179.45 177.56 1bh5 s ASP 40 N -5.54 3.56 0.43 4.20 -1.08 -1.26 -2.47 116.67 114.50 1bh5 s ASP 40 Ca -0.15 -1.22 0.10 0.00 -0.52 0.00 0.00 52.55 50.76 1bh5 s ASP 40 Cb 0.04 -0.84 0.92 0.00 -1.46 0.00 0.00 42.92 41.57 1bh5 s ASP 40 CO 0.68 -0.33 2.02 1.55 0.52 0.00 0.00 175.17 179.61 1bh5 h PRO 41 N 8.11 0.30 -0.32 4.34 0.13 -1.97 -2.17 132.00 140.41 1bh5 h PRO 41 Ca -0.15 -0.04 0.01 0.00 -0.87 0.00 0.00 66.00 64.95 1bh5 h PRO 41 Cb 1.07 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 1bh5 h PRO 41 CO 0.41 0.29 0.19 0.87 -0.23 0.00 0.00 178.00 179.52 1bh5 h LYS 42 N 0.30 0.39 -0.49 0.86 1.57 -1.99 0.11 116.57 117.30 1bh5 h LYS 42 Ca 0.07 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.77 1bh5 h LYS 42 Cb 0.13 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1bh5 h LYS 42 CO -0.00 0.26 0.07 0.87 -0.57 0.00 0.00 179.45 180.07 1bh5 h LYS 43 N 0.40 0.83 -0.28 3.15 1.57 -1.85 -2.42 116.57 117.96 1bh5 h LYS 43 Ca 0.13 -0.23 -0.13 0.00 -1.87 0.00 0.00 60.65 58.55 1bh5 h LYS 43 Cb -0.01 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.20 1bh5 h LYS 43 CO -0.05 0.83 -0.32 0.77 -0.57 0.00 0.00 179.45 180.11 1bh5 h SER 44 N 0.70 0.76 -0.41 0.86 0.02 -1.24 -1.44 113.55 112.80 1bh5 h SER 44 Ca 0.15 -0.48 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 1bh5 h SER 44 Cb 0.41 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 1bh5 h SER 44 CO 0.01 1.09 0.26 -0.07 -1.14 0.00 0.00 176.83 176.99 1bh5 h LEU 45 N 0.45 0.48 -0.28 5.07 3.38 -0.80 0.52 115.31 124.14 1bh5 h LEU 45 Ca 0.04 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1bh5 h LEU 45 Cb 0.89 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 1bh5 h LEU 45 CO 0.08 0.37 0.18 -0.78 0.09 0.00 0.00 178.44 178.38 1bh5 h ASP 46 N 0.55 0.32 0.31 -0.43 3.58 -1.31 -1.09 116.42 118.36 1bh5 h ASP 46 Ca 0.15 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.57 1bh5 h ASP 46 Cb -0.04 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 40.93 1bh5 h ASP 46 CO -0.03 0.24 -0.15 0.15 -2.88 0.00 0.00 179.24 176.57 1bh5 h PHE 47 N 0.38 -0.38 -0.48 0.28 3.57 -0.87 0.33 116.94 119.77 1bh5 h PHE 47 Ca 0.10 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.53 1bh5 h PHE 47 Cb -0.04 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 1bh5 h PHE 47 CO -0.06 -0.22 0.02 1.88 -2.23 0.00 0.00 178.31 177.71 1bh5 h TYR 48 N -0.44 0.83 0.02 0.41 0.05 -0.87 -0.73 116.97 116.24 1bh5 h TYR 48 Ca -0.04 -0.11 -0.16 0.00 0.05 0.00 0.00 58.73 58.47 1bh5 h TYR 48 Cb 0.33 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 37.82 1bh5 h TYR 48 CO -0.05 0.75 -0.89 1.79 -1.05 0.00 0.00 178.16 178.72 1bh5 h THR 49 N 0.74 1.21 -0.01 -2.88 1.35 -1.15 -1.59 112.91 110.57 1bh5 h THR 49 Ca 0.15 -2.26 -0.07 0.00 -0.55 0.00 0.00 66.41 63.68 1bh5 h THR 49 Cb 0.41 2.66 0.00 0.00 -1.73 0.00 0.00 68.15 69.50 1bh5 h THR 49 CO 0.01 0.46 -0.25 -0.09 -0.25 0.00 0.00 175.52 175.40 1bh5 h ARG 50 N -0.90 0.20 0.00 4.72 2.43 -0.42 -1.00 114.38 119.41 1bh5 h ARG 50 Ca -0.23 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 58.73 1bh5 h ARG 50 Cb 1.27 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 1bh5 h ARG 50 CO -0.11 0.90 -0.04 0.28 -1.51 0.00 0.00 179.97 179.49 1bh5 h VAL 51 N -0.43 1.70 0.00 0.20 2.07 -1.18 -3.38 116.25 115.23 1bh5 h VAL 51 Ca -0.03 -2.11 0.00 0.00 0.82 0.00 0.00 66.70 65.38 1bh5 h VAL 51 Cb 0.98 3.13 0.00 0.00 -1.52 0.00 0.00 31.29 33.88 1bh5 h VAL 51 CO 0.05 0.55 -0.89 0.18 0.02 0.00 0.00 177.57 177.48 1bh5 n LEU 52 N -4.63 0.65 -0.51 2.57 4.77 -0.96 -4.98 117.00 113.90 1bh5 n LEU 52 Ca -0.10 0.10 -0.05 0.00 -0.03 0.00 0.00 56.01 55.93 1bh5 n LEU 52 Cb 0.45 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 1bh5 n LEU 52 CO 0.35 -0.01 -0.06 0.61 -1.33 0.00 0.00 177.39 176.95 1bh5 n GLY 53 N 1.34 0.28 3.92 -0.72 0.00 -0.38 -4.97 105.19 104.66 1bh5 n GLY 53 Ca 0.02 -0.72 -0.26 0.00 0.00 0.00 0.00 46.02 45.06 1bh5 n GLY 53 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1bh5 s MET 54 N -3.91 2.27 -0.06 1.61 -1.94 -0.64 -4.91 119.30 111.73 1bh5 s MET 54 Ca 0.00 -0.15 0.06 0.00 -1.71 0.00 0.00 55.69 53.89 1bh5 s MET 54 Cb 0.00 -2.15 -0.01 0.00 2.01 0.00 0.00 34.83 34.68 1bh5 s MET 54 CO 0.00 -1.22 -0.25 0.99 -0.01 0.00 0.00 175.02 174.54 1bh5 s THR 55 N -3.27 2.03 -0.34 2.05 2.01 -0.27 -4.35 115.64 113.51 1bh5 s THR 55 Ca 0.60 -1.05 -0.29 0.00 0.31 0.00 0.00 61.69 61.26 1bh5 s THR 55 Cb -0.11 -1.72 -0.00 0.00 0.01 0.00 0.00 72.50 70.68 1bh5 s THR 55 CO 0.46 0.56 1.51 -0.22 -0.69 0.00 0.00 174.62 176.24 1bh5 s LEU 56 N -0.11 3.68 -0.01 4.42 2.96 -1.26 -1.80 118.68 126.56 1bh5 s LEU 56 Ca -0.05 1.15 0.18 0.00 -0.22 0.00 0.00 54.13 55.19 1bh5 s LEU 56 Cb -0.14 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 42.79 1bh5 s LEU 56 CO 0.04 -1.39 0.59 2.30 -1.32 0.00 0.00 176.35 176.57 1bh5 n ILE 57 N 6.86 0.00 -3.62 6.68 -5.35 0.67 -5.00 119.36 119.60 1bh5 n ILE 57 Ca 0.18 -0.23 -0.11 0.00 -0.27 0.00 0.00 62.75 62.32 1bh5 n ILE 57 Cb 0.47 0.60 -0.07 0.00 -1.74 0.00 0.00 39.64 38.91 1bh5 n ILE 57 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 1bh5 s GLN 58 N -2.90 0.62 -0.08 6.28 2.00 -1.20 -4.85 119.66 119.52 1bh5 s GLN 58 Ca 0.01 0.61 0.02 0.00 -2.00 0.00 0.00 55.36 54.00 1bh5 s GLN 58 Cb 0.12 0.30 0.01 0.00 0.80 0.00 0.00 33.01 34.25 1bh5 s GLN 58 CO 0.73 -0.10 -0.14 0.21 -0.50 0.00 0.00 175.29 175.49 1bh5 s LYS 59 N 0.01 1.95 -0.05 1.67 2.20 -1.26 -0.24 119.74 124.02 1bh5 s LYS 59 Ca 0.01 -0.49 0.03 0.00 -0.36 0.00 0.00 55.97 55.16 1bh5 s LYS 59 Cb -0.04 -1.60 0.00 0.00 -1.51 0.00 0.00 37.83 34.68 1bh5 s LYS 59 CO -0.03 0.02 -0.15 0.00 -0.36 0.00 0.00 175.35 174.83 1bh5 s ASP 61 N 0.28 3.35 -0.51 0.00 1.01 -1.26 -0.36 116.67 119.18 1bh5 s ASP 61 Ca -0.08 -0.41 0.03 0.00 0.71 0.00 0.00 52.55 52.80 1bh5 s ASP 61 Cb -0.13 -0.68 0.14 0.00 1.01 0.00 0.00 42.92 43.26 1bh5 s ASP 61 CO 0.03 0.30 0.29 -0.36 0.21 0.00 0.00 175.17 175.63 1bh5 s PHE 62 N -0.46 2.73 0.30 4.23 0.40 0.30 -5.00 117.98 120.47 1bh5 s PHE 62 Ca 0.05 -2.90 -0.01 0.00 -0.60 0.00 0.00 56.93 53.48 1bh5 s PHE 62 Cb -0.12 -2.40 0.45 0.00 0.51 0.00 0.00 43.02 41.46 1bh5 s PHE 62 CO 0.01 -0.73 1.89 -1.00 0.70 0.00 0.00 175.22 176.09 1bh5 h PRO 63 N 6.40 0.89 -0.27 0.24 0.13 -1.97 0.36 132.00 137.78 1bh5 h PRO 63 Ca -0.01 -0.13 -0.11 0.00 -0.87 0.00 0.00 66.00 64.88 1bh5 h PRO 63 Cb 0.89 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 31.85 1bh5 h PRO 63 CO 0.61 0.71 -0.28 0.82 -0.23 0.00 0.00 178.00 179.63 1bh5 h ILE 64 N 0.88 1.31 -0.00 -3.56 1.08 -1.96 -3.06 117.51 112.20 1bh5 h ILE 64 Ca 0.21 -1.44 0.00 0.00 -0.39 0.00 0.00 64.86 63.24 1bh5 h ILE 64 Cb 0.14 1.62 0.00 0.00 -3.07 0.00 0.00 36.82 35.51 1bh5 h ILE 64 CO -0.02 0.46 -0.06 0.23 -0.69 0.00 0.00 178.15 178.06 1bh5 n MET 65 N -4.29 0.24 -3.40 2.37 2.81 -1.08 -4.96 117.12 108.80 1bh5 n MET 65 Ca -0.04 -0.03 -0.18 0.00 -1.81 0.00 0.00 57.70 55.64 1bh5 n MET 65 Cb 0.46 -1.50 0.07 0.00 -0.71 0.00 0.00 33.22 31.55 1bh5 n MET 65 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1bh5 n LYS 66 N -1.35 -4.40 -3.64 0.03 5.02 0.12 -4.92 118.16 109.02 1bh5 n LYS 66 Ca 0.10 0.81 -0.13 0.00 -2.02 0.00 0.00 58.31 57.07 1bh5 n LYS 66 Cb 0.30 -5.68 -0.06 0.00 -0.02 0.00 0.00 35.03 29.57 1bh5 n LYS 66 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1bh5 s PHE 67 N -3.41 -0.31 0.20 2.13 -0.12 -0.94 -1.55 117.98 113.98 1bh5 s PHE 67 Ca 0.21 0.29 0.10 0.00 -0.05 0.00 0.00 56.93 57.48 1bh5 s PHE 67 Cb -0.03 0.25 -0.04 0.00 -0.63 0.00 0.00 43.02 42.56 1bh5 s PHE 67 CO 0.75 -0.59 -0.19 -1.12 -0.05 0.00 0.00 175.22 174.02 1bh5 s SER 68 N -1.98 2.97 -0.07 1.98 0.01 -0.29 -0.54 113.70 115.78 1bh5 s SER 68 Ca -0.05 -0.91 0.05 0.00 1.31 0.00 0.00 55.95 56.34 1bh5 s SER 68 Cb -0.01 -0.20 -0.00 0.00 0.21 0.00 0.00 66.02 66.02 1bh5 s SER 68 CO -0.02 -0.01 -0.22 -0.76 0.41 0.00 0.00 173.24 172.64 1bh5 s LEU 69 N -2.90 2.01 -0.15 2.44 1.43 0.51 -0.89 118.68 121.12 1bh5 s LEU 69 Ca 0.20 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 52.85 1bh5 s LEU 69 Cb -0.05 -1.25 0.01 0.00 0.03 0.00 0.00 46.19 44.93 1bh5 s LEU 69 CO 0.09 0.18 -0.20 -0.31 0.23 0.00 0.00 176.35 176.34 1bh5 s TYR 70 N 0.08 2.72 -0.24 0.29 1.51 0.54 -1.32 117.35 120.93 1bh5 s TYR 70 Ca -0.09 -1.37 -0.08 0.00 -1.01 0.00 0.00 57.07 54.53 1bh5 s TYR 70 Cb -0.15 -1.86 -0.03 0.00 -0.11 0.00 0.00 41.96 39.81 1bh5 s TYR 70 CO 0.05 -0.64 0.08 -0.06 -1.11 0.00 0.00 175.55 173.86 1bh5 s PHE 71 N 0.95 3.13 0.04 2.71 0.40 0.66 -0.77 117.98 125.11 1bh5 s PHE 71 Ca -0.03 -0.26 0.06 0.00 -0.60 0.00 0.00 56.93 56.10 1bh5 s PHE 71 Cb -0.15 -2.21 -0.03 0.00 0.51 0.00 0.00 43.02 41.14 1bh5 s PHE 71 CO -0.05 -0.22 -0.13 -0.51 0.70 0.00 0.00 175.22 175.01 1bh5 s LEU 72 N 1.34 2.85 0.15 -0.37 1.43 0.60 -0.24 118.68 124.45 1bh5 s LEU 72 Ca 0.05 -0.34 -0.24 0.00 -1.03 0.00 0.00 54.13 52.57 1bh5 s LEU 72 Cb -0.15 -1.66 0.07 0.00 0.03 0.00 0.00 46.19 44.48 1bh5 s LEU 72 CO 0.04 0.25 0.72 0.00 0.23 0.00 0.00 176.35 177.59 1bh5 s ALA 73 N -1.00 -1.58 -1.08 4.21 0.00 -0.74 0.48 121.76 122.05 1bh5 s ALA 73 Ca 0.17 0.41 -0.17 0.00 0.00 0.00 0.00 51.96 52.37 1bh5 s ALA 73 Cb -0.11 0.75 0.14 0.00 0.00 0.00 0.00 23.12 23.90 1bh5 s ALA 73 CO 0.08 -0.83 1.32 0.71 0.00 0.00 0.00 175.76 177.04 1bh5 s TYR 74 N -3.60 3.20 0.04 0.00 2.02 -1.26 -1.11 117.35 116.64 1bh5 s TYR 74 Ca 0.05 -1.67 0.02 0.00 -0.37 0.00 0.00 57.07 55.10 1bh5 s TYR 74 Cb -0.02 -4.36 -0.02 0.00 -0.40 0.00 0.00 41.96 37.15 1bh5 s TYR 74 CO -0.07 -1.51 -0.07 -1.21 -1.57 0.00 0.00 175.55 171.12 1bh5 s GLU 75 N 2.53 0.53 -0.07 -0.62 0.41 -1.26 -5.04 118.70 115.18 1bh5 s GLU 75 Ca 0.39 -0.78 -0.30 0.00 -0.41 0.00 0.00 54.97 53.88 1bh5 s GLU 75 Cb -0.03 -0.26 -0.03 0.00 -1.78 0.00 0.00 34.13 32.02 1bh5 s GLU 75 CO -0.04 0.04 1.28 0.34 -0.49 0.00 0.00 175.26 176.39 1bh5 s ASP 76 N -1.64 6.96 0.23 -0.19 -1.08 -1.26 -4.72 116.67 114.96 1bh5 s ASP 76 Ca -0.09 1.88 0.17 0.00 -0.52 0.00 0.00 52.55 53.99 1bh5 s ASP 76 Cb -0.09 -2.55 0.87 0.00 -1.46 0.00 0.00 42.92 39.69 1bh5 s ASP 76 CO 0.00 -0.67 1.52 2.29 0.52 0.00 0.00 175.17 178.83 1bh5 n LYS 77 N 5.64 0.11 0.00 4.34 2.85 -1.26 -0.90 118.16 128.94 1bh5 n LYS 77 Ca 0.12 0.56 0.14 0.00 -1.05 0.00 0.00 58.31 58.08 1bh5 n LYS 77 Cb 0.45 -1.83 0.63 0.00 -0.65 0.00 0.00 35.03 33.63 1bh5 n LYS 77 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1bh5 n ASN 78 N -2.06 0.00 0.01 -5.58 3.02 -1.26 -2.78 115.26 106.60 1bh5 n ASN 78 Ca -0.00 0.45 0.12 0.00 -0.03 0.00 0.00 54.58 55.11 1bh5 n ASN 78 Cb 0.06 -0.48 0.25 0.00 -0.61 0.00 0.00 39.78 39.00 1bh5 n ASN 78 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1bh5 n ASP 79 N -1.48 0.50 -4.61 6.41 8.00 -0.08 -4.83 116.55 120.47 1bh5 n ASP 79 Ca 0.08 -0.18 -0.43 0.00 0.71 0.00 0.00 54.79 54.97 1bh5 n ASP 79 Cb 0.33 0.22 -0.02 0.00 -0.02 0.00 0.00 41.12 41.63 1bh5 n ASP 79 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1bh5 s ILE 80 N -3.02 3.83 0.73 0.53 1.01 -1.12 -4.97 121.20 118.18 1bh5 s ILE 80 Ca 0.10 0.86 -0.16 0.00 0.00 0.00 0.00 60.65 61.46 1bh5 s ILE 80 Cb 0.17 -4.04 -0.01 0.00 0.01 0.00 0.00 42.46 38.59 1bh5 s ILE 80 CO 0.70 -0.61 0.74 -2.65 0.00 0.00 0.00 174.94 173.12 1bh5 n PRO 81 N 8.01 0.37 -0.01 2.79 -0.02 -1.26 -4.94 135.00 139.94 1bh5 n PRO 81 Ca 0.18 0.17 -0.07 0.00 -2.02 0.00 0.00 63.50 61.76 1bh5 n PRO 81 Cb 0.47 -2.02 -0.13 0.00 -0.02 0.00 0.00 33.50 31.81 1bh5 n PRO 81 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1bh5 h LYS 82 N -0.37 0.00 -6.46 -0.52 1.79 -1.96 -3.42 116.57 105.63 1bh5 h LYS 82 Ca -0.46 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.47 1bh5 h LYS 82 Cb 1.34 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.98 1bh5 h LYS 82 CO 0.44 0.49 0.44 -1.83 -1.08 0.00 0.00 179.45 177.91 1bh5 s GLU 83 N -2.66 4.52 0.15 3.15 4.04 -1.26 -4.89 118.70 121.75 1bh5 s GLU 83 Ca -0.04 1.57 -0.31 0.00 0.04 0.00 0.00 54.97 56.23 1bh5 s GLU 83 Cb 0.08 -3.40 -0.07 0.00 0.02 0.00 0.00 34.13 30.75 1bh5 s GLU 83 CO 0.82 -0.10 1.53 -0.22 -1.84 0.00 0.00 175.26 175.45 1bh5 h LYS 84 N 6.63 -0.06 -0.73 -4.83 3.64 -1.99 0.40 116.57 119.63 1bh5 h LYS 84 Ca -0.42 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 58.92 1bh5 h LYS 84 Cb 1.22 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.02 1bh5 h LYS 84 CO 0.77 -0.04 0.24 -0.44 -2.27 0.00 0.00 179.45 177.71 1bh5 h ASP 85 N -0.06 1.04 -0.59 4.20 3.32 -1.99 -1.62 116.42 120.72 1bh5 h ASP 85 Ca 0.14 -0.18 -0.10 0.00 0.02 0.00 0.00 57.03 56.91 1bh5 h ASP 85 Cb 0.43 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 1bh5 h ASP 85 CO -0.87 0.95 -0.03 -0.33 -1.72 0.00 0.00 179.24 177.25 1bh5 h GLU 86 N 1.08 1.07 -0.17 3.56 5.08 -1.68 -2.26 114.58 121.24 1bh5 h GLU 86 Ca 0.24 -0.35 0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1bh5 h GLU 86 Cb 0.28 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1bh5 h GLU 86 CO -0.01 1.06 0.09 -0.22 -1.00 0.00 0.00 179.01 178.92 1bh5 h LYS 87 N 0.97 0.19 -0.65 2.33 3.64 0.31 -1.45 116.57 121.90 1bh5 h LYS 87 Ca 0.17 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1bh5 h LYS 87 Cb 0.59 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.34 1bh5 h LYS 87 CO 0.04 0.12 0.41 0.82 -2.27 0.00 0.00 179.45 178.57 1bh5 h ILE 88 N 0.19 1.18 -0.74 2.00 2.04 -1.23 0.68 117.51 121.63 1bh5 h ILE 88 Ca 0.07 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 1bh5 h ILE 88 Cb 0.01 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.30 1bh5 h ILE 88 CO -0.04 0.18 0.34 0.00 0.00 0.00 0.00 178.15 178.63 1bh5 h ALA 89 N 1.22 1.21 -0.04 1.87 0.00 -1.23 -1.04 119.26 121.25 1bh5 h ALA 89 Ca 0.24 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1bh5 h ALA 89 Cb -0.06 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.44 1bh5 h ALA 89 CO -0.05 0.60 -0.36 2.35 0.00 0.00 0.00 179.25 181.79 1bh5 h TRP 90 N 1.06 0.44 -0.22 0.00 7.01 -0.63 -2.82 115.95 120.78 1bh5 h TRP 90 Ca 0.25 -0.21 -0.04 0.00 2.11 0.00 0.00 58.89 61.01 1bh5 h TRP 90 Cb 0.12 -0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.11 1bh5 h TRP 90 CO 0.01 0.98 -0.02 0.00 -2.79 0.00 0.00 178.44 176.62 1bh5 h ALA 91 N 0.37 1.55 -0.11 2.65 0.00 0.45 -1.81 119.26 122.37 1bh5 h ALA 91 Ca -0.03 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1bh5 h ALA 91 Cb 1.04 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1bh5 h ALA 91 CO 0.07 0.33 0.00 1.28 0.00 0.00 0.00 179.25 180.93 1bh5 n LEU 92 N -4.33 1.72 -1.00 0.00 4.77 -0.40 -3.96 117.00 113.79 1bh5 n LEU 92 Ca 0.00 -0.66 -0.02 0.00 -0.03 0.00 0.00 56.01 55.31 1bh5 n LEU 92 Cb 0.21 -0.06 0.20 0.00 -2.33 0.00 0.00 43.42 41.43 1bh5 n LEU 92 CO 0.37 0.33 0.56 -1.54 -1.33 0.00 0.00 177.39 175.78 1bh5 n SER 93 N 0.34 2.29 -4.88 -1.43 3.41 -0.68 -5.00 113.62 107.67 1bh5 n SER 93 Ca 0.17 -3.84 -0.36 0.00 -0.26 0.00 0.00 58.87 54.59 1bh5 n SER 93 Cb 0.36 -0.59 -0.06 0.00 -0.26 0.00 0.00 64.21 63.66 1bh5 n SER 93 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1bh5 s ARG 94 N -3.27 3.49 0.52 4.33 1.81 -1.23 -5.04 118.95 119.57 1bh5 s ARG 94 Ca 0.43 -0.14 -0.20 0.00 -1.72 0.00 0.00 55.73 54.09 1bh5 s ARG 94 Cb 0.40 -3.15 -0.06 0.00 -0.45 0.00 0.00 34.95 31.69 1bh5 s ARG 94 CO -0.03 0.73 1.16 0.15 -0.68 0.00 0.00 175.30 176.62 1bh5 s LYS 95 N -1.38 3.43 -1.07 3.54 1.02 -1.26 -4.18 119.74 119.84 1bh5 s LYS 95 Ca 0.21 1.70 -0.15 0.00 0.02 0.00 0.00 55.97 57.75 1bh5 s LYS 95 Cb -0.13 -2.13 -0.02 0.00 -0.52 0.00 0.00 37.83 35.04 1bh5 s LYS 95 CO 0.10 -0.81 0.80 0.00 -0.92 0.00 0.00 175.35 174.53 1bh5 n ALA 96 N -1.08 -2.55 -2.73 5.17 0.00 -1.13 -4.95 120.51 113.25 1bh5 n ALA 96 Ca 0.10 -0.15 -0.25 0.00 0.00 0.00 0.00 53.44 53.15 1bh5 n ALA 96 Cb 0.50 -4.08 -0.06 0.00 0.00 0.00 0.00 19.45 15.80 1bh5 n ALA 96 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1bh5 s THR 97 N -3.38 4.02 -0.22 0.00 -4.23 -0.07 -4.64 115.64 107.11 1bh5 s THR 97 Ca 0.41 -1.42 -0.04 0.00 -1.18 0.00 0.00 61.69 59.47 1bh5 s THR 97 Cb -0.13 -3.08 -0.01 0.00 1.34 0.00 0.00 72.50 70.62 1bh5 s THR 97 CO 0.83 -0.20 -0.04 -0.22 -0.54 0.00 0.00 174.62 174.44 1bh5 s LEU 98 N -3.30 2.92 -0.23 4.79 2.96 0.18 -1.74 118.68 124.26 1bh5 s LEU 98 Ca 0.30 -0.42 -0.08 0.00 -0.22 0.00 0.00 54.13 53.71 1bh5 s LEU 98 Cb -0.09 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.83 1bh5 s LEU 98 CO 0.21 -0.03 0.08 -0.70 -1.32 0.00 0.00 176.35 174.59 1bh5 s GLU 99 N 1.47 3.78 -0.20 1.98 2.12 0.12 -0.29 118.70 127.68 1bh5 s GLU 99 Ca 0.05 -0.42 -0.08 0.00 0.36 0.00 0.00 54.97 54.89 1bh5 s GLU 99 Cb -0.14 -3.32 -0.04 0.00 0.26 0.00 0.00 34.13 30.89 1bh5 s GLU 99 CO -0.03 -0.04 0.07 -0.51 -0.54 0.00 0.00 175.26 174.21 1bh5 s LEU 100 N 1.23 3.78 -0.25 2.70 1.43 0.05 -0.98 118.68 126.64 1bh5 s LEU 100 Ca 0.05 0.04 -0.09 0.00 -1.03 0.00 0.00 54.13 53.10 1bh5 s LEU 100 Cb -0.14 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 1bh5 s LEU 100 CO 0.04 0.13 0.12 -0.89 0.23 0.00 0.00 176.35 175.98 1bh5 s THR 101 N 0.62 4.85 -0.28 5.49 2.01 -0.20 -0.34 115.64 127.80 1bh5 s THR 101 Ca 0.04 0.01 -0.08 0.00 0.31 0.00 0.00 61.69 61.97 1bh5 s THR 101 Cb -0.13 -3.28 -0.01 0.00 0.01 0.00 0.00 72.50 69.10 1bh5 s THR 101 CO 0.01 0.32 0.09 -2.28 -0.69 0.00 0.00 174.62 172.08 1bh5 s HIS 102 N 1.45 3.13 -0.31 4.92 5.04 -0.07 -0.76 115.29 128.69 1bh5 s HIS 102 Ca 0.06 -0.69 -0.21 0.00 -1.54 0.00 0.00 55.06 52.68 1bh5 s HIS 102 Cb -0.15 -2.27 -0.01 0.00 0.04 0.00 0.00 32.58 30.19 1bh5 s HIS 102 CO 0.06 -0.47 0.68 -0.80 -2.34 0.00 0.00 174.74 171.87 1bh5 s ASN 103 N 1.57 6.54 0.19 9.88 0.01 -1.26 -1.14 114.94 130.73 1bh5 s ASN 103 Ca 0.04 0.48 -0.32 0.00 -0.71 0.00 0.00 52.86 52.35 1bh5 s ASN 103 Cb -0.16 -2.35 -0.15 0.00 0.41 0.00 0.00 41.25 38.99 1bh5 s ASN 103 CO 0.04 -0.53 1.24 0.79 -1.51 0.00 0.00 177.10 177.12 1bh5 n TRP 104 N 5.99 1.56 0.00 2.20 7.02 -0.60 -2.57 117.44 131.05 1bh5 n TRP 104 Ca 0.00 0.60 0.00 0.00 -1.02 0.00 0.00 57.50 57.09 1bh5 n TRP 104 Cb 0.49 -2.33 0.00 0.00 -2.42 0.00 0.00 31.31 27.04 1bh5 n TRP 104 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1bh5 n GLY 105 N 2.06 3.09 0.27 6.99 0.00 -1.26 -4.94 105.19 111.40 1bh5 n GLY 105 Ca 0.14 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.25 1bh5 n GLY 105 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1bh5 h THR 106 N 0.00 0.95 0.00 2.61 1.35 -1.72 -1.94 112.91 114.16 1bh5 h THR 106 Ca 0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 65.84 1bh5 h THR 106 Cb 0.00 0.97 -0.00 0.00 -1.73 0.00 0.00 68.15 67.39 1bh5 h THR 106 CO 0.00 0.00 -0.10 1.05 -0.25 0.00 0.00 175.52 176.22 1bh5 h GLU 107 N 0.00 0.00 0.00 4.72 9.09 -1.77 -2.37 114.58 124.25 1bh5 h GLU 107 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.44 1bh5 h GLU 107 Cb 0.11 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.21 1bh5 h GLU 107 CO -0.00 0.10 -0.71 -0.25 0.05 0.00 0.00 179.01 178.20 1bh5 n ASP 108 N -4.14 0.61 -4.39 3.06 8.00 -0.74 -4.76 116.55 114.21 1bh5 n ASP 108 Ca -0.03 -0.26 -0.45 0.00 0.71 0.00 0.00 54.79 54.76 1bh5 n ASP 108 Cb 0.18 0.46 -0.01 0.00 -0.02 0.00 0.00 41.12 41.73 1bh5 n ASP 108 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1bh5 s ASP 109 N -3.44 6.90 0.60 -2.24 -1.08 -0.89 -4.92 116.67 111.60 1bh5 s ASP 109 Ca 0.08 -2.76 0.28 0.00 -0.52 0.00 0.00 52.55 49.62 1bh5 s ASP 109 Cb 0.16 -2.29 1.26 0.00 -1.46 0.00 0.00 42.92 40.59 1bh5 s ASP 109 CO 0.75 -0.67 1.66 -0.33 0.52 0.00 0.00 175.17 177.10 1bh5 h GLU 110 N 7.72 0.00 0.00 4.34 4.39 -1.85 0.20 114.58 129.37 1bh5 h GLU 110 Ca 0.17 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.87 1bh5 h GLU 110 Cb 0.97 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.62 1bh5 h GLU 110 CO 0.99 0.00 -0.41 1.79 -1.16 0.00 0.00 179.01 180.21 1bh5 h THR 111 N 0.00 0.00 -3.94 1.13 1.35 -1.94 -3.46 112.91 106.05 1bh5 h THR 111 Ca 0.31 -0.77 -0.46 0.00 -0.55 0.00 0.00 66.41 64.93 1bh5 h THR 111 Cb 1.83 1.54 -0.01 0.00 -1.73 0.00 0.00 68.15 69.78 1bh5 h THR 111 CO -0.00 0.00 0.35 -1.58 -0.25 0.00 0.00 175.52 174.04 1bh5 s GLN 112 N -3.22 4.44 -0.11 4.72 -0.44 0.69 -5.07 119.66 120.68 1bh5 s GLN 112 Ca 0.06 1.31 -0.30 0.00 -2.50 0.00 0.00 55.36 53.92 1bh5 s GLN 112 Cb 0.10 -2.62 0.10 0.00 -1.64 0.00 0.00 33.01 28.95 1bh5 s GLN 112 CO 0.70 0.15 0.84 -1.54 0.50 0.00 0.00 175.29 175.93 1bh5 s SER 113 N -1.74 -0.52 0.48 6.67 1.04 -1.26 -4.97 113.70 113.40 1bh5 s SER 113 Ca 0.54 0.57 -0.04 0.00 0.48 0.00 0.00 55.95 57.50 1bh5 s SER 113 Cb -0.17 0.44 -0.03 0.00 0.10 0.00 0.00 66.02 66.36 1bh5 s SER 113 CO 0.22 -0.47 0.77 -0.31 0.98 0.00 0.00 173.24 174.42 1bh5 s TYR 114 N -1.12 3.48 -0.16 5.02 2.02 -1.26 -5.08 117.35 120.24 1bh5 s TYR 114 Ca -0.06 0.68 -0.09 0.00 -0.37 0.00 0.00 57.07 57.22 1bh5 s TYR 114 Cb -0.00 -2.33 -0.05 0.00 -0.40 0.00 0.00 41.96 39.18 1bh5 s TYR 114 CO 0.06 -0.33 0.16 -1.58 -1.57 0.00 0.00 175.55 172.28 1bh5 s HIS 115 N -2.72 3.49 -1.47 2.71 5.65 -1.26 -4.99 115.29 116.70 1bh5 s HIS 115 Ca 0.48 0.44 0.27 0.00 0.25 0.00 0.00 55.06 56.49 1bh5 s HIS 115 Cb -0.10 -2.11 0.85 0.00 -1.18 0.00 0.00 32.58 30.04 1bh5 s HIS 115 CO 0.43 0.45 1.63 0.27 -0.65 0.00 0.00 174.74 176.87 1bh5 n ASN 116 N 2.96 0.66 0.00 9.88 0.23 -1.26 -4.94 115.26 122.79 1bh5 n ASN 116 Ca -0.17 -0.53 0.00 0.00 -0.53 0.00 0.00 54.58 53.35 1bh5 n ASN 116 Cb 0.53 0.06 0.00 0.00 -2.08 0.00 0.00 39.78 38.29 1bh5 n ASN 116 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1bh5 n GLY 117 N 1.38 1.02 1.61 4.83 0.00 -1.26 -4.67 105.19 108.09 1bh5 n GLY 117 Ca 0.11 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.20 1bh5 n GLY 117 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bh5 n ASN 118 N 0.00 5.21 -3.73 1.61 3.02 -1.26 -2.90 115.26 117.21 1bh5 n ASN 118 Ca 0.00 -2.94 -0.11 0.00 -0.03 0.00 0.00 54.58 51.50 1bh5 n ASN 118 Cb 0.00 -0.64 -0.06 0.00 -0.61 0.00 0.00 39.78 38.46 1bh5 n ASN 118 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1bh5 s SER 119 N -1.11 -0.13 0.28 6.41 1.04 -1.26 -5.00 113.70 113.93 1bh5 s SER 119 Ca 0.51 -0.29 -0.30 0.00 0.48 0.00 0.00 55.95 56.35 1bh5 s SER 119 Cb 0.39 0.40 -0.13 0.00 0.10 0.00 0.00 66.02 66.78 1bh5 s SER 119 CO 0.14 -0.71 1.33 0.47 0.98 0.00 0.00 173.24 175.45 1bh5 n ASP 120 N 0.22 2.63 -4.73 7.02 8.00 -1.26 -2.75 116.55 125.68 1bh5 n ASP 120 Ca -0.17 1.17 -0.38 0.00 0.71 0.00 0.00 54.79 56.11 1bh5 n ASP 120 Cb 0.61 -1.43 -0.06 0.00 -0.02 0.00 0.00 41.12 40.22 1bh5 n ASP 120 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1bh5 s PRO 121 N -1.02 4.35 0.71 -0.24 0.04 -1.26 -5.08 135.00 132.50 1bh5 s PRO 121 Ca 0.63 0.54 -0.11 0.00 0.04 0.00 0.00 61.00 62.10 1bh5 s PRO 121 Cb -0.63 -3.43 0.03 0.00 0.04 0.00 0.00 34.50 30.51 1bh5 s PRO 121 CO 0.55 0.17 1.10 1.03 0.04 0.00 0.00 177.00 179.88 1bh5 s ARG 122 N 0.56 2.71 0.00 4.56 0.52 -1.11 -4.73 118.95 121.45 1bh5 s ARG 122 Ca 0.28 0.36 0.00 0.00 -0.52 0.00 0.00 55.73 55.85 1bh5 s ARG 122 Cb -0.16 -2.03 0.00 0.00 0.52 0.00 0.00 34.95 33.28 1bh5 s ARG 122 CO 0.12 -1.11 0.00 0.41 0.02 0.00 0.00 175.30 174.74 1bh5 n GLY 123 N -3.03 -1.40 3.60 -3.53 0.00 -1.14 -5.05 105.19 94.64 1bh5 n GLY 123 Ca 0.07 0.73 -0.40 0.00 0.00 0.00 0.00 46.02 46.42 1bh5 n GLY 123 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1bh5 n PHE 124 N 0.00 0.86 -0.03 1.61 7.35 -1.26 -4.96 117.46 121.03 1bh5 n PHE 124 Ca 0.00 0.50 -0.07 0.00 -0.76 0.00 0.00 57.45 57.12 1bh5 n PHE 124 Cb 0.00 -2.17 -0.02 0.00 0.35 0.00 0.00 39.48 37.64 1bh5 n PHE 124 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1bh5 n GLY 125 N 1.28 -0.19 3.68 7.13 0.00 -1.26 -4.34 105.19 111.48 1bh5 n GLY 125 Ca 0.11 -0.09 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 1bh5 n GLY 125 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1bh5 s HIS 126 N -2.26 -0.14 0.31 1.61 -3.43 -1.26 -4.28 115.29 105.84 1bh5 s HIS 126 Ca -0.13 -0.08 0.07 0.00 -0.80 0.00 0.00 55.06 54.13 1bh5 s HIS 126 Cb 0.04 0.60 -0.03 0.00 -1.43 0.00 0.00 32.58 31.75 1bh5 s HIS 126 CO 0.17 -0.63 0.25 0.96 -2.00 0.00 0.00 174.74 173.50 1bh5 s ILE 127 N -3.02 3.75 -0.02 -5.38 -4.36 -1.00 -4.96 121.20 106.21 1bh5 s ILE 127 Ca 0.11 -1.41 -0.02 0.00 -0.26 0.00 0.00 60.65 59.08 1bh5 s ILE 127 Cb 0.00 -3.23 0.00 0.00 1.25 0.00 0.00 42.46 40.49 1bh5 s ILE 127 CO -0.01 -0.22 0.06 -0.83 0.24 0.00 0.00 174.94 174.18 1bh5 s GLY 128 N -3.94 -0.03 -0.05 6.27 0.00 -1.26 -0.32 107.32 108.00 1bh5 s GLY 128 Ca 0.38 0.12 0.04 0.00 0.00 0.00 0.00 44.72 45.26 1bh5 s GLY 128 CO 0.26 0.09 -0.14 -0.42 0.00 0.00 0.00 173.10 172.88 1bh5 s ILE 129 N -0.12 3.05 -0.21 0.90 -1.09 0.64 -4.91 121.20 119.46 1bh5 s ILE 129 Ca -0.02 -0.73 -0.08 0.00 -2.23 0.00 0.00 60.65 57.59 1bh5 s ILE 129 Cb -0.01 -2.19 -0.04 0.00 -1.58 0.00 0.00 42.46 38.63 1bh5 s ILE 129 CO 0.00 0.59 0.09 0.00 -1.23 0.00 0.00 174.94 174.38 1bh5 s ALA 130 N -0.73 3.39 0.27 9.38 0.00 -1.26 -2.04 121.76 130.76 1bh5 s ALA 130 Ca 0.12 -0.87 0.08 0.00 0.00 0.00 0.00 51.96 51.29 1bh5 s ALA 130 Cb -0.11 -2.04 -0.05 0.00 0.00 0.00 0.00 23.12 20.91 1bh5 s ALA 130 CO 0.01 -0.06 -0.10 0.14 0.00 0.00 0.00 175.76 175.75 1bh5 s VAL 131 N 0.81 1.83 0.00 0.00 -7.23 0.32 -4.95 120.40 111.18 1bh5 s VAL 131 Ca 0.04 -2.19 0.20 0.00 -1.81 0.00 0.00 61.98 58.23 1bh5 s VAL 131 Cb -0.13 -2.35 0.17 0.00 0.56 0.00 0.00 36.38 34.62 1bh5 s VAL 131 CO 0.02 -0.37 1.67 -0.65 -0.31 0.00 0.00 175.10 175.46 1bh5 h PRO 132 N 2.32 0.00 -1.46 4.82 0.11 -1.99 -3.36 132.00 132.45 1bh5 h PRO 132 Ca -0.40 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.65 1bh5 h PRO 132 Cb 1.24 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 32.09 1bh5 h PRO 132 CO 0.65 0.32 -0.42 0.34 -0.21 0.00 0.00 178.00 178.68 1bh5 s ASP 133 N -6.31 -0.47 0.18 -2.05 -1.08 -1.26 -4.99 116.67 100.69 1bh5 s ASP 133 Ca 0.02 0.24 -0.11 0.00 -0.52 0.00 0.00 52.55 52.18 1bh5 s ASP 133 Cb 0.09 1.55 0.08 0.00 -1.46 0.00 0.00 42.92 43.17 1bh5 s ASP 133 CO 0.68 -0.30 1.69 0.58 0.52 0.00 0.00 175.17 178.34 1bh5 h VAL 134 N 6.10 1.25 -0.29 1.11 2.07 -1.90 -1.59 116.25 123.00 1bh5 h VAL 134 Ca -0.14 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.43 1bh5 h VAL 134 Cb 1.15 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1bh5 h VAL 134 CO 0.25 0.34 0.00 1.88 0.02 0.00 0.00 177.57 180.06 1bh5 h TYR 135 N 0.90 0.55 -0.19 1.57 0.05 -1.96 0.63 116.97 118.52 1bh5 h TYR 135 Ca 0.20 -0.09 -0.14 0.00 0.05 0.00 0.00 58.73 58.74 1bh5 h TYR 135 Cb 0.34 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 37.92 1bh5 h TYR 135 CO 0.02 0.64 -0.48 0.66 -1.05 0.00 0.00 178.16 177.95 1bh5 h SER 136 N 0.29 0.53 -0.49 3.88 4.64 -1.99 -1.64 113.55 118.78 1bh5 h SER 136 Ca 0.08 -0.26 0.02 0.00 -0.47 0.00 0.00 61.79 61.16 1bh5 h SER 136 Cb 0.42 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 1bh5 h SER 136 CO 0.01 0.93 0.30 0.00 -0.87 0.00 0.00 176.83 177.21 1bh5 h ALA 137 N 1.09 0.62 -0.01 5.18 0.00 -1.08 -2.27 119.26 122.79 1bh5 h ALA 137 Ca 0.02 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1bh5 h ALA 137 Cb 0.99 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1bh5 h ALA 137 CO 0.09 0.01 -0.70 0.00 0.00 0.00 0.00 179.25 178.65 1bh5 h LYS 139 N 0.04 0.67 -0.51 0.00 3.64 -1.03 -0.58 116.57 118.81 1bh5 h LYS 139 Ca -0.01 -0.14 -0.06 0.00 -1.27 0.00 0.00 60.65 59.17 1bh5 h LYS 139 Cb 1.23 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.94 1bh5 h LYS 139 CO 0.10 0.65 0.10 -0.09 -2.27 0.00 0.00 179.45 177.93 1bh5 h ARG 140 N 0.56 0.83 -0.61 1.90 2.43 -1.24 -1.69 114.38 116.56 1bh5 h ARG 140 Ca 0.14 -0.22 0.08 0.00 -0.81 0.00 0.00 59.98 59.17 1bh5 h ARG 140 Cb 0.26 -0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 29.64 1bh5 h ARG 140 CO -0.00 0.82 0.28 0.74 -1.51 0.00 0.00 179.97 180.29 1bh5 h PHE 141 N 0.72 0.50 -0.57 2.20 0.04 -1.08 0.43 116.94 119.17 1bh5 h PHE 141 Ca 0.16 0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.89 1bh5 h PHE 141 Cb 0.38 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.37 1bh5 h PHE 141 CO 0.03 0.19 0.10 0.93 -0.60 0.00 0.00 178.31 178.95 1bh5 h GLU 142 N 0.51 0.95 -0.32 1.51 5.08 -0.74 -0.41 114.58 121.16 1bh5 h GLU 142 Ca 0.29 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1bh5 h GLU 142 Cb 0.29 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1bh5 h GLU 142 CO -0.24 0.90 0.03 0.93 -1.00 0.00 0.00 179.01 179.63 1bh5 h GLU 143 N 0.84 0.47 -0.00 2.33 5.08 -0.72 -2.61 114.58 119.98 1bh5 h GLU 143 Ca 0.17 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1bh5 h GLU 143 Cb 0.41 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1bh5 h GLU 143 CO 0.01 0.47 -0.04 1.28 -1.00 0.00 0.00 179.01 179.74 1bh5 n LEU 144 N -4.32 0.22 0.00 1.33 4.77 0.09 -4.91 117.00 114.17 1bh5 n LEU 144 Ca 0.01 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 1bh5 n LEU 144 Cb 0.21 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1bh5 n LEU 144 CO 0.38 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1bh5 n GLY 145 N 1.21 0.54 3.75 -0.72 0.00 -0.85 -5.02 105.19 104.11 1bh5 n GLY 145 Ca 0.17 -0.85 -0.40 0.00 0.00 0.00 0.00 46.02 44.93 1bh5 n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bh5 s VAL 146 N -2.00 3.65 0.06 1.61 1.01 -0.22 -5.00 120.40 119.51 1bh5 s VAL 146 Ca 0.00 1.62 -0.30 0.00 0.00 0.00 0.00 61.98 63.30 1bh5 s VAL 146 Cb 0.00 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 1bh5 s VAL 146 CO 0.00 0.37 1.00 -0.75 0.00 0.00 0.00 175.10 175.72 1bh5 s LYS 147 N -1.23 4.60 -0.06 2.72 2.20 -1.26 -4.68 119.74 122.03 1bh5 s LYS 147 Ca 0.45 1.49 0.01 0.00 -0.36 0.00 0.00 55.97 57.55 1bh5 s LYS 147 Cb -0.30 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.58 1bh5 s LYS 147 CO 0.38 0.03 -0.06 -0.06 -0.36 0.00 0.00 175.35 175.29 1bh5 s PHE 148 N 0.55 2.97 -0.18 4.03 0.40 -1.26 -0.42 117.98 124.07 1bh5 s PHE 148 Ca 0.51 0.05 -0.00 0.00 -0.60 0.00 0.00 56.93 56.88 1bh5 s PHE 148 Cb -0.23 -1.72 -0.22 0.00 0.51 0.00 0.00 43.02 41.36 1bh5 s PHE 148 CO 0.29 0.36 0.10 0.28 0.70 0.00 0.00 175.22 176.95 1bh5 n VAL 149 N 2.14 1.62 -3.69 -0.44 0.31 0.17 -4.90 118.33 113.55 1bh5 n VAL 149 Ca -0.18 -0.64 -0.17 0.00 -0.01 0.00 0.00 64.34 63.35 1bh5 n VAL 149 Cb 0.53 -1.49 -0.16 0.00 -0.91 0.00 0.00 33.84 31.81 1bh5 n VAL 149 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1bh5 s LYS 150 N -2.54 -0.00 0.40 5.55 2.20 -0.24 -4.92 119.74 120.19 1bh5 s LYS 150 Ca -0.26 0.42 -0.20 0.00 -0.36 0.00 0.00 55.97 55.57 1bh5 s LYS 150 Cb 0.08 -0.33 -0.11 0.00 -1.51 0.00 0.00 37.83 35.96 1bh5 s LYS 150 CO 0.70 -0.27 0.90 0.15 -0.36 0.00 0.00 175.35 176.47 1bh5 s LYS 151 N 1.91 4.19 0.26 4.03 1.02 -1.26 -0.90 119.74 128.98 1bh5 s LYS 151 Ca 0.00 1.02 -0.07 0.00 0.02 0.00 0.00 55.97 56.95 1bh5 s LYS 151 Cb -0.12 -2.24 0.47 0.00 -0.52 0.00 0.00 37.83 35.41 1bh5 s LYS 151 CO -0.05 0.02 1.61 -1.35 -0.92 0.00 0.00 175.35 174.66 1bh5 h PRO 152 N 2.01 0.05 -0.66 -1.68 0.10 -1.94 -1.72 132.00 128.15 1bh5 h PRO 152 Ca -0.49 -0.00 -0.04 0.00 0.10 0.00 0.00 66.00 65.57 1bh5 h PRO 152 Cb 1.18 -0.01 -0.03 0.00 0.10 0.00 0.00 31.00 32.24 1bh5 h PRO 152 CO 0.62 0.03 0.05 -0.25 0.10 0.00 0.00 178.00 178.55 1bh5 n ASP 153 N -5.45 5.17 -4.58 -2.05 8.00 -1.26 -1.54 116.55 114.85 1bh5 n ASP 153 Ca 0.15 -2.90 -0.37 0.00 0.71 0.00 0.00 54.79 52.38 1bh5 n ASP 153 Cb 0.51 -0.68 -0.11 0.00 -0.02 0.00 0.00 41.12 40.82 1bh5 n ASP 153 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1bh5 s ASP 154 N -0.74 5.76 0.00 -2.24 1.01 -0.65 -5.00 116.67 114.82 1bh5 s ASP 154 Ca 0.50 -0.02 0.00 0.00 0.71 0.00 0.00 52.55 53.74 1bh5 s ASP 154 Cb 0.38 -2.04 0.00 0.00 1.01 0.00 0.00 42.92 42.27 1bh5 s ASP 154 CO 0.14 0.02 0.00 0.61 0.21 0.00 0.00 175.17 176.15 1bh5 n GLY 155 N 4.60 -1.39 0.00 0.21 0.00 -1.26 -4.61 105.19 102.74 1bh5 n GLY 155 Ca -0.15 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1bh5 n GLY 155 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1bh5 n LYS 156 N 0.00 0.00 -2.86 1.61 3.00 -1.26 -4.41 118.16 114.24 1bh5 n LYS 156 Ca 0.00 0.59 -0.42 0.00 -0.00 0.00 0.00 58.31 58.48 1bh5 n LYS 156 Cb 0.00 -1.18 -0.04 0.00 0.00 0.00 0.00 35.03 33.81 1bh5 n LYS 156 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.40 175.76 1bh5 s MET 157 N -1.71 4.11 0.41 1.64 -1.94 -1.26 -5.04 119.30 115.50 1bh5 s MET 157 Ca 0.00 0.89 -0.06 0.00 -1.71 0.00 0.00 55.69 54.81 1bh5 s MET 157 Cb 0.00 -3.68 -0.05 0.00 2.01 0.00 0.00 34.83 33.11 1bh5 s MET 157 CO 0.00 -0.62 0.72 0.15 -0.01 0.00 0.00 175.02 175.25 1bh5 s LYS 158 N 3.01 3.63 -1.05 2.03 -0.14 -1.26 -4.17 119.74 121.78 1bh5 s LYS 158 Ca 0.36 0.20 0.00 0.00 -1.36 0.00 0.00 55.97 55.17 1bh5 s LYS 158 Cb -0.15 -2.46 0.00 0.00 -1.68 0.00 0.00 37.83 33.55 1bh5 s LYS 158 CO 0.10 -0.04 0.00 0.41 -0.76 0.00 0.00 175.35 175.05 1bh5 n GLY 159 N -1.67 1.08 2.86 -3.33 0.00 -0.59 -4.93 105.19 98.60 1bh5 n GLY 159 Ca 0.00 -0.57 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 1bh5 n GLY 159 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1bh5 s LEU 160 N -2.31 1.06 0.17 0.99 2.96 -1.23 -4.44 118.68 115.88 1bh5 s LEU 160 Ca 0.00 -0.15 0.08 0.00 -0.22 0.00 0.00 54.13 53.84 1bh5 s LEU 160 Cb 0.00 -0.52 -0.04 0.00 0.50 0.00 0.00 46.19 46.12 1bh5 s LEU 160 CO 0.00 -0.11 -0.17 0.00 -1.32 0.00 0.00 176.35 174.75 1bh5 s ALA 161 N 1.40 1.98 -0.12 5.97 0.00 -0.53 -3.93 121.76 126.52 1bh5 s ALA 161 Ca -0.03 -1.53 0.01 0.00 0.00 0.00 0.00 51.96 50.41 1bh5 s ALA 161 Cb -0.13 -0.15 0.02 0.00 0.00 0.00 0.00 23.12 22.86 1bh5 s ALA 161 CO -0.03 0.18 -0.13 -0.06 0.00 0.00 0.00 175.76 175.72 1bh5 s PHE 162 N -2.33 1.90 0.42 0.00 0.08 -0.08 0.31 117.98 118.29 1bh5 s PHE 162 Ca 0.17 -0.97 0.07 0.00 0.12 0.00 0.00 56.93 56.32 1bh5 s PHE 162 Cb -0.04 -1.42 -0.05 0.00 -0.57 0.00 0.00 43.02 40.93 1bh5 s PHE 162 CO 0.07 -0.55 0.16 0.96 -0.10 0.00 0.00 175.22 175.76 1bh5 s ILE 163 N 1.32 2.24 0.10 0.64 -4.36 -0.53 0.45 121.20 121.06 1bh5 s ILE 163 Ca -0.00 -1.74 0.10 0.00 -0.26 0.00 0.00 60.65 58.75 1bh5 s ILE 163 Cb -0.14 -2.97 -0.04 0.00 1.25 0.00 0.00 42.46 40.56 1bh5 s ILE 163 CO -0.06 0.00 -0.25 -1.10 0.24 0.00 0.00 174.94 173.76 1bh5 s GLN 164 N -3.88 1.44 0.47 0.37 -0.21 0.44 0.02 119.66 118.30 1bh5 s GLN 164 Ca 0.40 -1.24 -0.03 0.00 0.02 0.00 0.00 55.36 54.50 1bh5 s GLN 164 Cb 0.05 -1.81 0.10 0.00 1.00 0.00 0.00 33.01 32.35 1bh5 s GLN 164 CO 0.22 0.44 0.64 -0.40 -2.12 0.00 0.00 175.29 174.06 1bh5 n ASP 165 N 1.18 0.53 0.30 5.90 5.75 -0.67 -4.46 116.55 125.09 1bh5 n ASP 165 Ca -0.18 -1.53 0.17 0.00 -0.01 0.00 0.00 54.79 53.24 1bh5 n ASP 165 Cb 0.53 -0.45 0.96 0.00 -1.03 0.00 0.00 41.12 41.13 1bh5 n ASP 165 CO 0.00 0.00 0.00 -0.65 -0.11 0.00 0.00 177.20 176.44 1bh5 h PRO 166 N 0.00 0.00 -0.01 0.11 0.11 -1.91 -1.62 132.00 128.68 1bh5 h PRO 166 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1bh5 h PRO 166 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1bh5 h PRO 166 CO 0.19 0.02 -0.28 -0.25 -0.21 0.00 0.00 178.00 177.48 1bh5 n ASP 167 N -3.58 0.98 0.00 -2.05 9.92 -1.26 -4.94 116.55 115.62 1bh5 n ASP 167 Ca -0.03 -0.84 0.00 0.00 -0.53 0.00 0.00 54.79 53.39 1bh5 n ASP 167 Cb 0.11 0.14 0.00 0.00 -0.64 0.00 0.00 41.12 40.74 1bh5 n ASP 167 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1bh5 n GLY 168 N 1.35 0.62 3.76 0.44 0.00 -0.61 -4.79 105.19 105.96 1bh5 n GLY 168 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1bh5 n GLY 168 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bh5 s TYR 169 N -2.43 2.93 0.25 1.61 2.02 -1.26 -4.67 117.35 115.81 1bh5 s TYR 169 Ca 0.00 1.18 -0.30 0.00 -0.37 0.00 0.00 57.07 57.59 1bh5 s TYR 169 Cb 0.00 -3.82 -0.09 0.00 -0.40 0.00 0.00 41.96 37.65 1bh5 s TYR 169 CO 0.00 -2.48 0.97 -1.58 -1.57 0.00 0.00 175.55 170.89 1bh5 s TRP 170 N -0.63 3.89 -0.15 2.71 0.52 -1.26 -1.66 118.94 122.36 1bh5 s TRP 170 Ca 0.54 1.87 -0.00 0.00 0.02 0.00 0.00 56.10 58.53 1bh5 s TRP 170 Cb -0.42 -3.03 0.03 0.00 -1.15 0.00 0.00 33.47 28.90 1bh5 s TRP 170 CO 0.51 0.24 -0.07 0.42 0.02 0.00 0.00 176.95 178.07 1bh5 s ILE 171 N -1.21 1.16 0.31 2.03 1.01 0.10 -2.36 121.20 122.24 1bh5 s ILE 171 Ca 0.42 -0.53 -0.28 0.00 0.00 0.00 0.00 60.65 60.26 1bh5 s ILE 171 Cb -0.27 -1.25 -0.09 0.00 0.01 0.00 0.00 42.46 40.86 1bh5 s ILE 171 CO 0.33 0.25 1.11 -1.58 0.00 0.00 0.00 174.94 175.05 1bh5 s GLN 172 N 1.63 4.49 -0.15 2.79 0.74 0.57 -1.45 119.66 128.28 1bh5 s GLN 172 Ca 0.03 1.79 0.00 0.00 0.05 0.00 0.00 55.36 57.22 1bh5 s GLN 172 Cb -0.14 -3.03 0.02 0.00 1.10 0.00 0.00 33.01 30.96 1bh5 s GLN 172 CO -0.08 0.08 -0.14 0.42 -0.55 0.00 0.00 175.29 175.02 1bh5 s ILE 173 N -1.27 1.57 0.10 -2.34 -1.09 0.15 -0.26 121.20 118.06 1bh5 s ILE 173 Ca 0.48 -0.63 -0.13 0.00 -2.23 0.00 0.00 60.65 58.14 1bh5 s ILE 173 Cb -0.31 -1.47 0.02 0.00 -1.58 0.00 0.00 42.46 39.12 1bh5 s ILE 173 CO 0.39 0.46 0.32 -0.22 -1.23 0.00 0.00 174.94 174.66 1bh5 s LEU 174 N 1.49 0.81 -0.39 2.97 0.20 -0.87 -1.45 118.68 121.44 1bh5 s LEU 174 Ca 0.05 -0.40 -0.04 0.00 0.69 0.00 0.00 54.13 54.43 1bh5 s LEU 174 Cb -0.13 1.50 0.09 0.00 -0.43 0.00 0.00 46.19 47.23 1bh5 s LEU 174 CO -0.11 -0.77 0.18 0.21 -0.29 0.00 0.00 176.35 175.57 1bh5 s ASN 175 N -2.70 5.28 0.45 3.68 2.47 -1.26 -0.52 114.94 122.35 1bh5 s ASN 175 Ca 0.02 -1.80 0.17 0.00 0.42 0.00 0.00 52.86 51.67 1bh5 s ASN 175 Cb 0.02 -1.84 1.11 0.00 -1.45 0.00 0.00 41.25 39.09 1bh5 s ASN 175 CO -0.10 -0.50 1.97 -0.65 -3.72 0.00 0.00 177.10 174.10 1bh5 h PRO 176 N 8.12 0.31 -0.00 0.43 0.11 -1.97 -0.82 132.00 138.18 1bh5 h PRO 176 Ca -0.16 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1bh5 h PRO 176 Cb 1.06 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1bh5 h PRO 176 CO 0.69 0.21 -0.01 0.09 -0.21 0.00 0.00 178.00 178.76 1bh5 n ASN 177 N -4.46 0.04 -0.13 -2.05 3.02 -1.26 -3.39 115.26 107.04 1bh5 n ASN 177 Ca 0.11 -0.31 0.02 0.00 -0.03 0.00 0.00 54.58 54.36 1bh5 n ASN 177 Cb 0.45 -0.22 0.01 0.00 -0.61 0.00 0.00 39.78 39.41 1bh5 n ASN 177 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1bh5 n LYS 178 N -1.21 0.68 0.04 3.52 5.02 -0.34 -4.77 118.16 121.10 1bh5 n LYS 178 Ca 0.16 -0.60 -0.05 0.00 -2.02 0.00 0.00 58.31 55.80 1bh5 n LYS 178 Cb 0.22 -1.00 0.15 0.00 -0.02 0.00 0.00 35.03 34.39 1bh5 n LYS 178 CO 0.00 0.00 0.00 1.98 -0.52 0.00 0.00 177.40 178.86 1bh5 h MET 179 N 0.62 0.42 -0.87 1.97 4.05 -1.50 -3.17 114.93 116.44 1bh5 h MET 179 Ca 0.00 -0.21 0.15 0.00 -0.28 0.00 0.00 59.70 59.36 1bh5 h MET 179 Cb 0.15 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 30.88 1bh5 h MET 179 CO 0.00 0.77 0.57 0.00 0.23 0.00 0.00 176.91 178.47 1bh5 h ALA 180 N 1.21 1.90 0.00 0.39 0.00 -1.86 -0.87 119.26 120.03 1bh5 h ALA 180 Ca 0.03 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1bh5 h ALA 180 Cb 0.89 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1bh5 h ALA 180 CO 0.07 -0.15 0.00 2.41 0.00 0.00 0.00 179.25 181.59 1bh5 n THR 181 N -4.55 0.48 -0.44 0.00 -1.04 -1.20 -3.12 114.28 104.42 1bh5 n THR 181 Ca 0.17 0.00 0.08 0.00 -2.04 0.00 0.00 64.05 62.27 1bh5 n THR 181 Cb 0.50 -0.72 0.26 0.00 -1.82 0.00 0.00 70.33 68.55 1bh5 n THR 181 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1bh5 n LEU 182 N -1.82 3.77 0.00 -4.42 -0.00 -0.34 -5.15 117.00 109.04 1bh5 n LEU 182 Ca 0.05 -2.25 0.00 0.00 -0.00 0.00 0.00 56.01 53.82 1bh5 n LEU 182 Cb 0.32 -0.42 0.00 0.00 -0.00 0.00 0.00 43.42 43.31 1bh5 n LEU 182 CO 0.24 0.81 0.00 0.23 -0.00 0.00 0.00 177.39 178.67