#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hd5 n GLY 29 N 0.00 3.21 3.71 1.69 0.00 -1.26 -5.04 105.19 107.50 3hd5 n GLY 29 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3hd5 n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hd5 s ALA 30 N -2.82 3.55 0.43 4.61 0.00 -1.26 -4.92 121.76 121.35 3hd5 s ALA 30 Ca 0.00 1.04 0.11 0.00 0.00 0.00 0.00 51.96 53.11 3hd5 s ALA 30 Cb 0.00 -3.52 0.95 0.00 0.00 0.00 0.00 23.12 20.55 3hd5 s ALA 30 CO 0.00 -0.60 2.03 1.96 0.00 0.00 0.00 175.76 179.16 3hd5 h GLN 31 N 6.88 0.27 0.00 0.00 4.20 -1.88 -3.47 115.11 121.11 3hd5 h GLN 31 Ca -0.42 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.26 3hd5 h GLN 31 Cb 1.21 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.94 3hd5 h GLN 31 CO 0.86 0.26 0.00 1.04 -0.67 0.00 0.00 178.83 180.31 3hd5 n GLN 32 N -4.42 0.00 -3.86 1.46 1.13 0.85 -4.80 117.38 107.74 3hd5 n GLN 32 Ca -0.00 0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 55.01 3hd5 n GLN 32 Cb 0.14 0.00 0.02 0.00 0.11 0.00 0.00 30.24 30.52 3hd5 n GLN 32 CO 0.00 0.00 0.00 1.52 -1.44 0.00 0.00 177.06 177.14 3hd5 s TYR 33 N 0.00 0.10 0.04 1.08 1.13 -1.26 -4.16 117.35 114.28 3hd5 s TYR 33 Ca 0.00 -0.60 -0.01 0.00 -1.41 0.00 0.00 57.07 55.05 3hd5 s TYR 33 Cb 0.00 0.76 -0.03 0.00 -1.10 0.00 0.00 41.96 41.58 3hd5 s TYR 33 CO 0.00 -1.16 -0.03 0.14 -2.51 0.00 0.00 175.55 171.98 3hd5 s VAL 34 N -2.16 0.21 0.37 -3.49 -7.23 -1.26 -5.01 120.40 101.82 3hd5 s VAL 34 Ca 0.20 -1.55 -0.24 0.00 -1.81 0.00 0.00 61.98 58.57 3hd5 s VAL 34 Cb -0.04 -1.16 -0.10 0.00 0.56 0.00 0.00 36.38 35.64 3hd5 s VAL 34 CO 0.08 -0.85 0.97 0.20 -0.31 0.00 0.00 175.10 175.19 3hd5 s ASN 35 N -2.50 7.10 -0.22 4.85 0.02 -1.26 -4.40 114.94 118.52 3hd5 s ASN 35 Ca 0.01 1.84 -0.06 0.00 -1.02 0.00 0.00 52.86 53.63 3hd5 s ASN 35 Cb 0.03 -2.57 -0.03 0.00 0.02 0.00 0.00 41.25 38.70 3hd5 s ASN 35 CO -0.07 -0.25 0.04 -0.63 0.02 0.00 0.00 177.10 176.21 3hd5 s ILE 36 N -1.78 4.20 -0.02 0.60 1.01 0.21 -4.94 121.20 120.47 3hd5 s ILE 36 Ca 0.55 -0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.98 3hd5 s ILE 36 Cb -0.17 -2.92 0.03 0.00 0.01 0.00 0.00 42.46 39.41 3hd5 s ILE 36 CO 0.22 0.40 0.01 0.20 0.00 0.00 0.00 174.94 175.76 3hd5 s ASN 37 N 1.16 0.29 0.83 3.58 -0.87 -1.26 -3.16 114.94 115.51 3hd5 s ASN 37 Ca 0.04 -0.01 -0.11 0.00 -1.57 0.00 0.00 52.86 51.21 3hd5 s ASN 37 Cb -0.14 -0.16 0.09 0.00 -0.02 0.00 0.00 41.25 41.02 3hd5 s ASN 37 CO 0.02 -0.10 1.09 -2.16 -2.57 0.00 0.00 177.10 173.39 3hd5 s PRO 38 N 0.94 1.79 0.00 -0.60 0.04 -1.26 -5.05 135.00 130.86 3hd5 s PRO 38 Ca -0.09 0.83 0.00 0.00 0.04 0.00 0.00 61.00 61.78 3hd5 s PRO 38 Cb -0.12 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.55 3hd5 s PRO 38 CO -0.02 -1.87 0.00 -0.35 0.04 0.00 0.00 177.00 174.80 3hd5 n PRO 39 N -3.63 2.89 -4.01 0.56 -0.04 -1.19 -5.01 135.00 124.56 3hd5 n PRO 39 Ca 0.07 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.40 3hd5 n PRO 39 Cb 0.55 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.87 3hd5 n PRO 39 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3hd5 s PRO 41 N 0.00 0.23 0.33 0.54 0.04 -1.26 -5.00 135.00 129.88 3hd5 s PRO 41 Ca 0.00 -0.16 -0.29 0.00 0.04 0.00 0.00 61.00 60.59 3hd5 s PRO 41 Cb 0.00 -0.19 -0.11 0.00 0.04 0.00 0.00 34.50 34.25 3hd5 s PRO 41 CO 0.00 0.05 1.44 0.45 0.04 0.00 0.00 177.00 178.98 3hd5 s SER 42 N -0.24 6.52 -0.03 6.66 0.15 -1.26 -4.91 113.70 120.60 3hd5 s SER 42 Ca -0.01 2.87 0.17 0.00 0.70 0.00 0.00 55.95 59.68 3hd5 s SER 42 Cb -0.02 -2.65 0.54 0.00 -1.71 0.00 0.00 66.02 62.17 3hd5 s SER 42 CO -0.00 -0.75 1.44 0.47 1.20 0.00 0.00 173.24 175.59 3hd5 n ASP 43 N 1.11 3.37 -3.77 5.45 8.00 -1.26 -4.64 116.55 124.81 3hd5 n ASP 43 Ca 0.03 -2.11 -0.30 0.00 0.71 0.00 0.00 54.79 53.12 3hd5 n ASP 43 Cb 0.40 -0.43 -0.15 0.00 -0.02 0.00 0.00 41.12 40.92 3hd5 n ASP 43 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3hd5 s THR 44 N -1.39 1.16 0.03 -3.53 2.01 -1.26 -5.10 115.64 107.56 3hd5 s THR 44 Ca 0.40 -1.71 -0.38 0.00 0.31 0.00 0.00 61.69 60.31 3hd5 s THR 44 Cb 0.22 -1.86 -0.17 0.00 0.01 0.00 0.00 72.50 70.69 3hd5 s THR 44 CO 0.25 -0.70 1.34 -0.81 -0.69 0.00 0.00 174.62 174.00 3hd5 n PRO 45 N 4.56 0.93 -0.67 4.92 -0.04 -1.26 -0.76 135.00 142.69 3hd5 n PRO 45 Ca 0.01 0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.80 3hd5 n PRO 45 Cb 0.41 -1.96 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 3hd5 n PRO 45 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hd5 n GLY 46 N 2.53 1.63 3.41 0.55 0.00 -1.26 -5.01 105.19 107.03 3hd5 n GLY 46 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 3hd5 n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hd5 s LYS 47 N -0.01 2.40 -0.16 1.61 -0.14 0.06 -4.91 119.74 118.59 3hd5 s LYS 47 Ca 0.00 -0.78 -0.26 0.00 -1.36 0.00 0.00 55.97 53.57 3hd5 s LYS 47 Cb 0.00 -2.27 -0.01 0.00 -1.68 0.00 0.00 37.83 33.87 3hd5 s LYS 47 CO 0.00 0.59 0.85 0.42 -0.76 0.00 0.00 175.35 176.45 3hd5 s ILE 48 N -0.65 4.87 0.00 2.17 1.01 0.93 -4.68 121.20 124.85 3hd5 s ILE 48 Ca 0.10 1.68 -0.16 0.00 0.00 0.00 0.00 60.65 62.26 3hd5 s ILE 48 Cb -0.11 -4.16 -0.06 0.00 0.01 0.00 0.00 42.46 38.15 3hd5 s ILE 48 CO 0.00 0.02 0.46 -1.61 0.00 0.00 0.00 174.94 173.81 3hd5 s GLU 49 N 2.15 4.05 -0.23 2.79 2.02 -1.26 -1.30 118.70 126.92 3hd5 s GLU 49 Ca 0.39 0.50 0.02 0.00 0.02 0.00 0.00 54.97 55.90 3hd5 s GLU 49 Cb -0.17 -3.25 0.04 0.00 0.10 0.00 0.00 34.13 30.85 3hd5 s GLU 49 CO 0.13 0.61 -0.13 0.08 0.02 0.00 0.00 175.26 175.96 3hd5 s VAL 50 N -0.85 2.22 -0.20 2.63 1.01 -0.18 -1.13 120.40 123.89 3hd5 s VAL 50 Ca 0.25 -1.34 -0.07 0.00 0.00 0.00 0.00 61.98 60.82 3hd5 s VAL 50 Cb -0.17 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 3hd5 s VAL 50 CO 0.14 0.18 0.06 -0.76 0.00 0.00 0.00 175.10 174.73 3hd5 s LEU 51 N 1.19 3.68 -0.38 3.92 1.43 0.12 -0.98 118.68 127.67 3hd5 s LEU 51 Ca -0.03 -0.01 -0.11 0.00 -1.03 0.00 0.00 54.13 52.94 3hd5 s LEU 51 Cb -0.17 -1.95 0.03 0.00 0.03 0.00 0.00 46.19 44.13 3hd5 s LEU 51 CO -0.08 0.11 0.22 -0.70 0.23 0.00 0.00 176.35 176.13 3hd5 s GLU 52 N 0.73 2.87 -0.08 1.70 2.12 0.57 -0.90 118.70 125.72 3hd5 s GLU 52 Ca 0.03 -1.06 -0.26 0.00 0.36 0.00 0.00 54.97 54.05 3hd5 s GLU 52 Cb -0.13 -3.75 -0.03 0.00 0.26 0.00 0.00 34.13 30.47 3hd5 s GLU 52 CO 0.02 -0.69 0.82 -0.06 -0.54 0.00 0.00 175.26 174.81 3hd5 s PHE 53 N 1.57 3.56 0.32 5.30 0.08 0.12 -0.34 117.98 128.59 3hd5 s PHE 53 Ca 0.02 1.39 0.01 0.00 0.12 0.00 0.00 56.93 58.47 3hd5 s PHE 53 Cb -0.19 -2.96 -0.01 0.00 -0.57 0.00 0.00 43.02 39.29 3hd5 s PHE 53 CO 0.07 -0.04 0.37 -0.59 -0.10 0.00 0.00 175.22 174.93 3hd5 s PHE 54 N 1.25 1.33 -0.16 0.36 -0.71 -0.52 -2.14 117.98 117.40 3hd5 s PHE 54 Ca 0.42 -1.43 -0.12 0.00 -1.04 0.00 0.00 56.93 54.76 3hd5 s PHE 54 Cb -0.18 -0.36 0.05 0.00 -1.21 0.00 0.00 43.02 41.31 3hd5 s PHE 54 CO 0.19 -0.99 0.41 0.00 -1.34 0.00 0.00 175.22 173.49 3hd5 s ALA 55 N -3.32 -1.01 0.42 1.99 0.00 -1.26 -0.90 121.76 117.67 3hd5 s ALA 55 Ca 0.35 1.29 0.10 0.00 0.00 0.00 0.00 51.96 53.70 3hd5 s ALA 55 Cb 0.01 -0.77 0.91 0.00 0.00 0.00 0.00 23.12 23.28 3hd5 s ALA 55 CO 0.22 -0.22 2.01 1.88 0.00 0.00 0.00 175.76 179.65 3hd5 h TYR 56 N 6.15 0.28 0.00 0.00 0.05 -1.93 -1.90 116.97 119.62 3hd5 h TYR 56 Ca -0.31 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.46 3hd5 h TYR 56 Cb 1.18 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.83 3hd5 h TYR 56 CO 0.34 0.28 0.00 0.25 -1.05 0.00 0.00 178.16 177.98 3hd5 n THR 57 N -4.40 0.25 -2.96 -2.88 -2.24 -1.26 -4.79 114.28 96.01 3hd5 n THR 57 Ca -0.00 0.06 -0.41 0.00 -2.27 0.00 0.00 64.05 61.43 3hd5 n THR 57 Cb 0.16 -0.65 -0.05 0.00 -2.10 0.00 0.00 70.33 67.70 3hd5 n THR 57 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hd5 h PRO 59 N 7.53 1.24 -0.18 0.00 0.11 -1.87 -1.31 132.00 137.52 3hd5 h PRO 59 Ca -0.27 -0.12 -0.15 0.00 0.11 0.00 0.00 66.00 65.56 3hd5 h PRO 59 Cb 1.12 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 3hd5 h PRO 59 CO 0.83 0.88 -0.52 0.45 -0.21 0.00 0.00 178.00 179.43 3hd5 h HIS 60 N 1.26 0.64 -0.41 0.65 3.86 -1.92 -1.33 115.15 117.91 3hd5 h HIS 60 Ca 0.33 -0.22 -0.07 0.00 -1.16 0.00 0.00 60.37 59.25 3hd5 h HIS 60 Cb -0.03 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.30 3hd5 h HIS 60 CO 0.01 0.93 -0.02 0.00 0.86 0.00 0.00 177.93 179.70 3hd5 h ALA 62 N 0.88 0.60 -0.56 0.00 0.00 -1.11 -1.28 119.26 117.77 3hd5 h ALA 62 Ca 0.11 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3hd5 h ALA 62 Cb 0.52 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3hd5 h ALA 62 CO 0.03 0.07 0.12 0.00 0.00 0.00 0.00 179.25 179.47 3hd5 h ALA 63 N 1.15 1.15 0.00 0.00 0.00 -1.07 -3.11 119.26 117.37 3hd5 h ALA 63 Ca 0.17 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3hd5 h ALA 63 Cb -0.03 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.53 3hd5 h ALA 63 CO -0.03 0.57 -0.48 0.97 0.00 0.00 0.00 179.25 180.28 3hd5 h ILE 64 N 0.84 0.00 -0.63 0.00 2.10 -0.99 -3.39 117.51 115.44 3hd5 h ILE 64 Ca 0.18 -0.79 0.11 0.00 1.08 0.00 0.00 64.86 65.44 3hd5 h ILE 64 Cb 0.33 1.52 -0.12 0.00 -1.09 0.00 0.00 36.82 37.47 3hd5 h ILE 64 CO 0.00 0.00 -0.35 -0.08 -1.08 0.00 0.00 178.15 176.65 3hd5 h GLU 65 N 0.00 -0.14 -1.87 2.19 4.57 -1.16 0.07 114.58 118.23 3hd5 h GLU 65 Ca 0.00 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 3hd5 h GLU 65 Cb 0.90 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.52 3hd5 h GLU 65 CO 0.00 -0.10 0.00 -0.35 -1.18 0.00 0.00 179.01 177.38 3hd5 n PRO 66 N -5.44 0.16 0.00 0.92 -0.04 -1.26 -0.75 135.00 128.60 3hd5 n PRO 66 Ca 0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.51 3hd5 n PRO 66 Cb 0.36 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.40 3hd5 n PRO 66 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3hd5 n VAL 68 N 1.10 0.00 -0.26 0.52 0.31 0.01 -1.67 118.33 118.34 3hd5 n VAL 68 Ca 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.34 3hd5 n VAL 68 Cb 0.08 0.00 0.14 0.00 -0.91 0.00 0.00 33.84 33.15 3hd5 n VAL 68 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3hd5 h GLU 69 N 0.00 0.71 -0.49 5.55 5.08 -1.19 0.13 114.58 124.38 3hd5 h GLU 69 Ca 0.00 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 3hd5 h GLU 69 Cb 0.00 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 3hd5 h GLU 69 CO 0.00 0.47 -0.05 0.22 -1.00 0.00 0.00 179.01 178.65 3hd5 h ASP 70 N 0.74 0.89 -0.65 1.42 3.58 -1.56 -2.93 116.42 117.90 3hd5 h ASP 70 Ca 0.35 -0.33 0.04 0.00 0.42 0.00 0.00 57.03 57.51 3hd5 h ASP 70 Cb 0.29 -0.24 -0.05 0.00 1.72 0.00 0.00 39.33 41.05 3hd5 h ASP 70 CO -0.22 1.01 0.38 -0.25 -2.88 0.00 0.00 179.24 177.28 3hd5 h TRP 71 N 0.75 0.70 0.00 0.28 7.01 -1.49 -2.35 115.95 120.86 3hd5 h TRP 71 Ca 0.13 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.14 3hd5 h TRP 71 Cb 0.59 -0.22 -0.00 0.00 -2.10 0.00 0.00 29.16 27.42 3hd5 h TRP 71 CO 0.04 0.37 -0.09 0.00 -2.79 0.00 0.00 178.44 175.97 3hd5 h ALA 72 N 1.31 1.68 0.00 2.65 0.00 -0.62 -2.49 119.26 121.80 3hd5 h ALA 72 Ca 0.28 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 3hd5 h ALA 72 Cb 0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3hd5 h ALA 72 CO -0.14 0.12 -0.18 0.87 0.00 0.00 0.00 179.25 179.92 3hd5 h LYS 73 N 0.00 0.00 -0.23 0.00 1.57 -1.31 -2.82 116.57 113.79 3hd5 h LYS 73 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3hd5 h LYS 73 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.49 3hd5 h LYS 73 CO 0.01 0.18 0.00 0.25 -0.57 0.00 0.00 179.45 179.32 3hd5 n THR 74 N -4.01 1.58 -1.22 -0.16 -2.24 -0.96 -5.04 114.28 102.23 3hd5 n THR 74 Ca -0.02 -1.48 -0.32 0.00 -2.27 0.00 0.00 64.05 59.96 3hd5 n THR 74 Cb 0.26 0.13 0.10 0.00 -2.10 0.00 0.00 70.33 68.73 3hd5 n THR 74 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hd5 s ALA 75 N -1.90 2.05 0.39 6.98 0.00 -1.06 -4.95 121.76 123.28 3hd5 s ALA 75 Ca 0.28 0.51 -0.27 0.00 0.00 0.00 0.00 51.96 52.48 3hd5 s ALA 75 Cb 0.20 -3.36 -0.11 0.00 0.00 0.00 0.00 23.12 19.86 3hd5 s ALA 75 CO 0.10 -1.98 1.38 -2.30 0.00 0.00 0.00 175.76 172.96 3hd5 n PRO 76 N -3.39 2.30 0.14 0.00 -0.02 -1.26 -4.90 135.00 127.86 3hd5 n PRO 76 Ca 0.11 0.81 0.15 0.00 -2.02 0.00 0.00 63.50 62.55 3hd5 n PRO 76 Cb 0.52 -2.51 0.70 0.00 -0.02 0.00 0.00 33.50 32.19 3hd5 n PRO 76 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 3hd5 h GLN 77 N 2.55 0.00 -0.52 -0.52 1.08 -2.00 0.54 115.11 116.24 3hd5 h GLN 77 Ca -0.49 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.71 3hd5 h GLN 77 Cb 1.27 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.70 3hd5 h GLN 77 CO 0.62 0.00 0.00 -0.40 -0.95 0.00 0.00 178.83 178.10 3hd5 n ASP 78 N -4.32 2.78 -4.38 1.46 5.75 -1.26 -4.86 116.55 111.72 3hd5 n ASP 78 Ca 0.03 -2.13 -0.31 0.00 -0.01 0.00 0.00 54.79 52.37 3hd5 n ASP 78 Cb 0.36 -0.37 -0.14 0.00 -1.03 0.00 0.00 41.12 39.93 3hd5 n ASP 78 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3hd5 s VAL 79 N -1.54 2.45 -0.00 2.12 1.01 0.18 -0.05 120.40 124.57 3hd5 s VAL 79 Ca 0.31 -1.07 0.04 0.00 0.00 0.00 0.00 61.98 61.27 3hd5 s VAL 79 Cb 0.18 -1.93 -0.01 0.00 0.00 0.00 0.00 36.38 34.62 3hd5 s VAL 79 CO 0.18 0.51 -0.13 0.54 0.00 0.00 0.00 175.10 176.21 3hd5 s VAL 80 N -0.72 0.99 -0.13 2.92 0.11 -0.42 -4.76 120.40 118.38 3hd5 s VAL 80 Ca 0.11 -0.58 -0.05 0.00 -2.93 0.00 0.00 61.98 58.53 3hd5 s VAL 80 Cb -0.10 -0.84 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 3hd5 s VAL 80 CO 0.01 0.25 0.05 -0.22 -3.33 0.00 0.00 175.10 171.86 3hd5 s LEU 81 N -0.38 3.83 -0.03 2.54 2.96 -1.26 -1.02 118.68 125.33 3hd5 s LEU 81 Ca 0.04 0.18 0.03 0.00 -0.22 0.00 0.00 54.13 54.16 3hd5 s LEU 81 Cb -0.05 -1.93 0.00 0.00 0.50 0.00 0.00 46.19 44.71 3hd5 s LEU 81 CO -0.00 0.30 -0.11 -0.54 -1.32 0.00 0.00 176.35 174.68 3hd5 s LYS 82 N -0.37 1.13 -0.20 1.98 1.02 -0.15 -4.96 119.74 118.19 3hd5 s LYS 82 Ca 0.09 -0.37 -0.09 0.00 0.02 0.00 0.00 55.97 55.62 3hd5 s LYS 82 Cb -0.12 -1.04 -0.05 0.00 -0.52 0.00 0.00 37.83 36.11 3hd5 s LYS 82 CO 0.02 0.14 0.11 -0.65 -0.92 0.00 0.00 175.35 174.05 3hd5 s GLN 83 N 0.16 4.09 -0.20 1.68 -0.21 -1.26 -0.31 119.66 123.60 3hd5 s GLN 83 Ca -0.03 -0.28 0.01 0.00 0.02 0.00 0.00 55.36 55.08 3hd5 s GLN 83 Cb -0.09 -3.36 0.04 0.00 1.00 0.00 0.00 33.01 30.60 3hd5 s GLN 83 CO 0.01 0.25 -0.12 0.08 -2.12 0.00 0.00 175.29 173.38 3hd5 s VAL 84 N 0.49 1.80 0.00 1.09 1.01 0.54 -4.93 120.40 120.41 3hd5 s VAL 84 Ca 0.06 -1.09 -0.30 0.00 0.00 0.00 0.00 61.98 60.65 3hd5 s VAL 84 Cb -0.12 -1.83 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 3hd5 s VAL 84 CO -0.00 0.21 1.21 -2.16 0.00 0.00 0.00 175.10 174.36 3hd5 s PRO 85 N 1.33 4.39 0.37 2.72 0.04 -1.26 -1.44 135.00 141.16 3hd5 s PRO 85 Ca -0.01 1.74 0.07 0.00 0.04 0.00 0.00 61.00 62.84 3hd5 s PRO 85 Cb -0.16 -3.46 -0.02 0.00 0.04 0.00 0.00 34.50 30.90 3hd5 s PRO 85 CO -0.09 -0.36 0.39 0.96 0.04 0.00 0.00 177.00 177.94 3hd5 s ILE 86 N 1.67 3.27 -0.16 0.56 -5.25 -0.08 -4.61 121.20 116.60 3hd5 s ILE 86 Ca 0.58 -1.25 -0.04 0.00 -0.99 0.00 0.00 60.65 58.95 3hd5 s ILE 86 Cb -0.27 -3.14 0.07 0.00 2.95 0.00 0.00 42.46 42.07 3hd5 s ILE 86 CO 0.26 -0.09 0.18 0.00 -1.79 0.00 0.00 174.94 173.50 3hd5 s ALA 87 N -2.34 -0.15 -1.22 2.27 0.00 -1.26 -4.77 121.76 114.30 3hd5 s ALA 87 Ca 0.46 0.30 0.27 0.00 0.00 0.00 0.00 51.96 52.99 3hd5 s ALA 87 Cb -0.06 -1.11 0.89 0.00 0.00 0.00 0.00 23.12 22.84 3hd5 s ALA 87 CO 0.29 -0.98 1.67 1.19 0.00 0.00 0.00 175.76 177.93 3hd5 n PHE 88 N 5.32 0.00 -3.73 0.00 3.72 -1.26 -4.88 117.46 116.63 3hd5 n PHE 88 Ca -0.05 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.25 3hd5 n PHE 88 Cb 0.50 -0.29 -0.04 0.00 -0.94 0.00 0.00 39.48 38.71 3hd5 n PHE 88 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3hd5 s ASN 89 N -2.83 -0.28 0.23 4.37 2.20 -1.26 -5.06 114.94 112.30 3hd5 s ASN 89 Ca 0.17 -0.46 -0.07 0.00 -0.94 0.00 0.00 52.86 51.56 3hd5 s ASN 89 Cb 0.19 0.59 0.28 0.00 -2.00 0.00 0.00 41.25 40.31 3hd5 s ASN 89 CO 0.59 -1.07 1.85 0.00 -2.94 0.00 0.00 177.10 175.52 3hd5 h ALA 90 N 2.17 1.07 0.00 3.54 0.00 -2.03 -3.32 119.26 120.69 3hd5 h ALA 90 Ca -0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3hd5 h ALA 90 Cb 1.26 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3hd5 h ALA 90 CO 0.36 0.24 0.00 0.41 0.00 0.00 0.00 179.25 180.26 3hd5 n GLY 91 N -1.31 0.35 4.99 0.00 0.00 -1.26 -4.28 105.19 103.68 3hd5 n GLY 91 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3hd5 n GLY 91 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3hd5 n LYS 93 N 1.70 0.00 -0.07 1.61 4.81 -1.25 -4.69 118.16 120.27 3hd5 n LYS 93 Ca 0.00 0.00 0.12 0.00 -0.87 0.00 0.00 58.31 57.56 3hd5 n LYS 93 Cb 0.00 -0.38 0.51 0.00 0.02 0.00 0.00 35.03 35.18 3hd5 n LYS 93 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 3hd5 h PRO 94 N 0.00 0.38 -0.02 1.64 0.11 -1.89 0.20 132.00 132.42 3hd5 h PRO 94 Ca 0.00 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.98 3hd5 h PRO 94 Cb 0.00 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.01 3hd5 h PRO 94 CO 0.00 0.25 -0.52 -0.07 -0.21 0.00 0.00 178.00 177.45 3hd5 h LEU 95 N 0.39 0.05 -0.14 2.35 -0.00 -1.88 -0.43 115.31 115.64 3hd5 h LEU 95 Ca 0.26 -0.02 -0.04 0.00 -0.00 0.00 0.00 57.88 58.08 3hd5 h LEU 95 Cb 0.52 -0.01 -0.00 0.00 -0.00 0.00 0.00 40.66 41.16 3hd5 h LEU 95 CO -0.07 0.56 -0.06 1.56 -0.00 0.00 0.00 178.44 180.43 3hd5 h GLN 96 N 0.04 0.29 -0.90 1.13 4.20 -0.98 -2.91 115.11 115.97 3hd5 h GLN 96 Ca -0.00 -0.12 0.05 0.00 0.06 0.00 0.00 58.65 58.64 3hd5 h GLN 96 Cb 0.93 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 28.64 3hd5 h GLN 96 CO 0.07 0.60 0.59 1.96 -0.67 0.00 0.00 178.83 181.38 3hd5 h GLN 97 N -0.04 1.03 -0.49 1.46 4.20 -0.81 -2.34 115.11 118.12 3hd5 h GLN 97 Ca 0.03 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.69 3hd5 h GLN 97 Cb 0.51 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 3hd5 h GLN 97 CO 0.02 0.68 0.33 1.25 -0.67 0.00 0.00 178.83 180.44 3hd5 h LEU 98 N 1.06 0.56 -0.09 1.46 5.85 -0.96 -0.78 115.31 122.42 3hd5 h LEU 98 Ca 0.38 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 59.12 3hd5 h LEU 98 Cb 0.13 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 3hd5 h LEU 98 CO -0.13 0.41 -0.16 0.22 -0.34 0.00 0.00 178.44 178.44 3hd5 h TYR 99 N 0.66 -0.41 -0.02 1.25 3.20 -1.23 -1.92 116.97 118.51 3hd5 h TYR 99 Ca 0.18 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.98 3hd5 h TYR 99 Cb -0.07 0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 3hd5 h TYR 99 CO -0.04 -0.23 -0.40 1.88 -1.64 0.00 0.00 178.16 177.73 3hd5 h TYR 100 N -0.22 0.05 -0.26 -3.82 0.05 -1.44 -2.93 116.97 108.41 3hd5 h TYR 100 Ca 0.08 -0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.80 3hd5 h TYR 100 Cb 0.33 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.05 3hd5 h TYR 100 CO -0.25 0.44 -0.01 1.15 -1.05 0.00 0.00 178.16 178.44 3hd5 h THR 101 N 0.04 1.26 -0.99 -2.88 2.02 -0.69 0.10 112.91 111.78 3hd5 h THR 101 Ca 0.00 -0.94 0.01 0.00 0.77 0.00 0.00 66.41 66.25 3hd5 h THR 101 Cb 0.73 1.37 -0.05 0.00 -1.74 0.00 0.00 68.15 68.45 3hd5 h THR 101 CO 0.05 0.30 0.66 -0.07 0.37 0.00 0.00 175.52 176.83 3hd5 h LEU 102 N 0.24 1.13 -0.53 2.58 3.38 -1.28 0.64 115.31 121.47 3hd5 h LEU 102 Ca 0.07 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 3hd5 h LEU 102 Cb 0.44 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 3hd5 h LEU 102 CO 0.02 0.82 -0.09 1.56 0.09 0.00 0.00 178.44 180.83 3hd5 h GLN 103 N 1.33 1.00 -0.72 1.13 1.08 -1.35 -0.22 115.11 117.36 3hd5 h GLN 103 Ca 0.37 -0.36 -0.05 0.00 -1.45 0.00 0.00 58.65 57.15 3hd5 h GLN 103 Cb -0.14 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.19 3hd5 h GLN 103 CO -0.08 1.04 0.23 0.00 -0.95 0.00 0.00 178.83 179.07 3hd5 h ALA 104 N 0.92 1.05 0.00 3.87 0.00 -0.25 -1.16 119.26 123.69 3hd5 h ALA 104 Ca 0.14 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3hd5 h ALA 104 Cb 0.65 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3hd5 h ALA 104 CO 0.04 0.65 0.00 1.28 0.00 0.00 0.00 179.25 181.22 3hd5 n LEU 105 N -4.26 0.00 -3.44 0.00 4.77 0.15 -4.89 117.00 109.33 3hd5 n LEU 105 Ca 0.06 0.10 -0.17 0.00 -0.03 0.00 0.00 56.01 55.96 3hd5 n LEU 105 Cb 0.22 -0.10 0.08 0.00 -2.33 0.00 0.00 43.42 41.29 3hd5 n LEU 105 CO 0.41 -0.02 0.08 -0.62 -1.33 0.00 0.00 177.39 175.92 3hd5 n GLU 106 N -1.10 -6.03 -2.73 3.23 1.02 -0.44 -4.95 120.64 109.65 3hd5 n GLU 106 Ca 0.17 0.83 -0.19 0.00 -0.02 0.00 0.00 57.16 57.94 3hd5 n GLU 106 Cb 0.13 -5.78 0.00 0.00 -0.02 0.00 0.00 31.44 25.76 3hd5 n GLU 106 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3hd5 n ARG 107 N -4.07 2.17 0.28 3.49 5.12 -0.16 -4.88 116.66 118.62 3hd5 n ARG 107 Ca -0.27 -3.92 0.18 0.00 -1.93 0.00 0.00 57.85 51.91 3hd5 n ARG 107 Cb 0.67 -1.79 0.94 0.00 -1.16 0.00 0.00 32.46 31.11 3hd5 n ARG 107 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3hd5 h PRO 108 N 2.86 0.00 0.00 5.56 0.13 -1.90 0.49 132.00 139.14 3hd5 h PRO 108 Ca 0.10 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.23 3hd5 h PRO 108 Cb 0.96 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.09 3hd5 h PRO 108 CO 0.66 0.00 -0.00 0.38 -0.23 0.00 0.00 178.00 178.81 3hd5 h ASP 109 N 0.00 0.00 1.38 1.44 -0.00 -1.94 -1.37 116.42 115.93 3hd5 h ASP 109 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.07 3hd5 h ASP 109 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.75 3hd5 h ASP 109 CO -0.00 0.00 -0.45 -0.07 -0.00 0.00 0.00 179.24 178.73 3hd5 h LEU 110 N 0.00 0.00 -0.07 0.15 3.38 -1.29 -3.38 115.31 114.11 3hd5 h LEU 110 Ca -0.00 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 57.96 3hd5 h LEU 110 Cb 0.01 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 3hd5 h LEU 110 CO 0.00 0.02 -0.42 -0.74 0.09 0.00 0.00 178.44 177.39 3hd5 h HIS 111 N 0.00 -1.21 0.00 1.13 2.76 -1.33 -1.24 115.15 115.27 3hd5 h HIS 111 Ca 0.00 0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 58.15 3hd5 h HIS 111 Cb 0.91 0.54 -0.01 0.00 1.55 0.00 0.00 27.41 30.40 3hd5 h HIS 111 CO 0.00 -0.49 -0.28 -1.00 -1.30 0.00 0.00 177.93 174.86 3hd5 h PRO 112 N -0.54 0.00 0.00 5.26 0.13 -1.73 -2.56 132.00 132.56 3hd5 h PRO 112 Ca 0.06 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.15 3hd5 h PRO 112 Cb 0.64 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.77 3hd5 h PRO 112 CO -0.36 0.28 -0.17 0.87 -0.23 0.00 0.00 178.00 178.39 3hd5 h LYS 113 N 0.00 0.00 -0.70 0.86 1.57 -1.45 -2.40 116.57 114.46 3hd5 h LYS 113 Ca -0.00 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.81 3hd5 h LYS 113 Cb 0.57 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.84 3hd5 h LYS 113 CO 0.04 0.17 0.43 0.28 -0.57 0.00 0.00 179.45 179.80 3hd5 h VAL 114 N 0.00 1.09 -0.41 0.50 2.07 -0.83 0.80 116.25 119.47 3hd5 h VAL 114 Ca -0.00 -0.29 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 3hd5 h VAL 114 Cb 0.41 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 3hd5 h VAL 114 CO 0.02 0.15 0.25 -0.26 0.02 0.00 0.00 177.57 177.76 3hd5 h PHE 115 N 0.85 0.53 -0.57 1.57 0.04 -1.56 -2.22 116.94 115.58 3hd5 h PHE 115 Ca 0.28 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.04 3hd5 h PHE 115 Cb 0.03 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 37.97 3hd5 h PHE 115 CO -0.04 0.37 0.32 1.15 -0.60 0.00 0.00 178.31 179.51 3hd5 h THR 116 N 0.54 1.18 -0.38 -1.55 2.02 -1.29 -0.92 112.91 112.52 3hd5 h THR 116 Ca 0.15 -0.43 0.00 0.00 0.77 0.00 0.00 66.41 66.89 3hd5 h THR 116 Cb -0.01 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 66.82 3hd5 h THR 116 CO -0.03 0.19 0.24 0.00 0.37 0.00 0.00 175.52 176.29 3hd5 h ALA 117 N 1.15 0.48 0.00 6.16 0.00 -0.55 0.82 119.26 127.32 3hd5 h ALA 117 Ca 0.20 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 3hd5 h ALA 117 Cb 0.02 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3hd5 h ALA 117 CO -0.03 -0.05 -0.00 0.82 0.00 0.00 0.00 179.25 179.99 3hd5 h ILE 118 N 0.50 1.44 0.00 0.00 2.04 -1.29 0.81 117.51 121.01 3hd5 h ILE 118 Ca 0.14 -1.30 -0.14 0.00 1.00 0.00 0.00 64.86 64.56 3hd5 h ILE 118 Cb -0.04 2.32 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 3hd5 h ILE 118 CO -0.03 0.34 -0.97 0.45 0.00 0.00 0.00 178.15 177.94 3hd5 h HIS 119 N -0.56 0.00 0.00 1.37 3.86 -1.19 -3.07 115.15 115.56 3hd5 h HIS 119 Ca -0.00 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 58.98 3hd5 h HIS 119 Cb 0.56 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.98 3hd5 h HIS 119 CO 0.12 0.54 -1.88 2.41 0.86 0.00 0.00 177.93 179.98 3hd5 n THR 120 N -3.05 0.88 1.21 2.45 -1.04 0.24 -4.51 114.28 110.45 3hd5 n THR 120 Ca -0.04 -0.38 0.13 0.00 -2.04 0.00 0.00 64.05 61.72 3hd5 n THR 120 Cb 0.79 -0.97 0.29 0.00 -1.82 0.00 0.00 70.33 68.62 3hd5 n THR 120 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3hd5 n GLU 121 N -2.84 1.07 -3.43 -2.82 1.02 -0.94 -4.95 120.64 107.75 3hd5 n GLU 121 Ca -0.26 -0.72 -0.25 0.00 -0.02 0.00 0.00 57.16 55.92 3hd5 n GLU 121 Cb 0.82 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.75 3hd5 n GLU 121 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3hd5 n ARG 122 N -0.33 -3.71 -2.85 3.49 5.12 -0.76 -4.92 116.66 112.69 3hd5 n ARG 122 Ca 0.12 0.52 -0.40 0.00 -1.93 0.00 0.00 57.85 56.16 3hd5 n ARG 122 Cb 0.39 -5.26 -0.05 0.00 -1.16 0.00 0.00 32.46 26.38 3hd5 n ARG 122 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 3hd5 s LYS 123 N -6.09 4.63 -1.26 5.56 1.02 0.20 -4.97 119.74 118.83 3hd5 s LYS 123 Ca 0.44 1.28 -0.12 0.00 0.02 0.00 0.00 55.97 57.59 3hd5 s LYS 123 Cb -0.23 -3.35 0.16 0.00 -0.52 0.00 0.00 37.83 33.89 3hd5 s LYS 123 CO 0.54 0.30 1.67 0.54 -0.92 0.00 0.00 175.35 177.48 3hd5 n ARG 124 N 2.55 3.43 -2.51 1.68 1.74 -1.26 -4.15 116.66 118.14 3hd5 n ARG 124 Ca -0.01 -3.63 -0.43 0.00 -0.77 0.00 0.00 57.85 53.02 3hd5 n ARG 124 Cb 0.49 -3.04 0.00 0.00 -1.02 0.00 0.00 32.46 28.90 3hd5 n ARG 124 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3hd5 n LEU 125 N 5.16 6.44 -0.31 0.55 4.77 -1.26 -4.57 117.00 127.79 3hd5 n LEU 125 Ca 0.40 -4.71 0.03 0.00 -0.03 0.00 0.00 56.01 51.70 3hd5 n LEU 125 Cb 0.40 -1.47 0.05 0.00 -2.33 0.00 0.00 43.42 40.07 3hd5 n LEU 125 CO 0.72 1.35 0.43 0.49 -1.33 0.00 0.00 177.39 179.05 3hd5 n PHE 126 N 3.71 0.09 -3.90 -1.77 3.72 -1.26 -4.93 117.46 113.12 3hd5 n PHE 126 Ca 0.37 -0.16 -0.09 0.00 -0.05 0.00 0.00 57.45 57.52 3hd5 n PHE 126 Cb 0.37 -0.01 -0.08 0.00 -0.94 0.00 0.00 39.48 38.81 3hd5 n PHE 126 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 3hd5 s ASP 127 N -0.71 0.16 0.20 4.37 -4.77 -1.26 -4.84 116.67 109.82 3hd5 s ASP 127 Ca 0.10 -0.59 -0.12 0.00 -3.30 0.00 0.00 52.55 48.64 3hd5 s ASP 127 Cb 0.06 0.28 0.24 0.00 -1.09 0.00 0.00 42.92 42.41 3hd5 s ASP 127 CO 0.09 -0.61 1.67 0.50 0.70 0.00 0.00 175.17 177.52 3hd5 h LYS 128 N 3.22 0.11 -0.06 2.11 3.64 -1.95 -2.47 116.57 121.18 3hd5 h LYS 128 Ca -0.33 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.08 3hd5 h LYS 128 Cb 1.19 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.94 3hd5 h LYS 128 CO 0.54 0.07 -0.20 -0.22 -2.27 0.00 0.00 179.45 177.37 3hd5 h LYS 129 N 0.12 -0.28 -0.83 1.90 1.63 -2.00 0.45 116.57 117.56 3hd5 h LYS 129 Ca 0.29 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.11 3hd5 h LYS 129 Cb 0.45 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.14 3hd5 h LYS 129 CO -0.48 -0.18 0.00 0.00 -3.45 0.00 0.00 179.45 175.34 3hd5 n ALA 130 N -2.61 1.31 0.00 5.00 0.00 -0.93 -1.92 120.51 121.37 3hd5 n ALA 130 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3hd5 n ALA 130 Cb 0.25 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.70 3hd5 n ALA 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hd5 n GLY 132 N 0.66 0.00 0.11 0.00 0.00 0.16 -1.97 105.19 104.15 3hd5 n GLY 132 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 3hd5 n GLY 132 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hd5 h GLU 133 N 0.00 0.03 -0.38 1.61 5.08 -1.61 0.17 114.58 119.48 3hd5 h GLU 133 Ca 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3hd5 h GLU 133 Cb 0.00 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 3hd5 h GLU 133 CO 0.00 0.02 0.25 2.35 -1.00 0.00 0.00 179.01 180.64 3hd5 h TRP 134 N 0.04 0.48 -0.28 4.33 7.01 -1.66 -1.75 115.95 124.11 3hd5 h TRP 134 Ca 0.10 0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.17 3hd5 h TRP 134 Cb 0.14 -0.16 -0.05 0.00 -2.10 0.00 0.00 29.16 26.99 3hd5 h TRP 134 CO -0.20 0.30 -0.06 0.00 -2.79 0.00 0.00 178.44 175.69 3hd5 h ALA 135 N 1.14 0.20 -0.71 2.65 0.00 -1.61 -0.97 119.26 119.96 3hd5 h ALA 135 Ca 0.14 0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.21 3hd5 h ALA 135 Cb -0.06 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 3hd5 h ALA 135 CO -0.03 -0.45 0.47 0.00 0.00 0.00 0.00 179.25 179.23 3hd5 h ALA 136 N 1.28 1.65 0.00 0.00 0.00 -0.34 0.55 119.26 122.40 3hd5 h ALA 136 Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3hd5 h ALA 136 Cb 0.20 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3hd5 h ALA 136 CO -0.28 0.25 -0.03 0.66 0.00 0.00 0.00 179.25 179.85 3hd5 h SER 137 N 0.80 0.00 -0.58 0.00 4.64 -0.29 -1.74 113.55 116.38 3hd5 h SER 137 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 3hd5 h SER 137 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3hd5 h SER 137 CO -0.09 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 175.90 3hd5 n GLN 138 N -3.21 3.95 -0.70 4.77 1.13 0.13 -4.90 117.38 118.55 3hd5 n GLN 138 Ca -0.01 -2.75 0.00 0.00 -1.94 0.00 0.00 57.00 52.30 3hd5 n GLN 138 Cb 0.21 -1.99 0.00 0.00 0.11 0.00 0.00 30.24 28.56 3hd5 n GLN 138 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hd5 n GLY 139 N 0.89 0.58 3.77 1.08 0.00 -0.65 -5.06 105.19 105.80 3hd5 n GLY 139 Ca 0.25 -0.63 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 3hd5 n GLY 139 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hd5 s VAL 140 N -2.00 5.41 -0.13 1.61 1.01 -0.84 -5.00 120.40 120.46 3hd5 s VAL 140 Ca 0.00 0.27 -0.29 0.00 0.00 0.00 0.00 61.98 61.96 3hd5 s VAL 140 Cb 0.00 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 3hd5 s VAL 140 CO 0.00 0.48 1.66 -0.62 0.00 0.00 0.00 175.10 176.62 3hd5 s ASP 141 N 0.00 6.50 0.22 3.32 -1.08 -1.26 -3.48 116.67 120.89 3hd5 s ASP 141 Ca 0.11 1.97 -0.09 0.00 -0.52 0.00 0.00 52.55 54.03 3hd5 s ASP 141 Cb -0.12 -2.53 0.35 0.00 -1.46 0.00 0.00 42.92 39.16 3hd5 s ASP 141 CO 0.01 -1.10 1.68 -0.09 0.52 0.00 0.00 175.17 176.19 3hd5 h ARG 142 N 10.25 0.19 -0.72 4.34 9.65 -1.94 0.13 114.38 136.29 3hd5 h ARG 142 Ca -0.37 -0.01 0.01 0.00 -1.10 0.00 0.00 59.98 58.50 3hd5 h ARG 142 Cb 1.17 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 29.67 3hd5 h ARG 142 CO 0.97 0.13 0.47 0.00 2.80 0.00 0.00 179.97 184.35 3hd5 h ALA 143 N 1.55 0.91 -0.11 2.80 0.00 -1.99 0.97 119.26 123.40 3hd5 h ALA 143 Ca 0.35 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 3hd5 h ALA 143 Cb 0.57 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3hd5 h ALA 143 CO -0.49 0.34 0.05 -0.22 0.00 0.00 0.00 179.25 178.93 3hd5 h LYS 144 N 0.98 0.16 0.18 0.00 3.11 -1.52 -1.88 116.57 117.60 3hd5 h LYS 144 Ca 0.26 -0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 58.07 3hd5 h LYS 144 Cb -0.11 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.10 3hd5 h LYS 144 CO -0.06 0.25 -0.09 0.35 -2.81 0.00 0.00 179.45 177.09 3hd5 h PHE 145 N 0.03 -0.23 -0.82 1.91 3.04 -0.48 -0.61 116.94 119.79 3hd5 h PHE 145 Ca 0.04 -0.01 0.11 0.00 3.98 0.00 0.00 57.97 62.09 3hd5 h PHE 145 Cb 0.15 0.08 -0.06 0.00 2.56 0.00 0.00 35.95 38.67 3hd5 h PHE 145 CO -0.02 -0.14 0.53 -0.44 -2.02 0.00 0.00 178.31 176.22 3hd5 h ASP 146 N -0.25 0.63 0.29 0.41 3.32 -0.77 -0.29 116.42 119.77 3hd5 h ASP 146 Ca -0.03 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 3hd5 h ASP 146 Cb 0.19 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.64 3hd5 h ASP 146 CO 0.04 0.36 -0.14 -1.28 -1.72 0.00 0.00 179.24 176.50 3hd5 h SER 147 N 0.69 -0.33 -0.86 6.45 0.87 -0.91 -3.29 113.55 116.17 3hd5 h SER 147 Ca 0.39 -0.19 0.03 0.00 -1.23 0.00 0.00 61.79 60.79 3hd5 h SER 147 Cb 0.56 0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.55 3hd5 h SER 147 CO -0.16 0.13 0.55 0.58 -0.53 0.00 0.00 176.83 177.41 3hd5 h VAL 148 N -0.93 1.13 -1.06 2.23 2.07 -0.90 -2.13 116.25 116.66 3hd5 h VAL 148 Ca -0.04 -0.37 0.28 0.00 0.82 0.00 0.00 66.70 67.40 3hd5 h VAL 148 Cb 0.50 -0.03 -0.07 0.00 -1.52 0.00 0.00 31.29 30.17 3hd5 h VAL 148 CO 0.07 0.20 0.71 0.15 0.02 0.00 0.00 177.57 178.71 3hd5 h PHE 149 N 1.07 0.41 -0.56 1.57 3.04 -1.14 0.46 116.94 121.79 3hd5 h PHE 149 Ca 0.34 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.31 3hd5 h PHE 149 Cb 0.02 -0.12 0.00 0.00 2.56 0.00 0.00 35.95 38.41 3hd5 h PHE 149 CO -0.02 0.04 0.00 -0.25 -2.02 0.00 0.00 178.31 176.06 3hd5 n ASP 150 N -4.47 3.62 -4.74 0.41 8.00 -0.83 -4.77 116.55 113.77 3hd5 n ASP 150 Ca 0.24 -1.98 -0.37 0.00 0.71 0.00 0.00 54.79 53.39 3hd5 n ASP 150 Cb 0.97 -0.37 0.05 0.00 -0.02 0.00 0.00 41.12 41.75 3hd5 n ASP 150 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3hd5 s SER 151 N -1.13 4.96 0.45 -2.24 1.04 0.16 -4.85 113.70 112.09 3hd5 s SER 151 Ca 0.41 2.54 0.17 0.00 0.48 0.00 0.00 55.95 59.56 3hd5 s SER 151 Cb 0.22 -2.61 1.04 0.00 0.10 0.00 0.00 66.02 64.77 3hd5 s SER 151 CO 0.30 -1.76 1.98 0.15 0.98 0.00 0.00 173.24 174.89 3hd5 h PHE 152 N 0.85 0.00 -0.07 5.02 3.57 -1.93 -1.87 116.94 122.50 3hd5 h PHE 152 Ca -0.51 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.01 3hd5 h PHE 152 Cb 1.31 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 3hd5 h PHE 152 CO 0.44 0.20 -0.01 1.03 -2.23 0.00 0.00 178.31 177.74 3hd5 h SER 153 N 0.00 -0.05 0.00 0.41 0.87 -1.92 0.33 113.55 113.20 3hd5 h SER 153 Ca -0.00 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 3hd5 h SER 153 Cb 0.38 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 3hd5 h SER 153 CO 0.03 -0.02 -0.00 0.58 -0.53 0.00 0.00 176.83 176.89 3hd5 h VAL 154 N 0.01 1.06 -0.88 2.23 2.07 -1.67 -1.41 116.25 117.65 3hd5 h VAL 154 Ca 0.03 -0.18 0.11 0.00 0.82 0.00 0.00 66.70 67.48 3hd5 h VAL 154 Cb 0.05 1.18 -0.08 0.00 -1.52 0.00 0.00 31.29 30.92 3hd5 h VAL 154 CO -0.07 0.05 0.52 -0.61 0.02 0.00 0.00 177.57 177.47 3hd5 h GLN 155 N -0.08 0.82 -0.17 1.57 4.15 -1.03 0.66 115.11 121.03 3hd5 h GLN 155 Ca -0.00 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.36 3hd5 h GLN 155 Cb 0.08 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.58 3hd5 h GLN 155 CO 0.00 0.54 0.07 1.15 -1.93 0.00 0.00 178.83 178.66 3hd5 h THR 156 N 0.84 1.16 -0.10 2.39 2.02 -0.02 -2.06 112.91 117.12 3hd5 h THR 156 Ca 0.43 -0.48 -0.06 0.00 0.77 0.00 0.00 66.41 67.07 3hd5 h THR 156 Cb 0.42 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 3hd5 h THR 156 CO -0.26 0.15 -0.20 1.56 0.37 0.00 0.00 175.52 177.13 3hd5 h GLN 157 N 0.11 0.17 -0.41 6.66 4.20 -0.53 -1.79 115.11 123.52 3hd5 h GLN 157 Ca 0.06 -0.05 -0.09 0.00 0.06 0.00 0.00 58.65 58.63 3hd5 h GLN 157 Cb 0.18 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 3hd5 h GLN 157 CO -0.00 0.38 -0.08 0.28 -0.67 0.00 0.00 178.83 178.73 3hd5 h VAL 158 N 0.16 1.27 -0.17 -0.54 2.07 -0.64 -0.38 116.25 118.02 3hd5 h VAL 158 Ca 0.03 -1.17 0.01 0.00 0.82 0.00 0.00 66.70 66.39 3hd5 h VAL 158 Cb 0.46 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 3hd5 h VAL 158 CO 0.03 0.39 0.07 1.56 0.02 0.00 0.00 177.57 179.64 3hd5 h GLN 159 N 0.61 0.15 -0.65 1.57 4.20 -0.97 -2.32 115.11 117.70 3hd5 h GLN 159 Ca 0.11 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 3hd5 h GLN 159 Cb 0.60 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.32 3hd5 h GLN 159 CO 0.04 0.10 0.35 -0.09 -0.67 0.00 0.00 178.83 178.55 3hd5 h ARG 160 N 0.16 0.90 -0.02 1.46 9.65 -1.19 -1.22 114.38 124.11 3hd5 h ARG 160 Ca 0.07 -0.10 -0.00 0.00 -1.10 0.00 0.00 59.98 58.85 3hd5 h ARG 160 Cb 0.03 -0.18 -0.00 0.00 -1.39 0.00 0.00 29.97 28.43 3hd5 h ARG 160 CO -0.06 0.67 0.01 0.00 2.80 0.00 0.00 179.97 183.38 3hd5 h ALA 161 N 1.48 0.02 -0.67 2.80 0.00 -0.59 0.15 119.26 122.44 3hd5 h ALA 161 Ca 0.23 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 3hd5 h ALA 161 Cb 0.04 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3hd5 h ALA 161 CO -0.04 -0.46 0.19 0.77 0.00 0.00 0.00 179.25 179.72 3hd5 h SER 162 N -0.01 0.97 -0.59 0.00 0.02 -1.15 -0.50 113.55 112.29 3hd5 h SER 162 Ca 0.01 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 60.75 3hd5 h SER 162 Cb 0.03 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.29 3hd5 h SER 162 CO -0.00 0.92 0.26 -0.61 -1.14 0.00 0.00 176.83 176.26 3hd5 h GLN 163 N 1.00 0.87 -0.39 3.45 4.15 -0.96 0.20 115.11 123.42 3hd5 h GLN 163 Ca 0.22 -0.14 -0.00 0.00 0.77 0.00 0.00 58.65 59.49 3hd5 h GLN 163 Cb 0.31 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.83 3hd5 h GLN 163 CO -0.01 0.72 0.23 -0.07 -1.93 0.00 0.00 178.83 177.78 3hd5 h LEU 164 N 0.81 0.48 -0.87 -2.39 3.38 -0.49 -0.38 115.31 115.85 3hd5 h LEU 164 Ca 0.20 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.12 3hd5 h LEU 164 Cb 0.16 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 3hd5 h LEU 164 CO -0.02 0.41 0.57 0.00 0.09 0.00 0.00 178.44 179.49 3hd5 h ALA 165 N 1.09 1.12 0.16 1.53 0.00 -0.69 -1.82 119.26 120.65 3hd5 h ALA 165 Ca 0.14 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3hd5 h ALA 165 Cb 0.02 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.48 3hd5 h ALA 165 CO -0.03 0.46 -0.08 0.93 0.00 0.00 0.00 179.25 180.54 3hd5 h GLU 166 N 1.14 -0.21 -0.81 0.00 4.39 -0.60 -1.76 114.58 116.73 3hd5 h GLU 166 Ca 0.33 0.01 0.13 0.00 0.34 0.00 0.00 59.36 60.18 3hd5 h GLU 166 Cb -0.07 0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 28.57 3hd5 h GLU 166 CO -0.09 0.02 0.53 0.00 -1.16 0.00 0.00 179.01 178.31 3hd5 h ALA 167 N 0.39 1.92 -0.01 3.43 0.00 -0.80 0.11 119.26 124.30 3hd5 h ALA 167 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3hd5 h ALA 167 Cb 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3hd5 h ALA 167 CO 0.04 -0.13 -0.00 0.00 0.00 0.00 0.00 179.25 179.16 3hd5 n ALA 168 N -2.47 2.60 -3.80 0.00 0.00 -0.71 -4.74 120.51 111.39 3hd5 n ALA 168 Ca 0.15 -0.39 -0.28 0.00 0.00 0.00 0.00 53.44 52.92 3hd5 n ALA 168 Cb 0.45 -1.24 0.02 0.00 0.00 0.00 0.00 19.45 18.68 3hd5 n ALA 168 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3hd5 n HIS 169 N -0.09 -1.79 -2.81 0.00 -0.00 0.37 -4.91 115.22 105.99 3hd5 n HIS 169 Ca 0.20 0.60 -0.42 0.00 -0.00 0.00 0.00 57.72 58.11 3hd5 n HIS 169 Cb 0.30 -3.66 -0.03 0.00 -0.00 0.00 0.00 29.99 26.60 3hd5 n HIS 169 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 3hd5 s ILE 170 N -3.69 4.88 0.00 1.59 -1.09 -0.82 -4.92 121.20 117.15 3hd5 s ILE 170 Ca 0.23 1.83 0.00 0.00 -2.23 0.00 0.00 60.65 60.48 3hd5 s ILE 170 Cb -0.08 -4.22 0.00 0.00 -1.58 0.00 0.00 42.46 36.58 3hd5 s ILE 170 CO 0.87 0.09 0.93 -0.90 -1.23 0.00 0.00 174.94 174.70 3hd5 n ASP 171 N 4.58 1.79 -3.54 3.58 5.68 -1.26 -4.92 116.55 122.47 3hd5 n ASP 171 Ca 0.05 -1.86 -0.08 0.00 -0.50 0.00 0.00 54.79 52.41 3hd5 n ASP 171 Cb 0.50 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.45 3hd5 n ASP 171 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 3hd5 s GLY 172 N -0.86 -0.40 0.09 6.12 0.00 -1.26 -5.17 107.32 105.85 3hd5 s GLY 172 Ca 0.00 1.29 0.10 0.00 0.00 0.00 0.00 44.72 46.11 3hd5 s GLY 172 CO 0.00 0.47 -0.25 -0.51 0.00 0.00 0.00 173.10 172.81 3hd5 s THR 173 N -2.71 2.06 0.76 0.90 -4.23 -1.26 -4.03 115.64 107.13 3hd5 s THR 173 Ca 0.05 -1.57 -0.10 0.00 -1.18 0.00 0.00 61.69 58.90 3hd5 s THR 173 Cb -0.01 -1.81 0.06 0.00 1.34 0.00 0.00 72.50 72.09 3hd5 s THR 173 CO -0.07 0.14 1.11 -2.16 -0.54 0.00 0.00 174.62 173.10 3hd5 s PRO 174 N -1.73 2.16 -0.10 3.99 0.04 -1.26 -4.74 135.00 133.36 3hd5 s PRO 174 Ca 0.11 0.03 -0.15 0.00 0.04 0.00 0.00 61.00 61.03 3hd5 s PRO 174 Cb -0.10 -2.04 0.04 0.00 0.04 0.00 0.00 34.50 32.44 3hd5 s PRO 174 CO 0.04 -1.40 0.38 0.00 0.04 0.00 0.00 177.00 176.07 3hd5 s ALA 175 N -3.43 -0.96 -0.06 8.56 0.00 -0.91 -4.47 121.76 120.49 3hd5 s ALA 175 Ca 0.61 0.88 0.06 0.00 0.00 0.00 0.00 51.96 53.51 3hd5 s ALA 175 Cb -0.11 -0.39 -0.01 0.00 0.00 0.00 0.00 23.12 22.61 3hd5 s ALA 175 CO 0.48 -0.22 -0.25 -0.06 0.00 0.00 0.00 175.76 175.71 3hd5 s PHE 176 N -0.34 2.42 -0.13 0.00 0.40 0.13 0.16 117.98 120.62 3hd5 s PHE 176 Ca -0.05 -0.71 -0.02 0.00 -0.60 0.00 0.00 56.93 55.55 3hd5 s PHE 176 Cb -0.03 -1.59 -0.02 0.00 0.51 0.00 0.00 43.02 41.88 3hd5 s PHE 176 CO 0.02 -0.21 -0.07 0.00 0.70 0.00 0.00 175.22 175.66 3hd5 s ALA 177 N -0.18 2.90 -0.09 5.36 0.00 -0.07 -0.12 121.76 129.55 3hd5 s ALA 177 Ca -0.03 -0.85 0.03 0.00 0.00 0.00 0.00 51.96 51.11 3hd5 s ALA 177 Cb -0.14 -1.41 0.01 0.00 0.00 0.00 0.00 23.12 21.59 3hd5 s ALA 177 CO 0.03 0.29 -0.18 0.08 0.00 0.00 0.00 175.76 175.99 3hd5 s VAL 178 N 0.14 1.62 -1.45 0.00 1.01 0.13 -0.70 120.40 121.15 3hd5 s VAL 178 Ca -0.03 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.20 3hd5 s VAL 178 Cb -0.14 -1.44 0.00 0.00 0.00 0.00 0.00 36.38 34.80 3hd5 s VAL 178 CO 0.03 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.21 3hd5 n GLY 179 N 3.84 0.85 3.83 4.51 0.00 -0.28 -1.19 105.19 116.74 3hd5 n GLY 179 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3hd5 n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hd5 n GLY 180 N -0.43 0.39 0.09 -0.02 0.00 -1.26 -4.75 105.19 99.21 3hd5 n GLY 180 Ca -0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 3hd5 n GLY 180 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hd5 n ARG 181 N -2.00 1.02 0.00 1.61 1.74 -0.33 -4.46 116.66 114.24 3hd5 n ARG 181 Ca 0.00 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 3hd5 n ARG 181 Cb 0.00 -1.45 0.00 0.00 -1.02 0.00 0.00 32.46 29.99 3hd5 n ARG 181 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3hd5 n TYR 182 N -2.75 0.00 0.00 -1.55 4.01 -0.75 0.68 117.16 116.80 3hd5 n TYR 182 Ca -0.31 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.43 3hd5 n TYR 182 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.07 3hd5 n TYR 182 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 3hd5 n THR 184 N 0.00 0.00 -3.80 -0.72 5.66 0.83 0.22 114.28 116.47 3hd5 n THR 184 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 3hd5 n THR 184 Cb 0.00 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 68.73 3hd5 n THR 184 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 3hd5 s SER 185 N 0.00 -0.12 0.23 1.09 1.04 -1.26 0.20 113.70 114.88 3hd5 s SER 185 Ca 0.00 -0.58 -0.06 0.00 0.48 0.00 0.00 55.95 55.78 3hd5 s SER 185 Cb 0.00 0.48 0.30 0.00 0.10 0.00 0.00 66.02 66.91 3hd5 s SER 185 CO 0.00 -0.92 1.84 -0.65 0.98 0.00 0.00 173.24 174.49 3hd5 h PRO 186 N 2.41 0.89 -0.66 4.02 0.11 -1.97 -1.15 132.00 135.65 3hd5 h PRO 186 Ca -0.31 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.76 3hd5 h PRO 186 Cb 1.24 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 3hd5 h PRO 186 CO 0.45 0.59 0.42 0.28 -0.21 0.00 0.00 178.00 179.53 3hd5 h VAL 187 N 0.91 1.11 0.00 3.15 2.07 -1.95 0.46 116.25 122.01 3hd5 h VAL 187 Ca 0.35 -0.29 -0.07 0.00 0.82 0.00 0.00 66.70 67.52 3hd5 h VAL 187 Cb 0.16 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 3hd5 h VAL 187 CO -0.17 0.15 -0.33 -0.07 0.02 0.00 0.00 177.57 177.18 3hd5 h LEU 188 N 0.84 0.00 -0.25 2.57 3.38 -1.78 -2.73 115.31 117.32 3hd5 h LEU 188 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 3hd5 h LEU 188 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3hd5 h LEU 188 CO -0.09 0.33 -0.03 0.00 0.09 0.00 0.00 178.44 178.74 3hd5 n ALA 189 N -2.29 2.67 -0.30 1.53 0.00 -0.47 -0.10 120.51 121.55 3hd5 n ALA 189 Ca -0.00 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.18 3hd5 n ALA 189 Cb 0.47 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.52 3hd5 n ALA 189 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hd5 n GLY 190 N 1.13 1.32 0.38 0.00 0.00 -0.83 -4.88 105.19 102.31 3hd5 n GLY 190 Ca 0.20 -0.19 0.16 0.00 0.00 0.00 0.00 46.02 46.19 3hd5 n GLY 190 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3hd5 h ASN 191 N 0.00 0.32 0.52 1.61 -1.24 -1.09 -1.58 115.58 114.12 3hd5 h ASN 191 Ca 0.00 0.02 0.00 0.00 0.71 0.00 0.00 56.30 57.03 3hd5 h ASN 191 Cb 0.11 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.11 3hd5 h ASN 191 CO 0.00 0.17 0.00 0.47 -1.29 0.00 0.00 177.43 176.78 3hd5 n ASP 192 N -4.46 0.58 0.27 1.15 8.00 -1.26 -2.17 116.55 118.66 3hd5 n ASP 192 Ca 0.13 0.67 0.18 0.00 0.71 0.00 0.00 54.79 56.48 3hd5 n ASP 192 Cb 0.53 -0.79 0.74 0.00 -0.02 0.00 0.00 41.12 41.59 3hd5 n ASP 192 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 3hd5 h TYR 193 N 0.00 0.00 0.00 1.24 0.05 -1.68 -1.80 116.97 114.77 3hd5 h TYR 193 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3hd5 h TYR 193 Cb 0.26 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.00 3hd5 h TYR 193 CO 0.00 0.00 -1.05 0.00 -1.05 0.00 0.00 178.16 176.06 3hd5 n ALA 194 N -2.06 3.80 -2.33 3.88 0.00 -0.92 -3.74 120.51 119.15 3hd5 n ALA 194 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.97 3hd5 n ALA 194 Cb 0.26 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 18.81 3hd5 n ALA 194 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hd5 n GLY 195 N 1.42 1.13 0.33 0.00 0.00 -0.84 -4.75 105.19 102.48 3hd5 n GLY 195 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.04 3hd5 n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hd5 h ALA 196 N -0.08 0.26 -0.28 4.61 0.00 -1.89 0.20 119.26 122.08 3hd5 h ALA 196 Ca 0.00 0.26 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 3hd5 h ALA 196 Cb 0.00 0.75 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3hd5 h ALA 196 CO 0.00 -0.54 0.16 -0.07 0.00 0.00 0.00 179.25 178.80 3hd5 h LEU 197 N -0.06 0.34 -0.41 0.00 3.38 -1.65 0.39 115.31 117.30 3hd5 h LEU 197 Ca 0.33 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 58.12 3hd5 h LEU 197 Cb 0.58 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 3hd5 h LEU 197 CO -0.81 0.27 -0.45 0.50 0.09 0.00 0.00 178.44 178.04 3hd5 h LYS 198 N 0.39 0.85 -0.18 1.13 3.64 -0.77 -2.39 116.57 119.23 3hd5 h LYS 198 Ca 0.10 -0.47 -0.12 0.00 -1.27 0.00 0.00 60.65 58.89 3hd5 h LYS 198 Cb 0.00 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3hd5 h LYS 198 CO -0.02 1.11 -0.41 0.28 -2.27 0.00 0.00 179.45 178.14 3hd5 h VAL 199 N 0.68 1.31 -0.36 2.00 2.07 0.29 -2.39 116.25 119.85 3hd5 h VAL 199 Ca 0.04 -1.57 -0.02 0.00 0.82 0.00 0.00 66.70 65.97 3hd5 h VAL 199 Cb 1.03 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 3hd5 h VAL 199 CO 0.10 0.48 0.15 0.58 0.02 0.00 0.00 177.57 178.90 3hd5 h VAL 200 N 0.35 1.19 -0.69 2.57 2.07 -0.12 0.28 116.25 121.89 3hd5 h VAL 200 Ca 0.03 -0.57 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 3hd5 h VAL 200 Cb 0.88 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 3hd5 h VAL 200 CO 0.07 0.20 0.34 0.44 0.02 0.00 0.00 177.57 178.65 3hd5 h ASP 201 N 0.43 0.88 0.09 0.57 3.32 -1.31 -0.60 116.42 119.81 3hd5 h ASP 201 Ca 0.12 -0.09 -0.15 0.00 0.02 0.00 0.00 57.03 56.93 3hd5 h ASP 201 Cb 0.18 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 3hd5 h ASP 201 CO -0.01 0.74 -0.53 1.56 -1.72 0.00 0.00 179.24 179.28 3hd5 h GLN 202 N 0.97 0.47 -0.10 3.56 4.20 -0.98 -2.99 115.11 120.26 3hd5 h GLN 202 Ca 0.24 -0.29 -0.10 0.00 0.06 0.00 0.00 58.65 58.56 3hd5 h GLN 202 Cb 0.09 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 3hd5 h GLN 202 CO -0.03 0.89 -0.41 -0.07 -0.67 0.00 0.00 178.83 178.53 3hd5 h LEU 203 N 0.37 0.22 -0.51 1.46 3.38 0.20 -2.17 115.31 118.25 3hd5 h LEU 203 Ca 0.01 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 3hd5 h LEU 203 Cb 1.05 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 3hd5 h LEU 203 CO 0.10 0.62 0.17 0.40 0.09 0.00 0.00 178.44 179.81 3hd5 h ILE 204 N 0.18 1.23 -0.35 1.22 2.04 -1.01 -1.34 117.51 119.48 3hd5 h ILE 204 Ca 0.02 -0.76 -0.02 0.00 1.00 0.00 0.00 64.86 65.10 3hd5 h ILE 204 Cb 0.81 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 3hd5 h ILE 204 CO 0.06 0.28 0.15 0.58 0.00 0.00 0.00 178.15 179.22 3hd5 h VAL 205 N 0.70 1.18 -0.44 1.67 2.07 -1.37 -2.64 116.25 117.43 3hd5 h VAL 205 Ca 0.17 -0.54 -0.06 0.00 0.82 0.00 0.00 66.70 67.08 3hd5 h VAL 205 Cb 0.26 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 3hd5 h VAL 205 CO -0.01 0.19 0.02 -0.61 0.02 0.00 0.00 177.57 177.19 3hd5 h GLN 206 N 0.42 0.70 0.00 1.57 4.15 -1.21 -2.19 115.11 118.55 3hd5 h GLN 206 Ca 0.12 -0.17 0.00 0.00 0.77 0.00 0.00 58.65 59.37 3hd5 h GLN 206 Cb 0.17 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.76 3hd5 h GLN 206 CO -0.01 0.70 0.00 0.66 -1.93 0.00 0.00 178.83 178.25 3hd5 h SER 207 N 0.66 0.00 1.50 -0.69 4.64 -1.12 -2.20 113.55 116.33 3hd5 h SER 207 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 3hd5 h SER 207 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3hd5 h SER 207 CO 0.01 0.00 -0.21 -0.09 -0.87 0.00 0.00 176.83 175.67 3hd5 h ARG 208 N 0.00 0.00 -0.01 4.77 2.43 -1.03 -3.51 114.38 117.02 3hd5 h ARG 208 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3hd5 h ARG 208 Cb 0.63 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 3hd5 h ARG 208 CO 0.00 0.00 0.00 0.39 -1.51 0.00 0.00 179.97 178.85