#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hw5 n LEU 2 N 0.00 0.00 0.00 7.52 4.32 -1.26 -4.75 117.00 122.83 1hw5 n LEU 2 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1hw5 n LEU 2 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1hw5 n LEU 2 CO 0.00 -0.77 0.00 0.61 -1.22 0.00 0.00 177.39 176.01 1hw5 n GLY 3 N 0.00 -0.96 3.38 -0.72 0.00 -1.26 -3.93 105.19 101.70 1hw5 n GLY 3 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1hw5 n GLY 3 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hw5 n LYS 4 N 0.00 -0.09 0.00 1.61 4.76 -1.26 -2.24 118.16 120.94 1hw5 n LYS 4 Ca 0.00 0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 1hw5 n LYS 4 Cb 0.00 -1.73 0.00 0.00 -1.84 0.00 0.00 35.03 31.46 1hw5 n LYS 4 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1hw5 n PRO 5 N -0.87 0.86 0.00 1.97 -0.02 -1.26 -4.89 135.00 130.79 1hw5 n PRO 5 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 1hw5 n PRO 5 Cb 0.53 -1.16 0.00 0.00 -0.02 0.00 0.00 33.50 32.84 1hw5 n PRO 5 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1hw5 n GLN 6 N -0.28 0.00 0.00 -0.52 1.13 -0.95 -5.14 117.38 111.62 1hw5 n GLN 6 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1hw5 n GLN 6 Cb 0.08 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.43 1hw5 n GLN 6 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1hw5 n THR 7 N -0.50 0.00 0.00 5.09 -2.24 -1.18 -4.85 114.28 110.61 1hw5 n THR 7 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1hw5 n THR 7 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1hw5 n THR 7 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1hw5 n ASP 8 N 0.51 0.00 -0.29 3.42 5.68 -1.20 -4.38 116.55 120.28 1hw5 n ASP 8 Ca 0.00 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.38 1hw5 n ASP 8 Cb 0.00 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 40.19 1hw5 n ASP 8 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 1hw5 h PRO 9 N 0.00 0.08 -0.53 0.11 0.11 -1.83 -2.43 132.00 127.52 1hw5 h PRO 9 Ca 0.00 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.04 1hw5 h PRO 9 Cb 0.00 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.07 1hw5 h PRO 9 CO 0.00 0.06 0.08 1.15 -0.21 0.00 0.00 178.00 179.08 1hw5 h THR 10 N 0.09 1.24 0.08 -1.15 2.02 -1.96 0.52 112.91 113.74 1hw5 h THR 10 Ca 0.49 -0.90 -0.25 0.00 0.77 0.00 0.00 66.41 66.51 1hw5 h THR 10 Cb 0.92 0.75 -0.00 0.00 -1.74 0.00 0.00 68.15 68.07 1hw5 h THR 10 CO -0.75 0.33 -1.13 -0.07 0.37 0.00 0.00 175.52 174.27 1hw5 h LEU 11 N 0.80 0.38 -0.78 2.58 3.38 -1.78 -2.32 115.31 117.57 1hw5 h LEU 11 Ca 0.17 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1hw5 h LEU 11 Cb 0.36 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1hw5 h LEU 11 CO 0.01 1.26 0.43 -0.33 0.09 0.00 0.00 178.44 179.90 1hw5 h GLU 12 N 0.10 1.09 -0.29 1.13 4.39 -0.92 -0.62 114.58 119.45 1hw5 h GLU 12 Ca -0.10 -0.12 0.04 0.00 0.34 0.00 0.00 59.36 59.51 1hw5 h GLU 12 Cb 1.83 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 30.24 1hw5 h GLU 12 CO 0.18 0.80 0.08 2.35 -1.16 0.00 0.00 179.01 181.26 1hw5 h TRP 13 N 1.08 0.14 -0.70 4.33 7.01 -0.94 -2.47 115.95 124.40 1hw5 h TRP 13 Ca 0.27 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 61.25 1hw5 h TRP 13 Cb 0.03 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.04 1hw5 h TRP 13 CO 0.00 0.05 0.29 0.35 -2.79 0.00 0.00 178.44 176.34 1hw5 h PHE 14 N 0.20 1.05 -0.11 2.65 3.57 -0.82 -3.01 116.94 120.47 1hw5 h PHE 14 Ca 0.13 -0.07 -0.11 0.00 3.53 0.00 0.00 57.97 61.45 1hw5 h PHE 14 Cb 0.12 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 1hw5 h PHE 14 CO -0.15 0.81 -0.42 -0.07 -2.23 0.00 0.00 178.31 176.25 1hw5 h LEU 15 N 0.99 0.25 -1.60 0.59 3.38 -0.91 -2.64 115.31 115.37 1hw5 h LEU 15 Ca 0.23 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1hw5 h LEU 15 Cb 0.19 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1hw5 h LEU 15 CO -0.02 0.65 0.00 0.77 0.09 0.00 0.00 178.44 179.92 1hw5 h SER 16 N 0.20 0.00 -0.46 -0.43 4.64 -1.30 0.36 113.55 116.56 1hw5 h SER 16 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1hw5 h SER 16 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1hw5 h SER 16 CO 0.06 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.43 1hw5 n HIS 17 N -2.56 0.60 -3.48 4.77 8.25 -1.00 -4.95 115.22 116.86 1hw5 n HIS 17 Ca -0.01 -0.30 -0.21 0.00 -0.26 0.00 0.00 57.72 56.95 1hw5 n HIS 17 Cb 0.13 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.23 1hw5 n HIS 17 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1hw5 s HIS 19 N -2.51 2.52 -0.26 0.00 -3.43 -0.33 -4.86 115.29 106.42 1hw5 s HIS 19 Ca 0.49 -0.67 -0.10 0.00 -0.80 0.00 0.00 55.06 53.97 1hw5 s HIS 19 Cb -0.04 -1.64 -0.04 0.00 -1.43 0.00 0.00 32.58 29.43 1hw5 s HIS 19 CO 0.29 -0.19 0.15 0.42 -2.00 0.00 0.00 174.74 173.41 1hw5 s ILE 20 N -0.14 5.04 0.20 -5.38 1.09 -1.26 -0.33 121.20 120.42 1hw5 s ILE 20 Ca -0.04 0.07 0.10 0.00 -1.10 0.00 0.00 60.65 59.69 1hw5 s ILE 20 Cb -0.14 -3.38 -0.04 0.00 -1.06 0.00 0.00 42.46 37.84 1hw5 s ILE 20 CO 0.04 0.30 -0.21 -1.00 -0.10 0.00 0.00 174.94 173.97 1hw5 s HIS 21 N 1.54 2.08 -0.14 3.97 3.76 0.04 -4.95 115.29 121.59 1hw5 s HIS 21 Ca 0.07 -0.41 -0.02 0.00 -0.15 0.00 0.00 55.06 54.55 1hw5 s HIS 21 Cb -0.15 -1.01 -0.02 0.00 1.11 0.00 0.00 32.58 32.51 1hw5 s HIS 21 CO 0.08 0.47 -0.08 0.15 -0.85 0.00 0.00 174.74 174.50 1hw5 s LYS 22 N -2.93 3.54 -0.16 1.40 1.02 -1.26 -1.54 119.74 119.81 1hw5 s LYS 22 Ca 0.21 -0.60 -0.01 0.00 0.02 0.00 0.00 55.97 55.59 1hw5 s LYS 22 Cb -0.06 -2.78 -0.01 0.00 -0.52 0.00 0.00 37.83 34.46 1hw5 s LYS 22 CO 0.09 0.23 -0.12 0.71 -0.92 0.00 0.00 175.35 175.35 1hw5 s TYR 23 N 0.34 2.83 0.57 3.18 2.02 0.14 -4.98 117.35 121.45 1hw5 s TYR 23 Ca -0.07 -0.83 -0.16 0.00 -0.37 0.00 0.00 57.07 55.63 1hw5 s TYR 23 Cb -0.15 -1.91 -0.05 0.00 -0.40 0.00 0.00 41.96 39.45 1hw5 s TYR 23 CO 0.04 -0.36 1.03 -1.25 -1.57 0.00 0.00 175.55 173.44 1hw5 s PRO 24 N 0.71 3.55 0.58 -1.71 0.05 -1.26 0.15 135.00 137.07 1hw5 s PRO 24 Ca -0.06 1.10 -0.19 0.00 0.05 0.00 0.00 61.00 61.91 1hw5 s PRO 24 Cb -0.15 -2.07 -0.06 0.00 0.05 0.00 0.00 34.50 32.26 1hw5 s PRO 24 CO 0.02 -0.61 0.85 0.43 0.05 0.00 0.00 177.00 177.74 1hw5 n SER 25 N -1.88 0.32 0.00 6.66 7.64 -1.25 -2.23 113.62 122.87 1hw5 n SER 25 Ca 0.08 0.81 0.00 0.00 1.01 0.00 0.00 58.87 60.77 1hw5 n SER 25 Cb 0.53 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 1hw5 n SER 25 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1hw5 n LYS 26 N -0.65 0.00 -2.78 1.43 4.76 0.13 -4.96 118.16 116.09 1hw5 n LYS 26 Ca 0.13 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.25 1hw5 n LYS 26 Cb 0.47 -2.07 -0.05 0.00 -1.84 0.00 0.00 35.03 31.53 1hw5 n LYS 26 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1hw5 s SER 27 N -3.49 6.73 -0.32 4.39 1.04 -0.95 -4.76 113.70 116.34 1hw5 s SER 27 Ca 0.00 1.45 -0.15 0.00 0.48 0.00 0.00 55.95 57.73 1hw5 s SER 27 Cb 0.00 -2.45 -0.02 0.00 0.10 0.00 0.00 66.02 63.65 1hw5 s SER 27 CO 0.00 -0.40 0.35 -0.89 0.98 0.00 0.00 173.24 173.28 1hw5 s THR 28 N -2.30 5.18 -0.04 2.02 2.01 -1.26 0.32 115.64 121.57 1hw5 s THR 28 Ca 0.57 0.20 -0.22 0.00 0.31 0.00 0.00 61.69 62.55 1hw5 s THR 28 Cb -0.10 -3.76 -0.29 0.00 0.01 0.00 0.00 72.50 68.36 1hw5 s THR 28 CO 0.23 0.01 0.93 -0.07 -0.69 0.00 0.00 174.62 175.03 1hw5 h LEU 29 N 8.67 0.44 -7.85 4.42 4.07 -1.11 -3.47 115.31 120.48 1hw5 h LEU 29 Ca -0.31 -0.92 -0.43 0.00 0.08 0.00 0.00 57.88 56.31 1hw5 h LEU 29 Cb 1.15 -0.14 -0.33 0.00 1.08 0.00 0.00 40.66 42.42 1hw5 h LEU 29 CO 0.67 1.32 -0.78 -0.63 -1.08 0.00 0.00 178.44 177.93 1hw5 s ILE 30 N -2.59 0.70 -0.19 1.22 1.01 -1.09 -4.97 121.20 115.29 1hw5 s ILE 30 Ca -0.14 -0.25 -0.08 0.00 0.00 0.00 0.00 60.65 60.18 1hw5 s ILE 30 Cb 0.01 -0.67 -0.04 0.00 0.01 0.00 0.00 42.46 41.76 1hw5 s ILE 30 CO 0.82 0.25 0.08 -1.00 0.00 0.00 0.00 174.94 175.08 1hw5 s HIS 31 N 0.64 3.26 0.33 3.97 3.76 -1.26 -0.23 115.29 125.75 1hw5 s HIS 31 Ca -0.10 0.07 -0.29 0.00 -0.15 0.00 0.00 55.06 54.59 1hw5 s HIS 31 Cb -0.13 -2.11 -0.11 0.00 1.11 0.00 0.00 32.58 31.34 1hw5 s HIS 31 CO 0.01 0.12 1.55 -1.14 -0.85 0.00 0.00 174.74 174.43 1hw5 s GLN 32 N 0.51 4.11 0.00 1.40 0.74 -1.24 -2.96 119.66 122.22 1hw5 s GLN 32 Ca 0.04 2.58 0.00 0.00 0.05 0.00 0.00 55.36 58.03 1hw5 s GLN 32 Cb -0.13 -3.00 0.00 0.00 1.10 0.00 0.00 33.01 30.99 1hw5 s GLN 32 CO 0.01 -0.59 0.00 0.41 -0.55 0.00 0.00 175.29 174.57 1hw5 n GLY 33 N 1.40 2.86 3.80 2.59 0.00 -0.96 -4.95 105.19 109.93 1hw5 n GLY 33 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1hw5 n GLY 33 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hw5 s GLU 34 N -0.43 3.85 0.27 1.61 2.02 -1.15 -4.55 118.70 120.31 1hw5 s GLU 34 Ca 0.00 1.32 -0.31 0.00 0.02 0.00 0.00 54.97 56.01 1hw5 s GLU 34 Cb 0.00 -2.10 -0.12 0.00 0.10 0.00 0.00 34.13 32.00 1hw5 s GLU 34 CO 0.00 -0.39 1.55 1.17 0.02 0.00 0.00 175.26 177.62 1hw5 n LYS 35 N -0.95 2.52 -3.49 1.61 3.00 -1.26 -0.61 118.16 118.98 1hw5 n LYS 35 Ca 0.09 0.90 -0.39 0.00 -0.00 0.00 0.00 58.31 58.91 1hw5 n LYS 35 Cb 0.53 -2.65 -0.10 0.00 0.00 0.00 0.00 35.03 32.81 1hw5 n LYS 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1hw5 s ALA 36 N 0.07 3.55 0.00 3.14 0.00 -0.62 -4.79 121.76 123.10 1hw5 s ALA 36 Ca 0.66 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 51.67 1hw5 s ALA 36 Cb -0.54 -2.59 0.00 0.00 0.00 0.00 0.00 23.12 19.99 1hw5 s ALA 36 CO 0.48 -0.59 0.07 0.39 0.00 0.00 0.00 175.76 176.10 1hw5 n GLU 37 N 5.18 0.36 -4.13 0.00 1.02 -1.26 -4.74 120.64 117.06 1hw5 n GLU 37 Ca -0.11 -0.07 -0.10 0.00 -0.02 0.00 0.00 57.16 56.86 1hw5 n GLU 37 Cb 0.51 -0.44 -0.10 0.00 -0.02 0.00 0.00 31.44 31.40 1hw5 n GLU 37 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1hw5 s THR 38 N -0.07 0.53 -0.03 2.62 -4.23 -1.26 -0.01 115.64 113.19 1hw5 s THR 38 Ca 0.00 -1.81 0.02 0.00 -1.18 0.00 0.00 61.69 58.72 1hw5 s THR 38 Cb 0.00 -1.52 -0.03 0.00 1.34 0.00 0.00 72.50 72.29 1hw5 s THR 38 CO 0.00 -0.86 -0.08 -0.22 -0.54 0.00 0.00 174.62 172.92 1hw5 s LEU 39 N -2.86 3.10 0.23 4.79 2.96 -0.25 -4.79 118.68 121.86 1hw5 s LEU 39 Ca 0.08 -0.11 0.11 0.00 -0.22 0.00 0.00 54.13 53.99 1hw5 s LEU 39 Cb 0.05 -1.72 -0.05 0.00 0.50 0.00 0.00 46.19 44.97 1hw5 s LEU 39 CO -0.06 0.32 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.78 1hw5 s TYR 40 N -0.88 2.16 -0.02 5.38 2.02 0.21 -1.32 117.35 124.90 1hw5 s TYR 40 Ca 0.14 -0.38 0.01 0.00 -0.37 0.00 0.00 57.07 56.47 1hw5 s TYR 40 Cb -0.11 -1.01 0.02 0.00 -0.40 0.00 0.00 41.96 40.46 1hw5 s TYR 40 CO 0.04 0.55 -0.02 -0.47 -1.57 0.00 0.00 175.55 174.08 1hw5 s TYR 41 N -2.20 0.44 -0.40 2.71 6.14 -0.68 -0.15 117.35 123.21 1hw5 s TYR 41 Ca 0.24 -0.07 -0.26 0.00 0.64 0.00 0.00 57.07 57.62 1hw5 s TYR 41 Cb -0.06 -0.42 0.02 0.00 0.42 0.00 0.00 41.96 41.92 1hw5 s TYR 41 CO 0.11 -0.11 0.92 0.42 0.64 0.00 0.00 175.55 177.53 1hw5 s ILE 42 N 0.65 4.55 0.05 3.14 1.01 0.68 -1.21 121.20 130.07 1hw5 s ILE 42 Ca -0.07 1.02 -0.02 0.00 0.00 0.00 0.00 60.65 61.58 1hw5 s ILE 42 Cb -0.10 -4.36 -0.27 0.00 0.01 0.00 0.00 42.46 37.73 1hw5 s ILE 42 CO -0.01 -0.64 1.03 0.58 0.00 0.00 0.00 174.94 175.90 1hw5 h VAL 43 N 5.91 1.37 -2.25 2.92 2.07 0.89 -1.03 116.25 126.12 1hw5 h VAL 43 Ca -0.24 -2.99 -0.07 0.00 0.82 0.00 0.00 66.70 64.22 1hw5 h VAL 43 Cb 1.08 2.84 -0.19 0.00 -1.52 0.00 0.00 31.29 33.49 1hw5 h VAL 43 CO 0.99 0.86 0.07 -0.54 0.02 0.00 0.00 177.57 178.97 1hw5 s LYS 44 N -2.64 0.95 0.00 1.57 3.01 -0.41 -4.78 119.74 117.43 1hw5 s LYS 44 Ca -0.05 0.20 0.00 0.00 -1.01 0.00 0.00 55.97 55.11 1hw5 s LYS 44 Cb 0.07 0.44 0.00 0.00 -1.01 0.00 0.00 37.83 37.34 1hw5 s LYS 44 CO 0.86 -0.28 0.00 0.41 0.51 0.00 0.00 175.35 176.85 1hw5 n GLY 45 N 1.13 -1.64 3.03 -3.33 0.00 -1.26 -0.61 105.19 102.50 1hw5 n GLY 45 Ca -0.19 -2.09 -0.10 0.00 0.00 0.00 0.00 46.02 43.64 1hw5 n GLY 45 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hw5 s SER 46 N -3.70 0.50 0.25 1.61 1.04 -1.26 -2.57 113.70 109.57 1hw5 s SER 46 Ca 0.00 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 55.86 1hw5 s SER 46 Cb 0.00 0.09 -0.05 0.00 0.10 0.00 0.00 66.02 66.16 1hw5 s SER 46 CO 0.00 -0.32 -0.00 0.68 0.98 0.00 0.00 173.24 174.58 1hw5 s VAL 47 N -1.87 1.13 -0.11 5.02 -7.23 -0.46 -0.59 120.40 116.31 1hw5 s VAL 47 Ca -0.10 -2.04 0.01 0.00 -1.81 0.00 0.00 61.98 58.04 1hw5 s VAL 47 Cb -0.07 -2.42 -0.02 0.00 0.56 0.00 0.00 36.38 34.44 1hw5 s VAL 47 CO -0.02 -0.28 -0.14 0.00 -0.31 0.00 0.00 175.10 174.35 1hw5 s ALA 48 N -3.35 2.58 -0.24 1.32 0.00 0.26 -2.25 121.76 120.08 1hw5 s ALA 48 Ca 0.30 -0.92 -0.16 0.00 0.00 0.00 0.00 51.96 51.18 1hw5 s ALA 48 Cb 0.06 -1.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.03 1hw5 s ALA 48 CO 0.10 0.32 0.42 0.08 0.00 0.00 0.00 175.76 176.68 1hw5 s VAL 49 N 0.10 5.16 0.15 0.00 1.01 0.51 -0.70 120.40 126.63 1hw5 s VAL 49 Ca -0.07 0.71 -0.13 0.00 0.00 0.00 0.00 61.98 62.49 1hw5 s VAL 49 Cb -0.15 -3.75 0.01 0.00 0.00 0.00 0.00 36.38 32.50 1hw5 s VAL 49 CO 0.05 0.18 0.37 -1.48 0.00 0.00 0.00 175.10 174.22 1hw5 s LEU 50 N 1.82 0.62 0.17 3.92 0.05 -0.26 0.73 118.68 125.73 1hw5 s LEU 50 Ca 0.18 -0.59 0.03 0.00 0.05 0.00 0.00 54.13 53.80 1hw5 s LEU 50 Cb -0.15 1.62 -0.05 0.00 -2.05 0.00 0.00 46.19 45.56 1hw5 s LEU 50 CO 0.09 -0.91 -0.02 0.27 -0.55 0.00 0.00 176.35 175.22 1hw5 s ILE 51 N -3.89 0.85 0.10 1.48 -4.36 -0.71 0.58 121.20 115.25 1hw5 s ILE 51 Ca 0.10 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.47 1hw5 s ILE 51 Cb 0.02 -2.08 -0.04 0.00 1.25 0.00 0.00 42.46 41.61 1hw5 s ILE 51 CO -0.05 -0.52 0.03 -0.54 0.24 0.00 0.00 174.94 174.09 1hw5 s LYS 52 N -3.87 0.81 0.86 0.37 3.01 -1.26 -0.29 119.74 119.37 1hw5 s LYS 52 Ca 0.23 -1.34 -0.09 0.00 -1.01 0.00 0.00 55.97 53.75 1hw5 s LYS 52 Cb 0.05 0.23 0.17 0.00 -1.01 0.00 0.00 37.83 37.28 1hw5 s LYS 52 CO 0.04 -0.20 1.18 0.16 0.51 0.00 0.00 175.35 177.03 1hw5 s ASP 53 N -2.99 3.61 0.57 2.83 -4.77 0.06 -4.90 116.67 111.08 1hw5 s ASP 53 Ca 0.17 -0.09 0.30 0.00 -3.30 0.00 0.00 52.55 49.64 1hw5 s ASP 53 Cb 0.08 -0.07 1.45 0.00 -1.09 0.00 0.00 42.92 43.28 1hw5 s ASP 53 CO -0.03 -2.38 1.84 1.05 0.70 0.00 0.00 175.17 176.35 1hw5 h GLU 54 N -1.15 0.00 -0.37 2.11 4.11 -2.02 -1.72 114.58 115.54 1hw5 h GLU 54 Ca -0.40 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 58.98 1hw5 h GLU 54 Cb 1.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 1hw5 h GLU 54 CO 0.37 0.00 0.03 0.39 0.07 0.00 0.00 179.01 179.87 1hw5 n GLU 55 N -3.91 3.12 -0.85 1.06 1.02 -1.26 -4.95 120.64 114.87 1hw5 n GLU 55 Ca 0.15 -2.96 0.00 0.00 -0.02 0.00 0.00 57.16 54.32 1hw5 n GLU 55 Cb 0.89 -1.94 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 1hw5 n GLU 55 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1hw5 n GLY 56 N -0.42 1.27 3.74 0.62 0.00 -0.64 -5.01 105.19 104.75 1hw5 n GLY 56 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 1hw5 n GLY 56 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1hw5 n LYS 57 N -2.00 2.57 -4.29 1.61 4.81 -1.26 -4.64 118.16 114.96 1hw5 n LYS 57 Ca 0.00 0.91 -0.33 0.00 -0.87 0.00 0.00 58.31 58.02 1hw5 n LYS 57 Cb 0.00 -2.64 -0.09 0.00 0.02 0.00 0.00 35.03 32.32 1hw5 n LYS 57 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1hw5 s GLU 58 N -1.16 2.85 -0.08 1.64 2.02 -1.26 -0.76 118.70 121.95 1hw5 s GLU 58 Ca 0.60 -0.56 0.01 0.00 0.02 0.00 0.00 54.97 55.04 1hw5 s GLU 58 Cb -0.51 -2.71 0.02 0.00 0.10 0.00 0.00 34.13 31.03 1hw5 s GLU 58 CO 0.55 0.64 -0.09 1.41 0.02 0.00 0.00 175.26 177.80 1hw5 s MET 59 N -1.43 1.46 -0.17 1.61 -2.45 0.60 -4.19 119.30 114.72 1hw5 s MET 59 Ca 0.18 -0.28 -0.28 0.00 -1.25 0.00 0.00 55.69 54.07 1hw5 s MET 59 Cb -0.12 -1.40 -0.00 0.00 1.25 0.00 0.00 34.83 34.56 1hw5 s MET 59 CO 0.09 -0.13 0.97 0.42 1.05 0.00 0.00 175.02 177.42 1hw5 s ILE 60 N 1.23 4.77 0.01 10.11 -1.09 0.16 -1.74 121.20 134.64 1hw5 s ILE 60 Ca -0.04 1.92 -0.18 0.00 -2.23 0.00 0.00 60.65 60.12 1hw5 s ILE 60 Cb -0.14 -4.26 -0.31 0.00 -1.58 0.00 0.00 42.46 36.17 1hw5 s ILE 60 CO -0.03 -0.07 1.01 -0.07 -1.23 0.00 0.00 174.94 174.55 1hw5 h LEU 61 N 8.69 0.68 -7.00 2.97 3.38 -0.03 -3.47 115.31 120.54 1hw5 h LEU 61 Ca -0.26 -0.88 0.14 0.00 0.09 0.00 0.00 57.88 56.97 1hw5 h LEU 61 Cb 1.11 -0.22 -0.19 0.00 0.09 0.00 0.00 40.66 41.45 1hw5 h LEU 61 CO 0.90 1.50 0.61 -0.55 0.09 0.00 0.00 178.44 180.99 1hw5 s SER 62 N -7.20 -0.29 0.20 -0.43 0.15 -1.13 -5.02 113.70 99.97 1hw5 s SER 62 Ca -0.11 0.13 -0.08 0.00 0.70 0.00 0.00 55.95 56.59 1hw5 s SER 62 Cb 0.03 0.28 -0.07 0.00 -1.71 0.00 0.00 66.02 64.56 1hw5 s SER 62 CO 0.88 -0.41 0.49 -0.31 1.20 0.00 0.00 173.24 175.10 1hw5 s TYR 63 N -2.18 3.44 0.09 3.44 2.02 -1.26 -0.36 117.35 122.54 1hw5 s TYR 63 Ca 0.04 0.76 0.03 0.00 -0.37 0.00 0.00 57.07 57.53 1hw5 s TYR 63 Cb -0.01 -2.17 -0.03 0.00 -0.40 0.00 0.00 41.96 39.35 1hw5 s TYR 63 CO -0.04 0.33 -0.09 -0.51 -1.57 0.00 0.00 175.55 173.66 1hw5 s LEU 64 N -2.78 2.40 0.34 -1.29 1.43 -0.96 -4.93 118.68 112.90 1hw5 s LEU 64 Ca 0.45 -0.80 0.06 0.00 -1.03 0.00 0.00 54.13 52.80 1hw5 s LEU 64 Cb -0.11 -0.24 -0.03 0.00 0.03 0.00 0.00 46.19 45.84 1hw5 s LEU 64 CO 0.23 -0.29 0.22 0.20 0.23 0.00 0.00 176.35 176.94 1hw5 s ASN 65 N -2.41 1.91 -0.15 2.29 0.01 -1.26 -1.35 114.94 113.98 1hw5 s ASN 65 Ca 0.04 -1.71 -0.42 0.00 -0.71 0.00 0.00 52.86 50.06 1hw5 s ASN 65 Cb -0.03 0.53 -0.20 0.00 0.41 0.00 0.00 41.25 41.97 1hw5 s ASN 65 CO -0.01 -1.01 1.24 1.67 -1.51 0.00 0.00 177.10 177.49 1hw5 n GLN 66 N -0.69 0.05 0.00 -0.60 7.27 -1.06 -1.04 117.38 121.32 1hw5 n GLN 66 Ca 0.03 0.02 0.00 0.00 0.07 0.00 0.00 57.00 57.12 1hw5 n GLN 66 Cb 0.63 -1.53 0.00 0.00 2.41 0.00 0.00 30.24 31.76 1hw5 n GLN 66 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1hw5 n GLY 67 N 2.30 3.08 3.72 1.69 0.00 -0.39 -5.00 105.19 110.59 1hw5 n GLY 67 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.85 1hw5 n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1hw5 s ASP 68 N -1.25 7.03 0.56 1.61 -0.00 -0.20 -4.83 116.67 119.60 1hw5 s ASP 68 Ca 0.00 1.24 -0.18 0.00 -0.00 0.00 0.00 52.55 53.61 1hw5 s ASP 68 Cb 0.00 -2.43 -0.05 0.00 -0.00 0.00 0.00 42.92 40.44 1hw5 s ASP 68 CO 0.00 -0.11 1.11 -0.36 -0.00 0.00 0.00 175.17 175.81 1hw5 s PHE 69 N 0.73 2.72 0.01 4.23 0.08 -1.26 -0.23 117.98 124.26 1hw5 s PHE 69 Ca 0.39 1.55 -0.04 0.00 0.12 0.00 0.00 56.93 58.94 1hw5 s PHE 69 Cb -0.18 -3.22 -0.01 0.00 -0.57 0.00 0.00 43.02 39.04 1hw5 s PHE 69 CO 0.19 -1.47 0.06 0.42 -0.10 0.00 0.00 175.22 174.32 1hw5 s ILE 70 N -1.96 0.09 -0.09 0.64 1.01 0.78 -4.86 121.20 116.81 1hw5 s ILE 70 Ca 0.70 -0.72 0.00 0.00 0.00 0.00 0.00 60.65 60.64 1hw5 s ILE 70 Cb -0.22 -0.33 0.00 0.00 0.01 0.00 0.00 42.46 41.92 1hw5 s ILE 70 CO 0.30 -0.39 0.00 0.61 0.00 0.00 0.00 174.94 175.45 1hw5 n GLY 71 N 1.66 0.47 0.21 6.18 0.00 -1.26 0.66 105.19 113.11 1hw5 n GLY 71 Ca -0.22 -0.80 0.12 0.00 0.00 0.00 0.00 46.02 45.12 1hw5 n GLY 71 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1hw5 h GLU 72 N 0.22 0.00 0.00 1.61 9.09 -1.89 -3.35 114.58 120.26 1hw5 h GLU 72 Ca -0.02 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.39 1hw5 h GLU 72 Cb 0.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.17 1hw5 h GLU 72 CO 0.03 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.37 1hw5 n LEU 73 N -3.02 0.25 -0.02 3.06 4.77 -1.26 -1.47 117.00 119.31 1hw5 n LEU 73 Ca 0.04 0.57 0.12 0.00 -0.03 0.00 0.00 56.01 56.71 1hw5 n LEU 73 Cb 0.52 -0.55 0.30 0.00 -2.33 0.00 0.00 43.42 41.36 1hw5 n LEU 73 CO 0.34 -0.44 0.52 0.61 -1.33 0.00 0.00 177.39 177.09 1hw5 n GLY 74 N -0.31 -1.23 0.20 -0.72 0.00 -1.26 -4.46 105.19 97.41 1hw5 n GLY 74 Ca 0.02 -0.33 0.14 0.00 0.00 0.00 0.00 46.02 45.86 1hw5 n GLY 74 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1hw5 h LEU 75 N 0.08 0.00 -0.68 0.99 5.85 -1.53 -3.36 115.31 116.66 1hw5 h LEU 75 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1hw5 h LEU 75 Cb 0.50 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.53 1hw5 h LEU 75 CO 0.00 0.00 -0.48 0.49 -0.34 0.00 0.00 178.44 178.11 1hw5 n PHE 76 N -2.67 0.00 -3.68 1.25 3.72 -1.26 -4.91 117.46 109.92 1hw5 n PHE 76 Ca 0.02 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.33 1hw5 n PHE 76 Cb 0.30 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.74 1hw5 n PHE 76 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1hw5 s GLU 77 N -2.20 0.51 0.57 -1.08 2.12 -1.26 -5.17 118.70 112.19 1hw5 s GLU 77 Ca 0.13 0.94 -0.13 0.00 0.36 0.00 0.00 54.97 56.26 1hw5 s GLU 77 Cb 0.14 0.04 -0.06 0.00 0.26 0.00 0.00 34.13 34.51 1hw5 s GLU 77 CO 0.51 -0.15 1.00 -1.21 -0.54 0.00 0.00 175.26 174.87 1hw5 s GLU 78 N 1.45 3.76 0.00 4.30 2.02 -1.26 -3.90 118.70 125.07 1hw5 s GLU 78 Ca -0.09 0.83 0.00 0.00 0.02 0.00 0.00 54.97 55.73 1hw5 s GLU 78 Cb -0.07 -2.11 0.00 0.00 0.10 0.00 0.00 34.13 32.05 1hw5 s GLU 78 CO -0.15 -0.42 0.00 0.41 0.02 0.00 0.00 175.26 175.12 1hw5 n GLY 79 N -2.19 0.54 3.81 -1.39 0.00 -1.26 -5.05 105.19 99.64 1hw5 n GLY 79 Ca 0.06 -0.34 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 1hw5 n GLY 79 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hw5 s GLN 80 N -0.71 2.84 0.21 1.61 -1.52 -1.25 -4.93 119.66 115.91 1hw5 s GLN 80 Ca 0.00 1.00 0.11 0.00 -1.95 0.00 0.00 55.36 54.53 1hw5 s GLN 80 Cb 0.00 -1.98 -0.05 0.00 -0.22 0.00 0.00 33.01 30.77 1hw5 s GLN 80 CO 0.00 -1.18 -0.23 -1.21 -0.25 0.00 0.00 175.29 172.42 1hw5 s GLU 81 N -4.98 1.54 0.06 2.91 2.02 -1.26 -1.59 118.70 117.40 1hw5 s GLU 81 Ca 0.59 -1.57 -0.32 0.00 0.02 0.00 0.00 54.97 53.70 1hw5 s GLU 81 Cb -0.15 -1.83 -0.11 0.00 0.10 0.00 0.00 34.13 32.15 1hw5 s GLU 81 CO 0.54 0.39 1.87 0.54 0.02 0.00 0.00 175.26 178.62 1hw5 n ARG 82 N 0.12 2.67 0.17 1.61 5.12 0.22 -4.85 116.66 121.72 1hw5 n ARG 82 Ca -0.11 0.97 0.13 0.00 -1.93 0.00 0.00 57.85 56.92 1hw5 n ARG 82 Cb 0.57 -2.87 0.46 0.00 -1.16 0.00 0.00 32.46 29.45 1hw5 n ARG 82 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1hw5 h SER 83 N 9.16 0.00 -5.07 0.55 4.64 -1.91 -2.56 113.55 118.36 1hw5 h SER 83 Ca -0.48 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 60.93 1hw5 h SER 83 Cb 1.24 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.26 1hw5 h SER 83 CO 0.94 0.00 0.30 0.00 -0.87 0.00 0.00 176.83 177.20 1hw5 s ALA 84 N -3.31 -1.39 0.44 5.18 0.00 -1.26 -4.94 121.76 116.47 1hw5 s ALA 84 Ca 0.06 -0.06 -0.18 0.00 0.00 0.00 0.00 51.96 51.77 1hw5 s ALA 84 Cb 0.09 0.78 -0.09 0.00 0.00 0.00 0.00 23.12 23.90 1hw5 s ALA 84 CO 0.53 -1.00 0.92 -1.58 0.00 0.00 0.00 175.76 174.63 1hw5 s TRP 85 N -3.71 3.37 -0.05 0.00 0.52 0.20 -3.74 118.94 115.53 1hw5 s TRP 85 Ca 0.10 1.47 0.01 0.00 0.02 0.00 0.00 56.10 57.70 1hw5 s TRP 85 Cb -0.04 -2.76 0.02 0.00 -1.15 0.00 0.00 33.47 29.54 1hw5 s TRP 85 CO 0.03 -0.16 -0.04 0.08 0.02 0.00 0.00 176.95 176.88 1hw5 s VAL 86 N -2.30 0.56 -0.02 4.03 1.01 0.68 -1.10 120.40 123.25 1hw5 s VAL 86 Ca 0.59 -0.10 0.03 0.00 0.00 0.00 0.00 61.98 62.50 1hw5 s VAL 86 Cb -0.10 -0.60 -0.00 0.00 0.00 0.00 0.00 36.38 35.68 1hw5 s VAL 86 CO 0.20 0.24 -0.11 -0.60 0.00 0.00 0.00 175.10 174.84 1hw5 s ARG 87 N 1.13 0.99 0.13 2.72 3.52 0.12 -0.43 118.95 127.14 1hw5 s ARG 87 Ca -0.08 -0.39 -0.31 0.00 -0.13 0.00 0.00 55.73 54.83 1hw5 s ARG 87 Cb -0.14 -0.94 -0.10 0.00 -1.56 0.00 0.00 34.95 32.22 1hw5 s ARG 87 CO -0.01 0.20 1.67 0.00 -0.81 0.00 0.00 175.30 176.35 1hw5 s ALA 88 N -0.10 3.77 -0.17 6.12 0.00 0.15 0.92 121.76 132.46 1hw5 s ALA 88 Ca 0.01 1.37 -0.23 0.00 0.00 0.00 0.00 51.96 53.11 1hw5 s ALA 88 Cb -0.06 -3.69 -0.21 0.00 0.00 0.00 0.00 23.12 19.17 1hw5 s ALA 88 CO 0.00 -0.99 0.45 -0.22 0.00 0.00 0.00 175.76 174.99 1hw5 h LYS 89 N 7.64 0.00 -5.89 0.00 1.63 -1.15 0.40 116.57 119.21 1hw5 h LYS 89 Ca -0.43 0.00 -0.58 0.00 -0.85 0.00 0.00 60.65 58.79 1hw5 h LYS 89 Cb 1.21 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 32.77 1hw5 h LYS 89 CO 0.93 0.91 -0.37 0.95 -3.45 0.00 0.00 179.45 178.42 1hw5 s THR 90 N -2.25 1.88 0.28 1.00 -4.23 -1.20 -4.50 115.64 106.62 1hw5 s THR 90 Ca -0.22 -1.56 -0.30 0.00 -1.18 0.00 0.00 61.69 58.42 1hw5 s THR 90 Cb 0.01 -2.44 -0.12 0.00 1.34 0.00 0.00 72.50 71.29 1hw5 s THR 90 CO 0.59 0.00 1.58 0.00 -0.54 0.00 0.00 174.62 176.25 1hw5 n ALA 91 N -1.58 2.33 -2.41 3.99 0.00 -1.26 -3.83 120.51 117.74 1hw5 n ALA 91 Ca -0.02 0.38 -0.28 0.00 0.00 0.00 0.00 53.44 53.52 1hw5 n ALA 91 Cb 0.64 -2.44 -0.14 0.00 0.00 0.00 0.00 19.45 17.52 1hw5 n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hw5 s GLU 93 N -1.44 2.82 -0.18 0.00 2.02 0.22 0.26 118.70 122.39 1hw5 s GLU 93 Ca 0.10 -1.07 0.01 0.00 0.02 0.00 0.00 54.97 54.03 1hw5 s GLU 93 Cb -0.10 -3.63 0.03 0.00 0.10 0.00 0.00 34.13 30.53 1hw5 s GLU 93 CO 0.03 -0.66 -0.16 0.08 0.02 0.00 0.00 175.26 174.57 1hw5 s VAL 94 N 1.52 1.91 0.42 2.63 1.01 -0.59 0.14 120.40 127.43 1hw5 s VAL 94 Ca 0.01 -0.96 -0.23 0.00 0.00 0.00 0.00 61.98 60.80 1hw5 s VAL 94 Cb -0.19 -1.80 -0.09 0.00 0.00 0.00 0.00 36.38 34.30 1hw5 s VAL 94 CO 0.05 0.41 1.04 0.00 0.00 0.00 0.00 175.10 176.60 1hw5 s ALA 95 N 1.33 3.05 0.01 5.51 0.00 -0.35 -0.78 121.76 130.52 1hw5 s ALA 95 Ca 0.03 0.67 -0.01 0.00 0.00 0.00 0.00 51.96 52.65 1hw5 s ALA 95 Cb -0.14 -3.26 -0.01 0.00 0.00 0.00 0.00 23.12 19.70 1hw5 s ALA 95 CO -0.11 -0.22 -0.00 -2.00 0.00 0.00 0.00 175.76 173.43 1hw5 s GLU 96 N -2.65 0.24 -0.02 0.00 2.12 0.56 -1.68 118.70 117.27 1hw5 s GLU 96 Ca 0.60 -0.41 -0.10 0.00 0.36 0.00 0.00 54.97 55.41 1hw5 s GLU 96 Cb -0.20 0.09 0.01 0.00 0.26 0.00 0.00 34.13 34.29 1hw5 s GLU 96 CO 0.26 -0.04 0.21 -1.50 -0.54 0.00 0.00 175.26 173.65 1hw5 s ILE 97 N -1.03 0.06 0.43 -3.70 2.07 -0.43 -1.19 121.20 117.41 1hw5 s ILE 97 Ca -0.11 -0.52 -0.24 0.00 -1.41 0.00 0.00 60.65 58.37 1hw5 s ILE 97 Cb -0.07 -0.49 -0.08 0.00 0.13 0.00 0.00 42.46 41.95 1hw5 s ILE 97 CO -0.01 -0.29 1.13 -0.94 -1.91 0.00 0.00 174.94 172.93 1hw5 s SER 98 N -1.17 6.40 0.32 4.50 1.04 -1.26 -1.09 113.70 122.43 1hw5 s SER 98 Ca -0.12 2.24 0.05 0.00 0.48 0.00 0.00 55.95 58.60 1hw5 s SER 98 Cb -0.06 -2.60 0.69 0.00 0.10 0.00 0.00 66.02 64.15 1hw5 s SER 98 CO 0.02 -0.76 1.84 1.88 0.98 0.00 0.00 173.24 177.20 1hw5 h TYR 99 N 2.28 1.01 -0.42 5.02 0.99 -0.76 0.11 116.97 125.19 1hw5 h TYR 99 Ca -0.49 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.25 1hw5 h TYR 99 Cb 1.24 -0.31 -0.02 0.00 1.00 0.00 0.00 36.73 38.63 1hw5 h TYR 99 CO 0.55 0.35 0.18 -0.22 -0.00 0.00 0.00 178.16 179.02 1hw5 h LYS 100 N 0.83 0.63 -0.53 4.88 3.64 -1.91 -0.89 116.57 123.22 1hw5 h LYS 100 Ca 0.50 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.76 1hw5 h LYS 100 Cb 0.66 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.35 1hw5 h LYS 100 CO -0.26 0.57 0.30 0.87 -2.27 0.00 0.00 179.45 178.66 1hw5 h LYS 101 N 0.54 0.72 -0.11 1.90 1.79 -1.74 -2.84 116.57 116.84 1hw5 h LYS 101 Ca 0.14 -0.07 -0.04 0.00 -2.18 0.00 0.00 60.65 58.50 1hw5 h LYS 101 Cb 0.17 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.66 1hw5 h LYS 101 CO -0.01 0.54 -0.10 0.35 -1.08 0.00 0.00 179.45 179.15 1hw5 h PHE 102 N 0.70 0.16 -0.07 -1.35 3.04 -0.16 -2.18 116.94 117.09 1hw5 h PHE 102 Ca 0.19 -0.01 -0.15 0.00 3.98 0.00 0.00 57.97 61.98 1hw5 h PHE 102 Cb 0.02 -0.05 -0.01 0.00 2.56 0.00 0.00 35.95 38.47 1hw5 h PHE 102 CO -0.02 0.26 -0.61 0.00 -2.02 0.00 0.00 178.31 175.93 1hw5 h ARG 103 N 0.15 0.24 -0.50 1.11 3.08 -0.95 -1.52 114.38 115.99 1hw5 h ARG 103 Ca 0.03 -0.16 -0.07 0.00 0.07 0.00 0.00 59.98 59.85 1hw5 h ARG 103 Cb 0.28 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1hw5 h ARG 103 CO 0.02 0.77 0.02 1.96 -1.07 0.00 0.00 179.97 181.66 1hw5 h GLN 104 N 0.18 0.83 -0.86 0.04 4.20 -1.28 -1.81 115.11 116.41 1hw5 h GLN 104 Ca -0.01 -0.22 -0.03 0.00 0.06 0.00 0.00 58.65 58.46 1hw5 h GLN 104 Cb 1.11 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 28.75 1hw5 h GLN 104 CO 0.09 0.83 0.43 -0.07 -0.67 0.00 0.00 178.83 179.44 1hw5 h LEU 105 N 0.78 1.10 -0.43 1.46 3.38 -1.05 -1.48 115.31 119.06 1hw5 h LEU 105 Ca 0.15 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1hw5 h LEU 105 Cb 0.45 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1hw5 h LEU 105 CO 0.02 0.91 0.15 0.40 0.09 0.00 0.00 178.44 180.00 1hw5 h ILE 106 N 1.21 1.21 -0.50 1.22 2.04 -0.84 0.19 117.51 122.05 1hw5 h ILE 106 Ca 0.30 -0.69 0.08 0.00 1.00 0.00 0.00 64.86 65.55 1hw5 h ILE 106 Cb 0.08 0.85 -0.07 0.00 -0.74 0.00 0.00 36.82 36.95 1hw5 h ILE 106 CO -0.04 0.25 0.13 1.56 0.00 0.00 0.00 178.15 180.05 1hw5 h GLN 107 N 0.56 0.27 -0.43 2.37 1.08 -1.04 -2.18 115.11 115.74 1hw5 h GLN 107 Ca 0.14 -0.02 -0.08 0.00 -1.45 0.00 0.00 58.65 57.25 1hw5 h GLN 107 Cb 0.24 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.59 1hw5 h GLN 107 CO -0.01 0.18 -0.03 0.28 -0.95 0.00 0.00 178.83 178.30 1hw5 h VAL 108 N 0.28 1.27 -1.34 -0.54 2.07 -0.59 -3.42 116.25 113.98 1hw5 h VAL 108 Ca 0.25 -1.09 -0.10 0.00 0.82 0.00 0.00 66.70 66.59 1hw5 h VAL 108 Cb 0.31 1.10 -0.24 0.00 -1.52 0.00 0.00 31.29 30.94 1hw5 h VAL 108 CO -0.30 0.37 -0.47 0.21 0.02 0.00 0.00 177.57 177.40 1hw5 s ASN 109 N -6.32 -0.64 0.00 0.57 2.47 0.61 -5.01 114.94 106.62 1hw5 s ASN 109 Ca -0.13 -0.30 0.00 0.00 0.42 0.00 0.00 52.86 52.86 1hw5 s ASN 109 Cb 0.11 1.56 0.00 0.00 -1.45 0.00 0.00 41.25 41.47 1hw5 s ASN 109 CO 0.81 -0.30 0.95 -0.81 -3.72 0.00 0.00 177.10 174.04 1hw5 n PRO 110 N 5.17 0.00 -0.31 0.43 -0.04 -0.84 -2.12 135.00 137.29 1hw5 n PRO 110 Ca 0.05 0.46 0.13 0.00 -0.04 0.00 0.00 63.50 64.09 1hw5 n PRO 110 Cb 0.52 -1.52 0.36 0.00 -0.04 0.00 0.00 33.50 32.82 1hw5 n PRO 110 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1hw5 h ASP 111 N 0.00 0.70 0.71 3.54 5.19 -1.93 -1.71 116.42 122.91 1hw5 h ASP 111 Ca 0.00 0.06 -0.08 0.00 -0.62 0.00 0.00 57.03 56.38 1hw5 h ASP 111 Cb 0.04 -0.07 -0.01 0.00 0.18 0.00 0.00 39.33 39.46 1hw5 h ASP 111 CO 0.00 0.31 -0.40 -0.29 -3.12 0.00 0.00 179.24 175.74 1hw5 h ILE 112 N 0.71 1.01 -0.02 0.35 6.09 -1.79 -1.84 117.51 122.03 1hw5 h ILE 112 Ca 0.50 -1.53 -0.16 0.00 -1.37 0.00 0.00 64.86 62.30 1hw5 h ILE 112 Cb 0.82 1.89 -0.02 0.00 0.47 0.00 0.00 36.82 39.99 1hw5 h ILE 112 CO -0.26 0.39 -0.74 0.25 -3.07 0.00 0.00 178.15 174.72 1hw5 h LEU 113 N 0.00 0.15 0.12 2.19 6.46 -1.55 -2.53 115.31 120.16 1hw5 h LEU 113 Ca -0.00 -0.11 -0.01 0.00 -0.12 0.00 0.00 57.88 57.64 1hw5 h LEU 113 Cb 0.86 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 40.75 1hw5 h LEU 113 CO 0.05 0.83 -0.06 -0.03 -0.62 0.00 0.00 178.44 178.62 1hw5 h MET 114 N 0.08 -0.16 -0.61 1.25 4.05 -0.80 1.00 114.93 119.74 1hw5 h MET 114 Ca -0.02 0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.44 1hw5 h MET 114 Cb 1.30 0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 32.10 1hw5 h MET 114 CO 0.11 0.13 0.38 0.00 0.23 0.00 0.00 176.91 177.75 1hw5 h ARG 115 N -0.44 0.72 -0.50 0.39 3.08 -1.49 0.21 114.38 116.35 1hw5 h ARG 115 Ca -0.02 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.03 1hw5 h ARG 115 Cb 0.36 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.21 1hw5 h ARG 115 CO 0.03 0.48 0.27 1.25 -1.07 0.00 0.00 179.97 180.92 1hw5 h LEU 116 N 0.75 0.40 -0.49 3.04 5.85 -1.40 -2.89 115.31 120.57 1hw5 h LEU 116 Ca 0.24 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.88 1hw5 h LEU 116 Cb 0.01 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1hw5 h LEU 116 CO -0.10 0.28 -0.09 0.28 -0.34 0.00 0.00 178.44 178.47 1hw5 h SER 117 N 0.53 0.94 -0.77 1.25 0.02 -0.01 -1.93 113.55 113.57 1hw5 h SER 117 Ca 0.21 -0.35 0.14 0.00 -0.84 0.00 0.00 61.79 60.95 1hw5 h SER 117 Cb 0.09 -0.25 -0.05 0.00 0.14 0.00 0.00 62.40 62.32 1hw5 h SER 117 CO -0.13 1.07 0.51 0.00 -1.14 0.00 0.00 176.83 177.13 1hw5 h ALA 118 N 0.90 2.04 -0.07 3.77 0.00 -0.53 0.66 119.26 126.02 1hw5 h ALA 118 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.81 1hw5 h ALA 118 Cb 0.64 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.36 1hw5 h ALA 118 CO 0.04 -0.24 -0.87 1.96 0.00 0.00 0.00 179.25 180.15 1hw5 h GLN 119 N 0.48 0.61 -0.45 0.00 4.20 -1.16 -2.39 115.11 116.42 1hw5 h GLN 119 Ca 0.37 -0.57 -0.09 0.00 0.06 0.00 0.00 58.65 58.43 1hw5 h GLN 119 Cb 0.77 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.67 1hw5 h GLN 119 CO -0.13 1.18 -0.08 0.52 -0.67 0.00 0.00 178.83 179.66 1hw5 h MET 120 N 0.39 0.78 -0.82 1.46 2.86 -0.76 0.57 114.93 119.40 1hw5 h MET 120 Ca -0.07 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 1hw5 h MET 120 Cb 1.49 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 33.04 1hw5 h MET 120 CO 0.16 0.84 0.52 0.00 1.06 0.00 0.00 176.91 179.49 1hw5 h ALA 121 N 1.20 1.04 -0.47 6.32 0.00 -0.81 -2.15 119.26 124.39 1hw5 h ALA 121 Ca 0.13 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1hw5 h ALA 121 Cb 0.55 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1hw5 h ALA 121 CO 0.03 0.48 0.08 -0.09 0.00 0.00 0.00 179.25 179.75 1hw5 h ARG 122 N 1.12 0.77 0.00 0.00 9.65 -0.88 -1.78 114.38 123.25 1hw5 h ARG 122 Ca 0.30 -0.20 -0.02 0.00 -1.10 0.00 0.00 59.98 58.95 1hw5 h ARG 122 Cb -0.09 -0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 28.40 1hw5 h ARG 122 CO -0.06 0.78 -0.12 0.00 2.80 0.00 0.00 179.97 183.37 1hw5 h ARG 123 N 0.64 0.00 0.09 0.20 3.08 -0.37 0.40 114.38 118.42 1hw5 h ARG 123 Ca 0.14 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.93 1hw5 h ARG 123 Cb 0.38 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 1hw5 h ARG 123 CO 0.01 0.12 -1.22 -0.07 -1.07 0.00 0.00 179.97 177.73 1hw5 h LEU 124 N 0.00 0.29 0.23 3.04 3.38 -0.92 -2.86 115.31 118.47 1hw5 h LEU 124 Ca -0.00 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1hw5 h LEU 124 Cb 0.23 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1hw5 h LEU 124 CO 0.02 1.26 -0.11 1.56 0.09 0.00 0.00 178.44 181.25 1hw5 h GLN 125 N 0.05 -0.30 -0.08 1.13 4.20 -0.63 -3.13 115.11 116.35 1hw5 h GLN 125 Ca -0.12 0.02 -0.08 0.00 0.06 0.00 0.00 58.65 58.54 1hw5 h GLN 125 Cb 1.92 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 29.76 1hw5 h GLN 125 CO 0.18 -0.02 -0.30 0.28 -0.67 0.00 0.00 178.83 178.29 1hw5 h VAL 126 N -0.57 1.25 0.00 -0.54 2.07 -1.05 -2.60 116.25 114.81 1hw5 h VAL 126 Ca -0.03 -1.17 0.00 0.00 0.82 0.00 0.00 66.70 66.32 1hw5 h VAL 126 Cb 0.42 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.71 1hw5 h VAL 126 CO 0.05 0.35 0.00 -0.07 0.02 0.00 0.00 177.57 177.92 1hw5 h LEU 127 N 0.14 0.00 0.41 2.57 -0.00 -1.48 -3.34 115.31 113.60 1hw5 h LEU 127 Ca 0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.88 1hw5 h LEU 127 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.27 1hw5 h LEU 127 CO 0.04 0.00 -0.19 0.00 -0.00 0.00 0.00 178.44 178.29 1hw5 h ALA 128 N 2.04 -0.54 -0.05 1.53 0.00 -1.41 0.17 119.26 121.00 1hw5 h ALA 128 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1hw5 h ALA 128 Cb 0.56 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1hw5 h ALA 128 CO 0.00 -0.79 0.03 1.05 0.00 0.00 0.00 179.25 179.54 1hw5 h GLU 129 N -0.57 0.07 -0.85 0.00 9.09 -1.76 -1.65 114.58 118.91 1hw5 h GLU 129 Ca -0.06 -0.01 0.19 0.00 0.05 0.00 0.00 59.36 59.54 1hw5 h GLU 129 Cb 0.43 -0.02 -0.11 0.00 -1.65 0.00 0.00 28.75 27.40 1hw5 h GLU 129 CO 0.09 0.07 0.37 -0.22 0.05 0.00 0.00 179.01 179.37 1hw5 h LYS 130 N 0.05 0.43 0.00 1.06 3.64 -1.68 0.69 116.57 120.76 1hw5 h LYS 130 Ca 0.02 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 1hw5 h LYS 130 Cb 0.02 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 1hw5 h LYS 130 CO -0.00 0.28 -0.51 0.28 -2.27 0.00 0.00 179.45 177.23 1hw5 h VAL 131 N 0.44 1.30 0.09 2.00 2.07 -0.48 -3.04 116.25 118.63 1hw5 h VAL 131 Ca 0.51 -1.80 0.01 0.00 0.82 0.00 0.00 66.70 66.24 1hw5 h VAL 131 Cb 0.89 1.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.62 1hw5 h VAL 131 CO -0.48 0.50 -0.16 1.23 0.02 0.00 0.00 177.57 178.69 1hw5 h GLY 132 N 1.70 -0.28 0.27 2.17 0.00 0.14 -3.06 103.07 104.00 1hw5 h GLY 132 Ca -0.01 0.18 0.09 0.00 0.00 0.00 0.00 47.33 47.60 1hw5 h GLY 132 CO 0.07 -0.15 0.04 3.43 0.00 0.00 0.00 176.54 179.92 1hw5 h ASN 133 N -0.31 -0.13 -0.92 0.19 -0.26 -1.29 -0.12 115.58 112.75 1hw5 h ASN 133 Ca 0.02 0.10 0.23 0.00 -0.56 0.00 0.00 56.30 56.10 1hw5 h ASN 133 Cb 0.33 0.17 -0.06 0.00 -1.06 0.00 0.00 38.32 37.70 1hw5 h ASN 133 CO -0.09 -0.03 0.62 -0.07 -1.06 0.00 0.00 177.43 176.80 1hw5 h LEU 134 N 0.16 0.28 0.10 1.61 4.07 -1.42 0.78 115.31 120.89 1hw5 h LEU 134 Ca 0.24 0.03 -0.34 0.00 0.08 0.00 0.00 57.88 57.90 1hw5 h LEU 134 Cb 0.35 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 42.05 1hw5 h LEU 134 CO -0.37 0.10 -1.87 0.00 -1.08 0.00 0.00 178.44 175.22 1hw5 h ALA 135 N 1.59 0.49 0.00 1.53 0.00 -1.33 -3.39 119.26 118.15 1hw5 h ALA 135 Ca 0.47 -1.37 -0.16 0.00 0.00 0.00 0.00 54.91 53.86 1hw5 h ALA 135 Cb 1.39 0.60 -0.02 0.00 0.00 0.00 0.00 17.79 19.75 1hw5 h ALA 135 CO -0.14 1.35 -0.74 0.74 0.00 0.00 0.00 179.25 180.46 1hw5 h PHE 136 N 0.06 0.00 -4.36 0.00 0.04 0.69 -3.46 116.94 109.90 1hw5 h PHE 136 Ca -0.37 0.00 -0.68 0.00 2.80 0.00 0.00 57.97 59.72 1hw5 h PHE 136 Cb 2.03 0.00 -0.27 0.00 2.20 0.00 0.00 35.95 39.91 1hw5 h PHE 136 CO 0.06 0.74 -0.88 -0.51 -0.60 0.00 0.00 178.31 177.12 1hw5 s LEU 137 N -6.83 2.14 0.88 1.54 1.43 0.26 -5.04 118.68 113.05 1hw5 s LEU 137 Ca 0.01 -0.55 -0.12 0.00 -1.03 0.00 0.00 54.13 52.45 1hw5 s LEU 137 Cb 0.10 -1.26 0.16 0.00 0.03 0.00 0.00 46.19 45.23 1hw5 s LEU 137 CO 0.78 0.26 1.22 1.51 0.23 0.00 0.00 176.35 180.35 1hw5 s ASP 138 N -1.06 3.63 0.28 2.29 3.84 -1.26 -4.64 116.67 119.74 1hw5 s ASP 138 Ca 0.11 0.21 0.02 0.00 -0.00 0.00 0.00 52.55 52.88 1hw5 s ASP 138 Cb -0.10 -0.41 0.64 0.00 -1.38 0.00 0.00 42.92 41.67 1hw5 s ASP 138 CO 0.01 -2.39 1.73 1.62 -0.00 0.00 0.00 175.17 176.14 1hw5 h VAL 139 N -1.29 0.59 -0.16 2.11 3.04 -1.97 0.85 116.25 119.43 1hw5 h VAL 139 Ca -0.43 -0.17 -0.01 0.00 -1.01 0.00 0.00 66.70 65.07 1hw5 h VAL 139 Cb 1.26 0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 30.58 1hw5 h VAL 139 CO 0.43 0.09 0.04 0.74 -1.01 0.00 0.00 177.57 177.86 1hw5 h THR 140 N 0.50 1.19 -0.64 3.17 2.02 -1.99 0.24 112.91 117.41 1hw5 h THR 140 Ca 0.51 -0.61 0.05 0.00 0.77 0.00 0.00 66.41 67.13 1hw5 h THR 140 Cb 0.87 1.30 -0.05 0.00 -1.74 0.00 0.00 68.15 68.53 1hw5 h THR 140 CO -0.45 0.19 0.37 1.23 0.37 0.00 0.00 175.52 177.22 1hw5 h GLY 141 N 0.07 0.93 1.56 2.16 0.00 -1.50 0.01 103.07 106.29 1hw5 h GLY 141 Ca 0.05 -0.26 -0.07 0.00 0.00 0.00 0.00 47.33 47.05 1hw5 h GLY 141 CO -0.00 0.19 -0.09 3.21 0.00 0.00 0.00 176.54 179.84 1hw5 h ARG 142 N 0.70 0.54 -0.39 4.80 3.08 0.97 -0.91 114.38 123.16 1hw5 h ARG 142 Ca 0.27 -0.15 -0.11 0.00 0.07 0.00 0.00 59.98 60.07 1hw5 h ARG 142 Cb 0.12 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1hw5 h ARG 142 CO -0.15 0.63 -0.18 0.82 -1.07 0.00 0.00 179.97 180.03 1hw5 h ILE 143 N 0.50 1.28 -0.09 2.04 2.04 0.29 -2.22 117.51 121.35 1hw5 h ILE 143 Ca 0.10 -1.31 0.00 0.00 1.00 0.00 0.00 64.86 64.65 1hw5 h ILE 143 Cb 0.47 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 1hw5 h ILE 143 CO 0.03 0.44 0.05 0.00 0.00 0.00 0.00 178.15 178.66 1hw5 h ALA 144 N 0.81 0.10 -1.00 1.87 0.00 -0.77 -2.06 119.26 118.22 1hw5 h ALA 144 Ca 0.09 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.11 1hw5 h ALA 144 Cb 0.73 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.41 1hw5 h ALA 144 CO 0.06 -0.41 0.63 0.37 0.00 0.00 0.00 179.25 179.89 1hw5 h GLN 145 N 0.11 0.97 -0.62 0.00 5.75 -1.09 -0.97 115.11 119.25 1hw5 h GLN 145 Ca 0.03 -0.06 -0.09 0.00 -0.15 0.00 0.00 58.65 58.39 1hw5 h GLN 145 Cb -0.01 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.30 1hw5 h GLN 145 CO -0.01 0.64 0.05 1.15 -2.65 0.00 0.00 178.83 178.01 1hw5 h THR 146 N 1.00 1.26 -0.19 2.39 2.02 -1.13 0.56 112.91 118.82 1hw5 h THR 146 Ca 0.49 -1.08 -0.04 0.00 0.77 0.00 0.00 66.41 66.55 1hw5 h THR 146 Cb 0.47 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 1hw5 h THR 146 CO -0.26 0.40 -0.03 -0.07 0.37 0.00 0.00 175.52 175.92 1hw5 h LEU 147 N 0.97 0.36 -0.11 2.58 3.38 -0.62 0.12 115.31 121.99 1hw5 h LEU 147 Ca 0.18 -0.35 0.04 0.00 0.09 0.00 0.00 57.88 57.84 1hw5 h LEU 147 Cb 0.49 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.09 1hw5 h LEU 147 CO 0.02 0.63 -0.25 -0.07 0.09 0.00 0.00 178.44 178.86 1hw5 h LEU 148 N 0.08 -0.76 -0.57 1.67 3.38 -0.97 1.00 115.31 119.14 1hw5 h LEU 148 Ca 0.05 0.12 0.10 0.00 0.09 0.00 0.00 57.88 58.24 1hw5 h LEU 148 Cb 0.47 0.33 -0.08 0.00 0.09 0.00 0.00 40.66 41.47 1hw5 h LEU 148 CO 0.02 -0.30 0.15 0.78 0.09 0.00 0.00 178.44 179.18 1hw5 h ASN 149 N -0.32 0.08 -0.23 -0.43 -0.26 -0.81 -1.37 115.58 112.23 1hw5 h ASN 149 Ca 0.10 0.09 -0.06 0.00 -0.56 0.00 0.00 56.30 55.87 1hw5 h ASN 149 Cb 0.46 0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 37.82 1hw5 h ASN 149 CO -0.30 0.06 -0.02 -0.07 -1.06 0.00 0.00 177.43 176.04 1hw5 h LEU 150 N 0.30 0.52 0.00 1.61 3.38 0.15 -0.50 115.31 120.77 1hw5 h LEU 150 Ca 0.29 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1hw5 h LEU 150 Cb 0.40 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1hw5 h LEU 150 CO -0.35 0.61 0.00 0.00 0.09 0.00 0.00 178.44 178.79 1hw5 n ALA 151 N -2.48 2.34 0.76 1.53 0.00 0.26 -2.42 120.51 120.50 1hw5 n ALA 151 Ca 0.01 -0.13 0.09 0.00 0.00 0.00 0.00 53.44 53.42 1hw5 n ALA 151 Cb 0.26 -1.44 0.08 0.00 0.00 0.00 0.00 19.45 18.36 1hw5 n ALA 151 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1hw5 n LYS 152 N -1.30 1.65 -2.41 0.00 5.02 -0.22 -4.80 118.16 116.11 1hw5 n LYS 152 Ca 0.12 -1.65 -0.37 0.00 -2.02 0.00 0.00 58.31 54.40 1hw5 n LYS 152 Cb 0.22 -1.36 -0.03 0.00 -0.02 0.00 0.00 35.03 33.84 1hw5 n LYS 152 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1hw5 s GLN 153 N -1.56 4.05 0.55 1.97 -0.21 -1.01 -4.92 119.66 118.52 1hw5 s GLN 153 Ca 0.22 1.66 0.32 0.00 0.02 0.00 0.00 55.36 57.59 1hw5 s GLN 153 Cb 0.16 -2.56 1.48 0.00 1.00 0.00 0.00 33.01 33.09 1hw5 s GLN 153 CO 0.24 -0.27 1.86 -1.35 -2.12 0.00 0.00 175.29 173.65 1hw5 h PRO 154 N 2.46 0.00 -0.00 2.91 0.11 -1.92 0.80 132.00 136.36 1hw5 h PRO 154 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1hw5 h PRO 154 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1hw5 h PRO 154 CO 0.62 0.00 -0.10 -0.40 -0.21 0.00 0.00 178.00 177.91 1hw5 n ASP 155 N -4.14 0.34 -4.75 -2.05 3.85 -1.26 -4.82 116.55 103.71 1hw5 n ASP 155 Ca 0.18 -0.39 -0.41 0.00 -0.71 0.00 0.00 54.79 53.45 1hw5 n ASP 155 Cb 0.98 -0.13 -0.02 0.00 -1.35 0.00 0.00 41.12 40.60 1hw5 n ASP 155 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1hw5 s ALA 156 N -2.56 3.63 0.05 2.12 0.00 0.27 -4.96 121.76 120.32 1hw5 s ALA 156 Ca 0.27 1.41 -0.15 0.00 0.00 0.00 0.00 51.96 53.49 1hw5 s ALA 156 Cb 0.20 -3.58 -0.06 0.00 0.00 0.00 0.00 23.12 19.68 1hw5 s ALA 156 CO 0.49 -0.83 0.47 -1.64 0.00 0.00 0.00 175.76 174.25 1hw5 s MET 157 N -0.81 3.97 0.55 0.00 -1.94 -0.97 -4.95 119.30 115.16 1hw5 s MET 157 Ca 0.58 0.47 -0.21 0.00 -1.71 0.00 0.00 55.69 54.83 1hw5 s MET 157 Cb -0.44 -3.14 -0.05 0.00 2.01 0.00 0.00 34.83 33.21 1hw5 s MET 157 CO 0.48 0.62 1.25 0.95 -0.01 0.00 0.00 175.02 178.32 1hw5 s THR 158 N -1.20 2.51 0.02 2.05 -4.23 -1.26 -1.22 115.64 112.32 1hw5 s THR 158 Ca 0.29 0.35 0.01 0.00 -1.18 0.00 0.00 61.69 61.16 1hw5 s THR 158 Cb -0.17 -3.16 -0.02 0.00 1.34 0.00 0.00 72.50 70.49 1hw5 s THR 158 CO 0.16 -0.03 -0.06 -2.28 -0.54 0.00 0.00 174.62 171.87 1hw5 s HIS 159 N -1.47 0.48 0.62 3.99 5.04 0.55 -4.67 115.29 119.84 1hw5 s HIS 159 Ca 0.73 -0.39 0.32 0.00 -1.54 0.00 0.00 55.06 54.18 1hw5 s HIS 159 Cb -0.34 -0.30 1.77 0.00 0.04 0.00 0.00 32.58 33.75 1hw5 s HIS 159 CO 0.39 -0.09 2.09 -1.35 -2.34 0.00 0.00 174.74 173.44 1hw5 h PRO 160 N 4.96 0.00 -0.01 2.88 0.11 -2.01 -0.98 132.00 136.95 1hw5 h PRO 160 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1hw5 h PRO 160 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1hw5 h PRO 160 CO 0.43 0.00 -0.51 -0.25 -0.21 0.00 0.00 178.00 177.46 1hw5 n ASP 161 N -3.49 1.49 0.00 -2.05 8.00 -1.26 -5.07 116.55 114.17 1hw5 n ASP 161 Ca 0.01 -1.25 0.00 0.00 0.71 0.00 0.00 54.79 54.26 1hw5 n ASP 161 Cb 0.32 0.63 0.00 0.00 -0.02 0.00 0.00 41.12 42.05 1hw5 n ASP 161 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1hw5 n GLY 162 N 1.29 -0.49 3.17 0.44 0.00 -0.37 -4.67 105.19 104.56 1hw5 n GLY 162 Ca 0.06 -0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 1hw5 n GLY 162 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1hw5 s MET 163 N 0.00 2.37 -0.14 1.61 -1.94 -0.85 -0.33 119.30 120.02 1hw5 s MET 163 Ca 0.00 -0.73 -0.07 0.00 -1.71 0.00 0.00 55.69 53.18 1hw5 s MET 163 Cb 0.00 -1.91 -0.04 0.00 2.01 0.00 0.00 34.83 34.89 1hw5 s MET 163 CO 0.00 0.21 0.12 -1.14 -0.01 0.00 0.00 175.02 174.20 1hw5 s GLN 164 N 0.22 3.63 0.12 2.03 0.74 -0.35 0.93 119.66 126.98 1hw5 s GLN 164 Ca -0.11 -0.18 0.04 0.00 0.05 0.00 0.00 55.36 55.15 1hw5 s GLN 164 Cb -0.15 -3.22 -0.04 0.00 1.10 0.00 0.00 33.01 30.70 1hw5 s GLN 164 CO 0.05 0.62 -0.09 0.96 -0.55 0.00 0.00 175.29 176.28 1hw5 s ILE 165 N -0.59 0.97 -0.23 -2.34 -4.36 0.44 -2.28 121.20 112.81 1hw5 s ILE 165 Ca 0.12 -1.88 -0.03 0.00 -0.26 0.00 0.00 60.65 58.61 1hw5 s ILE 165 Cb -0.12 -1.63 0.01 0.00 1.25 0.00 0.00 42.46 41.97 1hw5 s ILE 165 CO 0.02 -0.71 -0.05 -1.59 0.24 0.00 0.00 174.94 172.84 1hw5 s LYS 166 N -3.43 3.11 -0.21 0.37 0.00 -1.26 -0.68 119.74 117.64 1hw5 s LYS 166 Ca 0.11 -0.80 -0.27 0.00 0.00 0.00 0.00 55.97 55.02 1hw5 s LYS 166 Cb 0.01 -2.99 0.09 0.00 0.00 0.00 0.00 37.83 34.94 1hw5 s LYS 166 CO -0.01 -0.30 0.81 -1.50 0.00 0.00 0.00 175.35 174.35 1hw5 s ILE 167 N 1.40 0.00 0.75 3.79 2.07 -1.26 -5.05 121.20 122.91 1hw5 s ILE 167 Ca 0.03 0.00 -0.06 0.00 -1.41 0.00 0.00 60.65 59.21 1hw5 s ILE 167 Cb -0.15 -1.00 0.10 0.00 0.13 0.00 0.00 42.46 41.54 1hw5 s ILE 167 CO -0.04 0.00 1.05 0.42 -1.91 0.00 0.00 174.94 174.46 1hw5 s THR 168 N -0.18 2.21 0.28 4.00 -4.23 -1.26 -4.90 115.64 111.56 1hw5 s THR 168 Ca -0.02 -0.33 -0.02 0.00 -1.18 0.00 0.00 61.69 60.14 1hw5 s THR 168 Cb -0.03 -2.88 0.21 0.00 1.34 0.00 0.00 72.50 71.13 1hw5 s THR 168 CO 0.02 0.00 1.89 0.03 -0.54 0.00 0.00 174.62 176.02 1hw5 h ARG 169 N -0.74 1.00 0.02 3.99 3.08 -1.99 -2.97 114.38 116.76 1hw5 h ARG 169 Ca -0.42 -0.13 -0.20 0.00 0.07 0.00 0.00 59.98 59.30 1hw5 h ARG 169 Cb 1.29 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 31.13 1hw5 h ARG 169 CO 0.50 0.76 -0.94 0.37 -1.07 0.00 0.00 179.97 179.59 1hw5 h GLN 170 N 1.00 0.09 -0.36 0.04 4.15 -1.93 -2.31 115.11 115.79 1hw5 h GLN 170 Ca 0.25 -0.12 -0.08 0.00 0.77 0.00 0.00 58.65 59.46 1hw5 h GLN 170 Cb 0.08 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 1hw5 h GLN 170 CO -0.03 0.96 -0.10 0.93 -1.93 0.00 0.00 178.83 178.65 1hw5 h GLU 171 N 0.04 0.71 -0.73 1.69 5.08 -1.92 -1.29 114.58 118.16 1hw5 h GLU 171 Ca -0.04 -0.28 0.11 0.00 -1.00 0.00 0.00 59.36 58.16 1hw5 h GLU 171 Cb 1.62 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 30.75 1hw5 h GLU 171 CO 0.13 0.87 0.33 0.82 -1.00 0.00 0.00 179.01 180.17 1hw5 h ILE 172 N 0.50 0.76 -0.96 3.13 2.04 -1.55 0.54 117.51 121.98 1hw5 h ILE 172 Ca 0.09 -0.18 0.04 0.00 1.00 0.00 0.00 64.86 65.81 1hw5 h ILE 172 Cb 0.62 0.19 -0.06 0.00 -0.74 0.00 0.00 36.82 36.83 1hw5 h ILE 172 CO 0.04 0.10 0.63 1.23 0.00 0.00 0.00 178.15 180.14 1hw5 h GLY 173 N 0.53 1.39 2.00 5.37 0.00 -1.03 0.86 103.07 112.19 1hw5 h GLY 173 Ca 0.38 -0.47 -0.15 0.00 0.00 0.00 0.00 47.33 47.08 1hw5 h GLY 173 CO -0.33 0.40 -0.74 1.46 0.00 0.00 0.00 176.54 177.33 1hw5 h GLN 174 N 1.19 0.00 -0.15 4.80 4.20 0.07 0.61 115.11 125.83 1hw5 h GLN 174 Ca 0.38 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.91 1hw5 h GLN 174 Cb 0.03 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.82 1hw5 h GLN 174 CO -0.12 0.74 -0.63 0.82 -0.67 0.00 0.00 178.83 178.97 1hw5 h ILE 175 N 0.00 1.32 -0.02 2.54 2.04 0.11 0.45 117.51 123.95 1hw5 h ILE 175 Ca -0.01 -1.87 0.00 0.00 1.00 0.00 0.00 64.86 63.98 1hw5 h ILE 175 Cb 1.31 2.04 0.00 0.00 -0.74 0.00 0.00 36.82 39.43 1hw5 h ILE 175 CO 0.10 0.58 -0.19 1.33 0.00 0.00 0.00 178.15 179.97 1hw5 n VAL 176 N -4.08 0.00 -2.24 1.67 0.24 0.19 -4.62 118.33 109.48 1hw5 n VAL 176 Ca -0.07 -0.37 -0.01 0.00 -2.04 0.00 0.00 64.34 61.86 1hw5 n VAL 176 Cb 0.67 1.25 0.00 0.00 -1.47 0.00 0.00 33.84 34.28 1hw5 n VAL 176 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1hw5 n GLY 177 N 1.36 0.61 3.30 7.63 0.00 0.20 -5.02 105.19 113.27 1hw5 n GLY 177 Ca 0.13 -0.77 -0.16 0.00 0.00 0.00 0.00 46.02 45.21 1hw5 n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hw5 s SER 179 N -3.30 5.67 0.53 0.00 1.04 -1.26 -4.29 113.70 112.09 1hw5 s SER 179 Ca 0.38 2.02 0.22 0.00 0.48 0.00 0.00 55.95 59.04 1hw5 s SER 179 Cb 0.08 -2.56 1.35 0.00 0.10 0.00 0.00 66.02 64.99 1hw5 s SER 179 CO 0.13 -1.25 2.06 0.08 0.98 0.00 0.00 173.24 175.25 1hw5 h ARG 180 N 0.79 0.00 -0.14 4.02 0.11 -1.90 -1.51 114.38 115.74 1hw5 h ARG 180 Ca -0.48 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 59.55 1hw5 h ARG 180 Cb 1.24 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.32 1hw5 h ARG 180 CO 0.57 0.00 -0.10 1.49 0.10 0.00 0.00 179.97 182.02 1hw5 h GLU 181 N 0.00 0.32 -0.89 0.08 4.81 -1.91 -0.95 114.58 116.04 1hw5 h GLU 181 Ca 0.15 -0.16 0.06 0.00 -0.13 0.00 0.00 59.36 59.28 1hw5 h GLU 181 Cb 0.59 -0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.91 1hw5 h GLU 181 CO -0.00 0.68 0.58 1.15 -0.73 0.00 0.00 179.01 180.69 1hw5 h THR 182 N -0.03 1.07 -0.56 0.32 2.02 -1.68 -0.12 112.91 113.93 1hw5 h THR 182 Ca 0.03 -0.34 -0.11 0.00 0.77 0.00 0.00 66.41 66.76 1hw5 h THR 182 Cb 0.60 -0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 1hw5 h THR 182 CO 0.03 0.18 -0.08 0.58 0.37 0.00 0.00 175.52 176.60 1hw5 h VAL 183 N 1.00 1.27 -0.39 3.16 2.07 -1.16 -1.66 116.25 120.54 1hw5 h VAL 183 Ca 0.38 -1.23 -0.03 0.00 0.82 0.00 0.00 66.70 66.64 1hw5 h VAL 183 Cb 0.20 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1hw5 h VAL 183 CO -0.14 0.44 0.12 1.23 0.02 0.00 0.00 177.57 179.24 1hw5 h GLY 184 N 0.95 0.64 0.98 2.17 0.00 -0.21 0.40 103.07 108.00 1hw5 h GLY 184 Ca 0.15 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 1hw5 h GLY 184 CO 0.04 0.35 0.13 3.21 0.00 0.00 0.00 176.54 180.28 1hw5 h ARG 185 N 0.48 0.28 -0.20 4.80 3.08 -0.87 -2.33 114.38 119.62 1hw5 h ARG 185 Ca 0.12 -0.02 -0.21 0.00 0.07 0.00 0.00 59.98 59.94 1hw5 h ARG 185 Cb 0.25 -0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.24 1hw5 h ARG 185 CO -0.00 0.22 -0.70 0.82 -1.07 0.00 0.00 179.97 179.24 1hw5 h ILE 186 N 0.27 1.28 -0.87 2.04 2.04 -1.22 -2.09 117.51 118.95 1hw5 h ILE 186 Ca 0.08 -1.89 0.15 0.00 1.00 0.00 0.00 64.86 64.20 1hw5 h ILE 186 Cb 0.00 1.85 -0.07 0.00 -0.74 0.00 0.00 36.82 37.87 1hw5 h ILE 186 CO -0.01 0.60 0.56 -0.07 0.00 0.00 0.00 178.15 179.23 1hw5 h LEU 187 N 0.59 0.59 -0.55 1.44 3.38 -0.91 -0.53 115.31 119.32 1hw5 h LEU 187 Ca -0.03 0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 1hw5 h LEU 187 Cb 1.32 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 1hw5 h LEU 187 CO 0.15 0.29 -0.41 0.50 0.09 0.00 0.00 178.44 179.06 1hw5 h LYS 188 N 0.62 0.71 -0.26 1.13 1.63 -0.81 -1.63 116.57 117.96 1hw5 h LYS 188 Ca 0.44 -0.37 -0.02 0.00 -0.85 0.00 0.00 60.65 59.85 1hw5 h LYS 188 Cb 0.78 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.41 1hw5 h LYS 188 CO -0.19 0.99 0.09 1.98 -3.45 0.00 0.00 179.45 178.87 1hw5 h MET 189 N 0.57 0.39 -0.67 1.90 4.05 -0.63 -0.38 114.93 120.15 1hw5 h MET 189 Ca 0.04 -0.08 -0.02 0.00 -0.28 0.00 0.00 59.70 59.37 1hw5 h MET 189 Cb 0.95 -0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 31.66 1hw5 h MET 189 CO 0.09 0.44 0.36 -0.07 0.23 0.00 0.00 176.91 177.95 1hw5 h LEU 190 N 0.26 0.84 0.22 3.39 3.38 -1.07 -0.47 115.31 121.86 1hw5 h LEU 190 Ca 0.08 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1hw5 h LEU 190 Cb 0.20 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1hw5 h LEU 190 CO -0.01 0.69 -0.25 -0.08 0.09 0.00 0.00 178.44 178.88 1hw5 h GLU 191 N 0.94 -0.50 0.00 1.13 4.81 -1.09 -0.29 114.58 119.58 1hw5 h GLU 191 Ca 0.24 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.49 1hw5 h GLU 191 Cb 0.04 0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 1hw5 h GLU 191 CO -0.04 -0.34 -0.06 -0.44 -0.73 0.00 0.00 179.01 177.41 1hw5 h ASP 192 N -0.52 0.00 -0.03 1.04 3.45 -0.41 0.21 116.42 120.15 1hw5 h ASP 192 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1hw5 h ASP 192 Cb 0.50 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.27 1hw5 h ASP 192 CO -0.08 0.06 0.00 0.00 -1.57 0.00 0.00 179.24 177.65 1hw5 n GLN 193 N -3.37 1.14 -3.88 3.56 6.02 -0.24 -4.90 117.38 115.70 1hw5 n GLN 193 Ca -0.02 -0.21 -0.26 0.00 -0.01 0.00 0.00 57.00 56.51 1hw5 n GLN 193 Cb 0.20 -1.28 0.00 0.00 1.02 0.00 0.00 30.24 30.18 1hw5 n GLN 193 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1hw5 n ASN 194 N -0.56 -1.52 -0.07 1.08 5.03 0.74 -4.89 115.26 115.08 1hw5 n ASN 194 Ca 0.13 -0.91 -0.08 0.00 0.87 0.00 0.00 54.58 54.59 1hw5 n ASN 194 Cb 0.11 -3.51 -0.09 0.00 -1.02 0.00 0.00 39.78 35.27 1hw5 n ASN 194 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1hw5 n LEU 195 N -4.40 1.25 -4.10 3.41 4.77 -0.17 -4.97 117.00 112.80 1hw5 n LEU 195 Ca -0.22 -0.04 -0.09 0.00 -0.03 0.00 0.00 56.01 55.63 1hw5 n LEU 195 Cb 0.64 -0.06 -0.10 0.00 -2.33 0.00 0.00 43.42 41.58 1hw5 n LEU 195 CO 0.74 0.51 -0.30 0.27 -1.33 0.00 0.00 177.39 177.28 1hw5 s ILE 196 N -2.31 0.15 -0.19 -0.08 -4.36 -1.24 -0.73 121.20 112.43 1hw5 s ILE 196 Ca -0.13 -1.81 -0.02 0.00 -0.26 0.00 0.00 60.65 58.43 1hw5 s ILE 196 Cb 0.05 -1.80 -0.01 0.00 1.25 0.00 0.00 42.46 41.94 1hw5 s ILE 196 CO 0.46 -0.67 -0.08 -0.55 0.24 0.00 0.00 174.94 174.34 1hw5 s SER 197 N -2.99 4.15 -0.21 4.36 0.15 0.31 -4.24 113.70 115.24 1hw5 s SER 197 Ca 0.16 -0.38 -0.05 0.00 0.70 0.00 0.00 55.95 56.38 1hw5 s SER 197 Cb 0.07 -1.68 -0.02 0.00 -1.71 0.00 0.00 66.02 62.67 1hw5 s SER 197 CO -0.03 0.05 0.01 0.00 1.20 0.00 0.00 173.24 174.46 1hw5 s ALA 198 N 1.07 3.05 0.00 5.45 0.00 -1.26 -0.45 121.76 129.62 1hw5 s ALA 198 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.95 1hw5 s ALA 198 Cb -0.15 -1.82 0.00 0.00 0.00 0.00 0.00 23.12 21.15 1hw5 s ALA 198 CO -0.01 -0.22 0.00 0.72 0.00 0.00 0.00 175.76 176.25 1hw5 n HIS 199 N 4.38 0.00 0.83 0.00 8.25 -1.26 -4.98 115.22 122.44 1hw5 n HIS 199 Ca -0.17 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.39 1hw5 n HIS 199 Cb 0.52 0.00 0.46 0.00 1.12 0.00 0.00 29.99 32.09 1hw5 n HIS 199 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1hw5 n GLY 200 N 0.00 -1.02 3.83 -1.41 0.00 -1.26 -4.75 105.19 100.57 1hw5 n GLY 200 Ca 0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 1hw5 n GLY 200 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hw5 s LYS 201 N -2.74 1.85 -0.16 1.61 1.02 -1.26 -5.00 119.74 115.06 1hw5 s LYS 201 Ca 0.15 -1.13 -0.00 0.00 0.02 0.00 0.00 55.97 55.00 1hw5 s LYS 201 Cb 0.13 0.56 -0.01 0.00 -0.52 0.00 0.00 37.83 37.99 1hw5 s LYS 201 CO 0.32 -0.86 -0.13 0.99 -0.92 0.00 0.00 175.35 174.75 1hw5 s THR 202 N -2.84 2.85 -0.28 2.17 2.01 0.14 -4.51 115.64 115.18 1hw5 s THR 202 Ca 0.15 -0.71 -0.10 0.00 0.31 0.00 0.00 61.69 61.34 1hw5 s THR 202 Cb -0.05 -2.22 -0.03 0.00 0.01 0.00 0.00 72.50 70.21 1hw5 s THR 202 CO 0.08 0.51 0.15 -0.63 -0.69 0.00 0.00 174.62 174.04 1hw5 s ILE 203 N 0.79 4.88 -0.14 1.82 1.01 0.41 0.17 121.20 130.14 1hw5 s ILE 203 Ca -0.05 -0.05 -0.16 0.00 0.00 0.00 0.00 60.65 60.39 1hw5 s ILE 203 Cb -0.15 -3.35 -0.04 0.00 0.01 0.00 0.00 42.46 38.93 1hw5 s ILE 203 CO 0.01 0.24 0.37 -0.69 0.00 0.00 0.00 174.94 174.87 1hw5 s VAL 204 N 1.69 5.25 0.00 2.92 1.01 0.27 -0.53 120.40 131.00 1hw5 s VAL 204 Ca 0.06 0.73 0.00 0.00 0.00 0.00 0.00 61.98 62.77 1hw5 s VAL 204 Cb -0.16 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.51 1hw5 s VAL 204 CO 0.08 0.37 0.00 1.33 0.00 0.00 0.00 175.10 176.88