#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ia8 s PRO 4 N 0.00 4.10 0.00 0.52 0.02 -1.26 -5.13 135.00 133.25 3ia8 s PRO 4 Ca 0.00 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.10 3ia8 s PRO 4 Cb 0.00 -2.83 0.00 0.00 0.02 0.00 0.00 34.50 31.69 3ia8 s PRO 4 CO 0.00 -0.35 0.00 1.17 -0.33 0.00 0.00 177.00 177.49 3ia8 n LYS 5 N 0.32 0.69 -4.80 5.54 3.00 -1.26 -4.76 118.16 116.87 3ia8 n LYS 5 Ca 0.03 0.00 -0.28 0.00 -0.00 0.00 0.00 58.31 58.06 3ia8 n LYS 5 Cb 0.44 0.00 -0.17 0.00 0.00 0.00 0.00 35.03 35.30 3ia8 n LYS 5 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 3ia8 s ASN 7 N -2.16 2.35 0.45 3.14 3.84 -1.26 -4.13 114.94 117.17 3ia8 s ASN 7 Ca 0.00 -0.41 0.16 0.00 0.21 0.00 0.00 52.86 52.81 3ia8 s ASN 7 Cb 0.00 -1.08 1.09 0.00 -0.55 0.00 0.00 41.25 40.71 3ia8 s ASN 7 CO 0.00 0.08 1.99 -0.65 -2.79 0.00 0.00 177.10 175.73 3ia8 h PRO 8 N 6.93 0.32 -0.81 0.43 0.11 -1.94 -1.62 132.00 135.43 3ia8 h PRO 8 Ca -0.26 -0.02 0.21 0.00 0.11 0.00 0.00 66.00 66.04 3ia8 h PRO 8 Cb 1.21 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 3ia8 h PRO 8 CO 0.48 0.21 0.56 0.28 -0.21 0.00 0.00 178.00 179.32 3ia8 h VAL 9 N 0.33 0.64 -0.01 3.15 2.07 -1.94 -2.01 116.25 118.48 3ia8 h VAL 9 Ca 0.26 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.74 3ia8 h VAL 9 Cb 0.59 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3ia8 h VAL 9 CO -0.06 0.03 -0.10 1.33 0.02 0.00 0.00 177.57 178.78 3ia8 n VAL 10 N -4.37 0.00 -0.27 2.57 0.24 -0.61 -4.41 118.33 111.48 3ia8 n VAL 10 Ca 0.16 -0.23 0.08 0.00 -2.04 0.00 0.00 64.34 62.31 3ia8 n VAL 10 Cb 0.78 0.59 0.23 0.00 -1.47 0.00 0.00 33.84 33.96 3ia8 n VAL 10 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3ia8 h GLU 11 N 2.20 0.35 0.00 7.34 4.22 -1.46 -0.35 114.58 126.88 3ia8 h GLU 11 Ca 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.42 3ia8 h GLU 11 Cb 0.56 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3ia8 h GLU 11 CO 0.00 0.23 0.00 -2.30 -2.18 0.00 0.00 179.01 174.76 3ia8 n PRO 12 N -5.08 0.15 -0.13 0.92 -0.02 -1.26 -1.79 135.00 127.80 3ia8 n PRO 12 Ca 0.17 0.59 0.04 0.00 -2.02 0.00 0.00 63.50 62.28 3ia8 n PRO 12 Cb 0.51 -1.95 0.11 0.00 -0.02 0.00 0.00 33.50 32.16 3ia8 n PRO 12 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3ia8 n LEU 13 N -2.26 2.69 0.26 2.45 4.77 -0.17 -4.71 117.00 120.03 3ia8 n LEU 13 Ca -0.01 -1.98 0.18 0.00 -0.03 0.00 0.00 56.01 54.17 3ia8 n LEU 13 Cb 0.08 -0.17 0.84 0.00 -2.33 0.00 0.00 43.42 41.84 3ia8 n LEU 13 CO 0.12 0.67 1.02 0.77 -1.33 0.00 0.00 177.39 178.64 3ia8 h SER 14 N 1.54 0.00 0.00 -1.43 4.64 -1.07 -3.36 113.55 113.87 3ia8 h SER 14 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 3ia8 h SER 14 Cb 0.67 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.74 3ia8 h SER 14 CO 0.00 0.00 0.11 -2.67 -0.87 0.00 0.00 176.83 173.40 3ia8 n TRP 15 N -2.86 0.00 -1.52 4.77 4.27 -1.26 -4.90 117.44 115.94 3ia8 n TRP 15 Ca -0.01 -0.48 0.00 0.00 -3.89 0.00 0.00 57.50 53.12 3ia8 n TRP 15 Cb 0.18 -0.65 0.00 0.00 -1.36 0.00 0.00 31.31 29.47 3ia8 n TRP 15 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 3ia8 n LEU 17 N 2.43 -2.04 0.00 5.67 4.77 -1.26 -4.97 117.00 121.60 3ia8 n LEU 17 Ca 0.10 2.04 0.00 0.00 -0.03 0.00 0.00 56.01 58.12 3ia8 n LEU 17 Cb 0.28 -2.56 0.00 0.00 -2.33 0.00 0.00 43.42 38.81 3ia8 n LEU 17 CO 0.13 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.89 3ia8 n GLY 18 N -0.51 1.29 3.57 -0.72 0.00 -0.33 -4.99 105.19 103.50 3ia8 n GLY 18 Ca 0.00 -1.63 -0.35 0.00 0.00 0.00 0.00 46.02 44.03 3ia8 n GLY 18 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ia8 s THR 19 N -1.62 4.65 0.07 2.61 2.01 -0.44 -1.21 115.64 121.71 3ia8 s THR 19 Ca 0.00 -0.07 0.07 0.00 0.31 0.00 0.00 61.69 61.99 3ia8 s THR 19 Cb 0.00 -3.12 -0.03 0.00 0.01 0.00 0.00 72.50 69.36 3ia8 s THR 19 CO 0.00 0.41 -0.18 0.26 -0.69 0.00 0.00 174.62 174.42 3ia8 s TRP 20 N 0.81 1.59 -0.03 4.92 0.52 0.75 -0.33 118.94 127.16 3ia8 s TRP 20 Ca 0.04 -0.40 0.02 0.00 0.02 0.00 0.00 56.10 55.78 3ia8 s TRP 20 Cb -0.14 -0.91 0.01 0.00 -1.15 0.00 0.00 33.47 31.28 3ia8 s TRP 20 CO 0.02 0.12 -0.08 -1.17 0.02 0.00 0.00 176.95 175.86 3ia8 s LEU 21 N -1.53 1.74 0.10 2.99 2.96 -0.11 -0.69 118.68 124.15 3ia8 s LEU 21 Ca 0.04 -0.18 -0.31 0.00 -0.22 0.00 0.00 54.13 53.47 3ia8 s LEU 21 Cb -0.09 -0.52 -0.10 0.00 0.50 0.00 0.00 46.19 45.98 3ia8 s LEU 21 CO 0.03 0.05 1.86 -0.94 -1.32 0.00 0.00 176.35 176.02 3ia8 s SER 22 N 0.27 6.44 -0.25 3.68 1.04 -0.50 -0.33 113.70 124.05 3ia8 s SER 22 Ca -0.04 2.72 -0.03 0.00 0.48 0.00 0.00 55.95 59.08 3ia8 s SER 22 Cb -0.09 -2.56 0.14 0.00 0.10 0.00 0.00 66.02 63.61 3ia8 s SER 22 CO 0.00 -1.01 0.44 -0.62 0.98 0.00 0.00 173.24 173.03 3ia8 s ASP 23 N 3.16 -0.21 1.09 7.02 -1.08 -0.47 -4.44 116.67 121.73 3ia8 s ASP 23 Ca 0.82 0.50 -0.08 0.00 -0.52 0.00 0.00 52.55 53.27 3ia8 s ASP 23 Cb -0.45 1.41 0.12 0.00 -1.46 0.00 0.00 42.92 42.53 3ia8 s ASP 23 CO 0.37 -0.28 0.44 -0.81 0.52 0.00 0.00 175.17 175.41 3ia8 n PRO 24 N 5.38 -1.69 -1.43 4.34 -0.04 -1.26 -4.44 135.00 135.87 3ia8 n PRO 24 Ca -0.04 -0.70 -0.36 0.00 -0.04 0.00 0.00 63.50 62.37 3ia8 n PRO 24 Cb 0.50 -0.63 0.09 0.00 -0.04 0.00 0.00 33.50 33.42 3ia8 n PRO 24 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3ia8 n PRO 25 N -2.72 0.63 -1.35 0.54 -0.02 -1.26 -4.60 135.00 126.21 3ia8 n PRO 25 Ca 0.06 0.27 -0.34 0.00 -2.02 0.00 0.00 63.50 61.47 3ia8 n PRO 25 Cb 0.23 -2.34 0.10 0.00 -0.02 0.00 0.00 33.50 31.48 3ia8 n PRO 25 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3ia8 s GLY 26 N -1.63 2.38 -0.19 -1.23 0.00 0.99 -4.78 107.32 102.86 3ia8 s GLY 26 Ca 0.76 0.94 -0.02 0.00 0.00 0.00 0.00 44.72 46.40 3ia8 s GLY 26 CO 0.47 1.36 -0.10 0.00 0.00 0.00 0.00 173.10 174.84 3ia8 s ALA 27 N -1.92 2.66 -0.06 3.20 0.00 -0.08 -2.00 121.76 123.56 3ia8 s ALA 27 Ca 0.76 -1.12 0.01 0.00 0.00 0.00 0.00 51.96 51.61 3ia8 s ALA 27 Cb -0.31 -1.48 -0.03 0.00 0.00 0.00 0.00 23.12 21.30 3ia8 s ALA 27 CO 0.46 -0.27 -0.08 0.20 0.00 0.00 0.00 175.76 176.07 3ia8 s GLY 28 N 1.20 1.66 0.18 0.00 0.00 -0.23 -1.67 107.32 108.46 3ia8 s GLY 28 Ca 0.02 -0.91 -0.17 0.00 0.00 0.00 0.00 44.72 43.66 3ia8 s GLY 28 CO -0.04 -0.69 0.50 -0.51 0.00 0.00 0.00 173.10 172.37 3ia8 s THR 29 N -0.79 0.03 -0.20 0.90 -4.23 0.23 -1.65 115.64 109.93 3ia8 s THR 29 Ca 0.12 -0.75 -0.32 0.00 -1.18 0.00 0.00 61.69 59.56 3ia8 s THR 29 Cb -0.11 -1.51 0.15 0.00 1.34 0.00 0.00 72.50 72.37 3ia8 s THR 29 CO 0.01 -0.15 1.19 -0.47 -0.54 0.00 0.00 174.62 174.66 3ia8 s TYR 30 N -3.86 -0.17 0.48 3.99 5.04 -1.26 -4.12 117.35 117.44 3ia8 s TYR 30 Ca 0.08 0.21 0.40 0.00 -2.44 0.00 0.00 57.07 55.33 3ia8 s TYR 30 Cb -0.00 0.49 2.15 0.00 0.35 0.00 0.00 41.96 44.95 3ia8 s TYR 30 CO -0.04 -0.20 2.23 -1.35 -1.34 0.00 0.00 175.55 174.85 3ia8 h PRO 31 N 2.15 0.00 -0.15 4.97 0.11 -1.98 -1.10 132.00 135.99 3ia8 h PRO 31 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 3ia8 h PRO 31 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3ia8 h PRO 31 CO 0.25 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.29 3ia8 n THR 32 N -2.96 0.17 -4.45 -1.15 -2.24 -1.26 -4.98 114.28 97.41 3ia8 n THR 32 Ca -0.02 -0.55 -0.27 0.00 -2.27 0.00 0.00 64.05 60.93 3ia8 n THR 32 Cb 0.09 1.19 -0.13 0.00 -2.10 0.00 0.00 70.33 69.38 3ia8 n THR 32 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3ia8 s LEU 33 N -1.82 2.28 0.24 3.22 1.43 -0.42 -5.12 118.68 118.50 3ia8 s LEU 33 Ca 0.33 -0.69 -0.30 0.00 -1.03 0.00 0.00 54.13 52.44 3ia8 s LEU 33 Cb 0.21 -1.11 -0.09 0.00 0.03 0.00 0.00 46.19 45.23 3ia8 s LEU 33 CO 0.31 0.15 1.15 -1.58 0.23 0.00 0.00 176.35 176.61 3ia8 s GLN 34 N -1.83 4.56 0.51 1.70 0.74 -1.26 -4.39 119.66 119.69 3ia8 s GLN 34 Ca 0.11 1.85 -0.23 0.00 0.05 0.00 0.00 55.36 57.15 3ia8 s GLN 34 Cb -0.10 -3.21 -0.06 0.00 1.10 0.00 0.00 33.01 30.75 3ia8 s GLN 34 CO 0.05 0.06 1.34 -2.14 -0.55 0.00 0.00 175.29 174.05 3ia8 s PRO 35 N -0.95 3.37 0.15 1.67 0.02 -1.26 -4.85 135.00 133.15 3ia8 s PRO 35 Ca 0.48 2.21 -0.03 0.00 0.02 0.00 0.00 61.00 63.68 3ia8 s PRO 35 Cb -0.33 -2.38 -0.03 0.00 0.02 0.00 0.00 34.50 31.78 3ia8 s PRO 35 CO 0.40 -1.00 0.12 -0.59 -0.33 0.00 0.00 177.00 175.60 3ia8 s PHE 36 N -1.31 0.81 0.28 6.54 -0.71 -0.66 -5.01 117.98 117.92 3ia8 s PHE 36 Ca 0.68 -1.16 0.10 0.00 -1.04 0.00 0.00 56.93 55.51 3ia8 s PHE 36 Cb -0.39 -0.40 -0.05 0.00 -1.21 0.00 0.00 43.02 40.96 3ia8 s PHE 36 CO 0.48 -0.59 -0.15 -0.65 -1.34 0.00 0.00 175.22 172.98 3ia8 s GLN 37 N -4.05 1.62 0.04 1.99 -0.21 -1.26 -1.07 119.66 116.72 3ia8 s GLN 37 Ca 0.25 -1.77 -0.18 0.00 0.02 0.00 0.00 55.36 53.68 3ia8 s GLN 37 Cb 0.06 -1.54 0.04 0.00 1.00 0.00 0.00 33.01 32.57 3ia8 s GLN 37 CO 0.03 0.22 0.41 1.52 -2.12 0.00 0.00 175.29 175.35 3ia8 s TYR 38 N -2.70 -0.27 0.05 0.91 1.13 -0.85 -4.56 117.35 111.07 3ia8 s TYR 38 Ca 0.29 0.24 -0.07 0.00 -1.41 0.00 0.00 57.07 56.12 3ia8 s TYR 38 Cb -0.01 0.22 -0.05 0.00 -1.10 0.00 0.00 41.96 41.01 3ia8 s TYR 38 CO 0.13 -0.56 0.33 -0.51 -2.51 0.00 0.00 175.55 172.43 3ia8 s LEU 39 N -1.95 4.35 -0.02 -3.49 1.43 -0.39 -0.00 118.68 118.60 3ia8 s LEU 39 Ca -0.06 0.64 -0.01 0.00 -1.03 0.00 0.00 54.13 53.67 3ia8 s LEU 39 Cb -0.01 -2.87 0.02 0.00 0.03 0.00 0.00 46.19 43.36 3ia8 s LEU 39 CO -0.02 0.20 0.05 -0.70 0.23 0.00 0.00 176.35 176.11 3ia8 s GLU 40 N -1.94 0.01 -0.18 1.70 2.12 -1.26 -0.31 118.70 118.85 3ia8 s GLU 40 Ca 0.31 0.15 -0.04 0.00 0.36 0.00 0.00 54.97 55.75 3ia8 s GLU 40 Cb -0.13 -0.12 -0.02 0.00 0.26 0.00 0.00 34.13 34.11 3ia8 s GLU 40 CO 0.18 -0.10 -0.03 -1.21 -0.54 0.00 0.00 175.26 173.56 3ia8 s GLU 41 N 0.62 3.60 -0.17 4.30 2.02 0.23 -1.41 118.70 127.89 3ia8 s GLU 41 Ca -0.05 -0.54 0.01 0.00 0.02 0.00 0.00 54.97 54.41 3ia8 s GLU 41 Cb -0.07 -2.96 0.02 0.00 0.10 0.00 0.00 34.13 31.22 3ia8 s GLU 41 CO -0.02 0.11 -0.18 0.08 0.02 0.00 0.00 175.26 175.27 3ia8 s VAL 42 N 0.70 1.92 -0.28 2.63 1.01 0.14 -0.60 120.40 125.93 3ia8 s VAL 42 Ca -0.02 -0.86 -0.02 0.00 0.00 0.00 0.00 61.98 61.09 3ia8 s VAL 42 Cb -0.14 -1.75 0.04 0.00 0.00 0.00 0.00 36.38 34.52 3ia8 s VAL 42 CO 0.02 0.51 -0.02 -1.00 0.00 0.00 0.00 175.10 174.61 3ia8 s HIS 43 N 1.34 3.18 -0.16 5.22 3.76 0.23 -0.18 115.29 128.69 3ia8 s HIS 43 Ca 0.05 -1.72 0.01 0.00 -0.15 0.00 0.00 55.06 53.25 3ia8 s HIS 43 Cb -0.13 -2.09 0.02 0.00 1.11 0.00 0.00 32.58 31.49 3ia8 s HIS 43 CO -0.12 -0.77 -0.19 0.42 -0.85 0.00 0.00 174.74 173.23 3ia8 s ILE 44 N 1.29 1.90 0.30 0.60 1.01 -0.35 -1.40 121.20 124.55 3ia8 s ILE 44 Ca -0.03 -0.85 0.01 0.00 0.00 0.00 0.00 60.65 59.78 3ia8 s ILE 44 Cb -0.18 -1.72 -0.02 0.00 0.01 0.00 0.00 42.46 40.55 3ia8 s ILE 44 CO -0.02 0.52 0.32 -0.94 0.00 0.00 0.00 174.94 174.81 3ia8 s SER 45 N 1.18 0.95 0.09 3.58 1.04 0.02 -1.19 113.70 119.38 3ia8 s SER 45 Ca 0.01 -1.53 -0.08 0.00 0.48 0.00 0.00 55.95 54.83 3ia8 s SER 45 Cb -0.14 0.55 -0.00 0.00 0.10 0.00 0.00 66.02 66.53 3ia8 s SER 45 CO -0.09 -1.08 0.18 -1.38 0.98 0.00 0.00 173.24 171.85 3ia8 s HIS 46 N -3.55 0.20 -0.16 5.02 -3.43 -1.26 -0.27 115.29 111.84 3ia8 s HIS 46 Ca 0.36 -0.63 0.17 0.00 -0.80 0.00 0.00 55.06 54.16 3ia8 s HIS 46 Cb 0.02 -0.08 0.44 0.00 -1.43 0.00 0.00 32.58 31.54 3ia8 s HIS 46 CO 0.20 -0.55 1.18 1.33 -2.00 0.00 0.00 174.74 174.90 3ia8 n VAL 47 N -0.07 1.41 -0.60 -5.38 0.24 -1.26 -4.95 118.33 107.72 3ia8 n VAL 47 Ca -0.14 -2.63 0.00 0.00 -2.04 0.00 0.00 64.34 59.53 3ia8 n VAL 47 Cb 0.62 0.24 0.00 0.00 -1.47 0.00 0.00 33.84 33.23 3ia8 n VAL 47 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ia8 n GLY 48 N -0.45 0.85 3.92 7.63 0.00 -1.26 -4.93 105.19 110.95 3ia8 n GLY 48 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 3ia8 n GLY 48 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ia8 s GLN 49 N -0.38 2.39 -1.57 1.61 -0.21 -1.26 -4.25 119.66 116.00 3ia8 s GLN 49 Ca 0.00 -0.11 -0.10 0.00 0.02 0.00 0.00 55.36 55.17 3ia8 s GLN 49 Cb 0.00 -2.16 -0.08 0.00 1.00 0.00 0.00 33.01 31.76 3ia8 s GLN 49 CO 0.00 -1.13 2.88 -0.35 -2.12 0.00 0.00 175.29 174.57 3ia8 n PRO 50 N -2.88 3.56 -4.26 2.91 -0.04 -1.26 -4.50 135.00 128.52 3ia8 n PRO 50 Ca 0.07 -2.15 -0.29 0.00 -0.04 0.00 0.00 63.50 61.09 3ia8 n PRO 50 Cb 0.60 -2.79 -0.10 0.00 -0.04 0.00 0.00 33.50 31.17 3ia8 n PRO 50 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3ia8 s LEU 52 N 0.22 2.90 -0.01 1.53 1.43 0.21 -4.04 118.68 120.93 3ia8 s LEU 52 Ca 0.67 -0.48 0.02 0.00 -1.03 0.00 0.00 54.13 53.31 3ia8 s LEU 52 Cb 0.17 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.66 3ia8 s LEU 52 CO -0.06 0.17 -0.05 0.20 0.23 0.00 0.00 176.35 176.84 3ia8 s ASN 53 N -2.29 4.75 0.02 2.29 0.01 0.62 -1.15 114.94 119.20 3ia8 s ASN 53 Ca 0.21 -0.09 -0.01 0.00 -0.71 0.00 0.00 52.86 52.25 3ia8 s ASN 53 Cb -0.11 -1.15 -0.02 0.00 0.41 0.00 0.00 41.25 40.38 3ia8 s ASN 53 CO 0.13 0.29 -0.01 0.72 -1.51 0.00 0.00 177.10 176.72 3ia8 s PHE 54 N -0.99 0.26 -0.03 2.20 -0.12 -0.55 -0.80 117.98 117.94 3ia8 s PHE 54 Ca 0.17 -0.54 0.00 0.00 -0.05 0.00 0.00 56.93 56.52 3ia8 s PHE 54 Cb -0.11 -0.19 0.03 0.00 -0.63 0.00 0.00 43.02 42.11 3ia8 s PHE 54 CO 0.07 -0.23 -0.00 -1.54 -0.05 0.00 0.00 175.22 173.47 3ia8 s SER 55 N -1.62 0.60 -0.23 1.98 1.04 -0.49 -1.63 113.70 113.35 3ia8 s SER 55 Ca -0.13 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.26 3ia8 s SER 55 Cb -0.08 -0.26 0.03 0.00 0.10 0.00 0.00 66.02 65.81 3ia8 s SER 55 CO -0.02 -0.11 -0.12 -0.36 0.98 0.00 0.00 173.24 173.62 3ia8 s PHE 56 N 1.12 3.01 -0.16 5.02 0.08 -0.35 -0.60 117.98 126.10 3ia8 s PHE 56 Ca -0.08 -1.72 0.01 0.00 0.12 0.00 0.00 56.93 55.25 3ia8 s PHE 56 Cb -0.13 -1.99 0.02 0.00 -0.57 0.00 0.00 43.02 40.35 3ia8 s PHE 56 CO -0.02 -0.78 -0.18 -0.80 -0.10 0.00 0.00 175.22 173.35 3ia8 s ASN 57 N 1.27 2.90 0.15 1.36 0.01 0.23 -1.70 114.94 119.16 3ia8 s ASN 57 Ca 0.00 -0.56 0.05 0.00 -0.71 0.00 0.00 52.86 51.63 3ia8 s ASN 57 Cb -0.16 -1.33 -0.04 0.00 0.41 0.00 0.00 41.25 40.13 3ia8 s ASN 57 CO -0.07 -0.01 0.12 -0.94 -1.51 0.00 0.00 177.10 174.69 3ia8 s SER 58 N 1.30 5.52 0.01 -1.22 1.04 -0.16 -0.60 113.70 119.59 3ia8 s SER 58 Ca 0.03 -0.11 -0.04 0.00 0.48 0.00 0.00 55.95 56.31 3ia8 s SER 58 Cb -0.13 -1.45 -0.01 0.00 0.10 0.00 0.00 66.02 64.53 3ia8 s SER 58 CO -0.10 0.09 0.07 -0.36 0.98 0.00 0.00 173.24 173.92 3ia8 s PHE 59 N -1.68 0.11 0.21 5.02 0.40 0.57 -4.18 117.98 118.44 3ia8 s PHE 59 Ca 0.31 -0.25 -0.31 0.00 -0.60 0.00 0.00 56.93 56.08 3ia8 s PHE 59 Cb -0.10 -0.09 -0.10 0.00 0.51 0.00 0.00 43.02 43.23 3ia8 s PHE 59 CO 0.23 -0.24 1.48 -1.58 0.70 0.00 0.00 175.22 175.82 3ia8 s HIS 60 N -1.33 3.04 0.44 0.36 5.65 -0.05 -1.27 115.29 122.14 3ia8 s HIS 60 Ca -0.14 0.88 0.18 0.00 0.25 0.00 0.00 55.06 56.22 3ia8 s HIS 60 Cb -0.08 -3.85 1.11 0.00 -1.18 0.00 0.00 32.58 28.57 3ia8 s HIS 60 CO 0.01 -2.93 2.01 -1.35 -0.65 0.00 0.00 174.74 171.83 3ia8 h PRO 61 N 5.76 0.00 0.06 2.88 0.11 -1.92 0.14 132.00 139.02 3ia8 h PRO 61 Ca -0.45 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.33 3ia8 h PRO 61 Cb 1.21 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 3ia8 h PRO 61 CO 0.83 0.18 -1.93 -0.25 -0.21 0.00 0.00 178.00 176.61 3ia8 n ASP 62 N -4.15 1.50 -0.00 -2.05 8.00 -1.26 -4.53 116.55 114.06 3ia8 n ASP 62 Ca -0.02 0.26 0.04 0.00 0.71 0.00 0.00 54.79 55.78 3ia8 n ASP 62 Cb 0.25 -0.41 -0.06 0.00 -0.02 0.00 0.00 41.12 40.87 3ia8 n ASP 62 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3ia8 n THR 63 N -3.25 0.00 -1.41 -3.53 -2.24 -1.23 -5.00 114.28 97.62 3ia8 n THR 63 Ca -0.27 -0.22 -0.14 0.00 -2.27 0.00 0.00 64.05 61.15 3ia8 n THR 63 Cb 1.05 0.46 -0.06 0.00 -2.10 0.00 0.00 70.33 69.68 3ia8 n THR 63 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3ia8 n ARG 64 N -1.66 -1.23 -1.85 -0.78 1.74 0.47 -4.97 116.66 108.38 3ia8 n ARG 64 Ca -0.01 0.98 -0.42 0.00 -0.77 0.00 0.00 57.85 57.64 3ia8 n ARG 64 Cb 0.20 -5.19 -0.02 0.00 -1.02 0.00 0.00 32.46 26.42 3ia8 n ARG 64 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 3ia8 s LYS 65 N -3.14 4.18 0.83 5.56 2.20 -1.26 -4.58 119.74 123.53 3ia8 s LYS 65 Ca 0.00 2.47 -0.13 0.00 -0.36 0.00 0.00 55.97 57.95 3ia8 s LYS 65 Cb 0.00 -3.09 0.06 0.00 -1.51 0.00 0.00 37.83 33.29 3ia8 s LYS 65 CO 0.00 -0.62 0.91 -2.30 -0.36 0.00 0.00 175.35 172.98 3ia8 n PRO 66 N 3.17 0.05 -1.40 4.03 -0.02 -1.26 -0.87 135.00 138.70 3ia8 n PRO 66 Ca 0.11 0.08 -0.45 0.00 -2.02 0.00 0.00 63.50 61.23 3ia8 n PRO 66 Cb 0.38 -2.20 -0.01 0.00 -0.02 0.00 0.00 33.50 31.64 3ia8 n PRO 66 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 3ia8 n HIS 68 N -3.27 -0.81 -3.82 6.00 -0.00 -1.26 -4.84 115.22 107.22 3ia8 n HIS 68 Ca 0.11 0.77 -0.13 0.00 -0.00 0.00 0.00 57.72 58.48 3ia8 n HIS 68 Cb 0.51 -1.94 -0.14 0.00 -0.00 0.00 0.00 29.99 28.43 3ia8 n HIS 68 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 3ia8 s ARG 69 N -1.16 0.08 0.11 1.57 0.52 -1.26 -0.99 118.95 117.82 3ia8 s ARG 69 Ca 0.62 0.16 -0.07 0.00 -0.52 0.00 0.00 55.73 55.91 3ia8 s ARG 69 Cb -0.76 -0.01 -0.01 0.00 0.52 0.00 0.00 34.95 34.69 3ia8 s ARG 69 CO 0.59 -0.04 0.18 -1.83 0.02 0.00 0.00 175.30 174.21 3ia8 s GLU 70 N 0.28 0.92 0.11 3.54 -1.05 -0.69 -0.79 118.70 121.01 3ia8 s GLU 70 Ca -0.02 -1.11 -0.17 0.00 -0.15 0.00 0.00 54.97 53.52 3ia8 s GLU 70 Cb -0.03 0.33 0.04 0.00 -0.44 0.00 0.00 34.13 34.02 3ia8 s GLU 70 CO -0.01 -0.29 0.41 0.00 0.95 0.00 0.00 175.26 176.32 3ia8 n GLY 72 N -0.07 -0.60 3.05 0.00 0.00 -0.65 -1.22 105.19 105.70 3ia8 n GLY 72 Ca -0.17 -0.60 -0.10 0.00 0.00 0.00 0.00 46.02 45.15 3ia8 n GLY 72 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ia8 s PHE 73 N -4.00 0.11 -0.20 1.61 0.08 -0.56 -1.48 117.98 113.53 3ia8 s PHE 73 Ca 0.00 -0.24 0.00 0.00 0.12 0.00 0.00 56.93 56.82 3ia8 s PHE 73 Cb 0.00 -0.09 0.05 0.00 -0.57 0.00 0.00 43.02 42.41 3ia8 s PHE 73 CO 0.00 -0.23 -0.07 0.42 -0.10 0.00 0.00 175.22 175.24 3ia8 s ILE 74 N -1.25 1.44 -0.02 0.64 1.01 -0.30 -1.33 121.20 121.39 3ia8 s ILE 74 Ca -0.14 -0.97 0.04 0.00 0.00 0.00 0.00 60.65 59.58 3ia8 s ILE 74 Cb -0.08 -1.62 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 3ia8 s ILE 74 CO 0.00 0.06 -0.12 -0.13 0.00 0.00 0.00 174.94 174.76 3ia8 s ARG 75 N 1.47 2.48 -0.13 2.79 0.52 0.54 -0.62 118.95 125.99 3ia8 s ARG 75 Ca -0.02 -0.73 -0.06 0.00 -0.52 0.00 0.00 55.73 54.39 3ia8 s ARG 75 Cb -0.17 -2.41 -0.04 0.00 0.52 0.00 0.00 34.95 32.85 3ia8 s ARG 75 CO -0.07 0.61 0.10 -0.51 0.02 0.00 0.00 175.30 175.44 3ia8 s LEU 76 N -1.06 4.13 -0.11 2.53 2.01 -1.26 -0.46 118.68 124.45 3ia8 s LEU 76 Ca 0.14 0.33 -0.30 0.00 0.01 0.00 0.00 54.13 54.32 3ia8 s LEU 76 Cb -0.11 -2.00 -0.02 0.00 0.01 0.00 0.00 46.19 44.07 3ia8 s LEU 76 CO 0.03 0.36 1.23 -0.75 1.01 0.00 0.00 176.35 178.23 3ia8 s LYS 77 N -0.72 4.29 0.38 1.70 2.20 -0.27 -4.95 119.74 122.37 3ia8 s LYS 77 Ca 0.13 1.66 -0.27 0.00 -0.36 0.00 0.00 55.97 57.12 3ia8 s LYS 77 Cb -0.12 -3.66 -0.11 0.00 -1.51 0.00 0.00 37.83 32.43 3ia8 s LYS 77 CO 0.03 -0.58 1.31 -2.30 -0.36 0.00 0.00 175.35 173.44 3ia8 n PRO 78 N 5.93 2.12 -2.13 4.03 -0.02 -1.26 -2.19 135.00 141.48 3ia8 n PRO 78 Ca 0.12 0.75 -0.16 0.00 -2.02 0.00 0.00 63.50 62.19 3ia8 n PRO 78 Cb 0.45 -2.39 -0.02 0.00 -0.02 0.00 0.00 33.50 31.52 3ia8 n PRO 78 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3ia8 n ASP 79 N 0.52 -4.77 -3.91 2.55 8.00 -1.26 -4.98 116.55 112.69 3ia8 n ASP 79 Ca 0.05 0.07 -0.11 0.00 0.71 0.00 0.00 54.79 55.50 3ia8 n ASP 79 Cb 0.38 -3.85 -0.07 0.00 -0.02 0.00 0.00 41.12 37.56 3ia8 n ASP 79 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3ia8 s THR 80 N -2.75 0.00 -1.15 -3.53 -4.23 -0.93 -5.02 115.64 98.02 3ia8 s THR 80 Ca 0.00 -1.65 0.17 0.00 -1.18 0.00 0.00 61.69 59.03 3ia8 s THR 80 Cb 0.00 -2.39 0.67 0.00 1.34 0.00 0.00 72.50 72.13 3ia8 s THR 80 CO 0.00 0.00 1.57 -0.46 -0.54 0.00 0.00 174.62 175.19 3ia8 n ASN 81 N -0.56 4.47 -4.75 3.99 6.94 -1.26 -4.71 115.26 119.38 3ia8 n ASN 81 Ca 0.00 -2.43 -0.40 0.00 -0.02 0.00 0.00 54.58 51.74 3ia8 n ASN 81 Cb 0.63 -0.56 -0.05 0.00 -2.36 0.00 0.00 39.78 37.44 3ia8 n ASN 81 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3ia8 s LYS 82 N -1.86 4.69 0.03 -3.83 -0.14 -1.26 -1.19 119.74 116.18 3ia8 s LYS 82 Ca 0.47 1.34 0.04 0.00 -1.36 0.00 0.00 55.97 56.46 3ia8 s LYS 82 Cb 0.31 -3.32 -0.02 0.00 -1.68 0.00 0.00 37.83 33.12 3ia8 s LYS 82 CO 0.23 0.40 -0.11 0.08 -0.76 0.00 0.00 175.35 175.19 3ia8 s VAL 83 N -0.65 0.87 -0.02 3.17 1.01 -0.14 -1.11 120.40 123.53 3ia8 s VAL 83 Ca 0.41 -0.81 0.05 0.00 0.00 0.00 0.00 61.98 61.63 3ia8 s VAL 83 Cb -0.24 -0.80 -0.01 0.00 0.00 0.00 0.00 36.38 35.34 3ia8 s VAL 83 CO 0.29 -0.00 -0.16 0.00 0.00 0.00 0.00 175.10 175.22 3ia8 s ALA 84 N -0.74 1.39 -0.07 5.51 0.00 0.39 -1.37 121.76 126.87 3ia8 s ALA 84 Ca 0.00 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.29 3ia8 s ALA 84 Cb -0.07 -0.38 0.01 0.00 0.00 0.00 0.00 23.12 22.68 3ia8 s ALA 84 CO 0.01 0.32 -0.16 0.12 0.00 0.00 0.00 175.76 176.04 3ia8 s PHE 85 N -0.29 1.81 -0.02 0.00 2.19 0.14 -0.34 117.98 121.47 3ia8 s PHE 85 Ca 0.04 -0.68 0.05 0.00 0.33 0.00 0.00 56.93 56.68 3ia8 s PHE 85 Cb -0.07 -1.27 -0.01 0.00 -1.31 0.00 0.00 43.02 40.36 3ia8 s PHE 85 CO -0.00 -0.30 -0.18 0.14 1.83 0.00 0.00 175.22 176.71 3ia8 s VAL 86 N 0.48 1.42 -0.00 3.12 -7.23 -0.44 -0.49 120.40 117.26 3ia8 s VAL 86 Ca -0.14 -0.75 -0.01 0.00 -1.81 0.00 0.00 61.98 59.27 3ia8 s VAL 86 Cb -0.16 -1.19 -0.00 0.00 0.56 0.00 0.00 36.38 35.59 3ia8 s VAL 86 CO 0.05 0.40 0.02 -0.55 -0.31 0.00 0.00 175.10 174.71 3ia8 s SER 87 N -0.27 0.04 -0.07 4.85 0.15 -0.89 -1.50 113.70 116.00 3ia8 s SER 87 Ca 0.03 -0.08 0.04 0.00 0.70 0.00 0.00 55.95 56.64 3ia8 s SER 87 Cb -0.08 0.06 -0.02 0.00 -1.71 0.00 0.00 66.02 64.27 3ia8 s SER 87 CO 0.00 -0.08 -0.18 0.00 1.20 0.00 0.00 173.24 174.18 3ia8 s ALA 88 N -0.36 2.47 0.12 5.45 0.00 -0.36 -1.65 121.76 127.43 3ia8 s ALA 88 Ca -0.04 -0.98 0.10 0.00 0.00 0.00 0.00 51.96 51.04 3ia8 s ALA 88 Cb -0.03 -0.92 -0.04 0.00 0.00 0.00 0.00 23.12 22.13 3ia8 s ALA 88 CO -0.00 0.42 -0.25 -0.65 0.00 0.00 0.00 175.76 175.28 3ia8 s GLN 89 N -0.24 1.33 0.00 0.00 -0.21 0.45 -1.56 119.66 119.44 3ia8 s GLN 89 Ca 0.00 -1.27 0.21 0.00 0.02 0.00 0.00 55.36 54.32 3ia8 s GLN 89 Cb -0.13 -1.74 1.11 0.00 1.00 0.00 0.00 33.01 33.25 3ia8 s GLN 89 CO 0.03 0.41 1.69 0.27 -2.12 0.00 0.00 175.29 175.57 3ia8 n ASN 90 N 1.03 0.00 0.00 5.90 6.94 0.03 -0.85 115.26 128.31 3ia8 n ASN 90 Ca -0.18 -0.09 0.09 0.00 -0.02 0.00 0.00 54.58 54.38 3ia8 n ASN 90 Cb 0.53 -0.25 0.42 0.00 -2.36 0.00 0.00 39.78 38.12 3ia8 n ASN 90 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 3ia8 n THR 91 N -1.25 0.64 -1.53 5.53 -2.24 -1.26 -4.87 114.28 109.30 3ia8 n THR 91 Ca 0.11 0.16 0.00 0.00 -2.27 0.00 0.00 64.05 62.05 3ia8 n THR 91 Cb 0.16 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 67.55 3ia8 n THR 91 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ia8 n GLY 92 N 0.43 0.92 3.31 3.38 0.00 -0.03 -4.67 105.19 108.54 3ia8 n GLY 92 Ca 0.05 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 3ia8 n GLY 92 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ia8 s VAL 93 N -2.31 2.01 0.13 1.61 1.01 -1.13 -1.15 120.40 120.57 3ia8 s VAL 93 Ca 0.00 -1.18 0.09 0.00 0.00 0.00 0.00 61.98 60.89 3ia8 s VAL 93 Cb 0.00 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 3ia8 s VAL 93 CO 0.00 0.48 -0.20 0.68 0.00 0.00 0.00 175.10 176.06 3ia8 s VAL 94 N -0.67 1.81 0.03 2.92 -7.23 -0.02 -0.41 120.40 116.83 3ia8 s VAL 94 Ca 0.10 -1.73 -0.12 0.00 -1.81 0.00 0.00 61.98 58.42 3ia8 s VAL 94 Cb -0.10 -1.72 0.01 0.00 0.56 0.00 0.00 36.38 35.13 3ia8 s VAL 94 CO 0.00 -0.16 0.26 -1.83 -0.31 0.00 0.00 175.10 173.06 3ia8 s GLU 95 N -2.31 0.74 -0.12 4.82 -1.05 -0.66 -1.38 118.70 118.73 3ia8 s GLU 95 Ca 0.11 -0.52 0.01 0.00 -0.15 0.00 0.00 54.97 54.43 3ia8 s GLU 95 Cb -0.08 0.31 0.02 0.00 -0.44 0.00 0.00 34.13 33.94 3ia8 s GLU 95 CO 0.06 -0.22 -0.16 0.08 0.95 0.00 0.00 175.26 175.96 3ia8 s VAL 96 N -2.39 1.61 0.08 1.83 1.01 -0.21 -2.09 120.40 120.25 3ia8 s VAL 96 Ca -0.06 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.31 3ia8 s VAL 96 Cb -0.02 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 3ia8 s VAL 96 CO -0.03 0.46 -0.23 -1.61 0.00 0.00 0.00 175.10 173.69 3ia8 s GLU 97 N 1.09 1.42 0.07 2.72 2.02 0.36 -0.86 118.70 125.51 3ia8 s GLU 97 Ca -0.04 -1.12 -0.00 0.00 0.02 0.00 0.00 54.97 53.83 3ia8 s GLU 97 Cb -0.14 -1.68 -0.04 0.00 0.10 0.00 0.00 34.13 32.37 3ia8 s GLU 97 CO -0.04 0.41 -0.04 -1.21 0.02 0.00 0.00 175.26 174.40 3ia8 s GLU 98 N -1.56 0.69 0.00 1.61 2.02 -0.28 0.28 118.70 121.46 3ia8 s GLU 98 Ca 0.10 -1.26 0.00 0.00 0.02 0.00 0.00 54.97 53.83 3ia8 s GLU 98 Cb -0.10 0.08 0.00 0.00 0.10 0.00 0.00 34.13 34.21 3ia8 s GLU 98 CO 0.03 -0.08 0.00 0.41 0.02 0.00 0.00 175.26 175.64 3ia8 n GLY 99 N 0.06 -0.84 3.33 -1.39 0.00 -0.47 -1.24 105.19 104.64 3ia8 n GLY 99 Ca -0.13 -0.22 -0.09 0.00 0.00 0.00 0.00 46.02 45.57 3ia8 n GLY 99 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3ia8 s GLU 100 N -0.32 1.10 -0.13 1.61 -1.05 -0.70 -0.97 118.70 118.24 3ia8 s GLU 100 Ca 0.00 -1.02 -0.02 0.00 -0.15 0.00 0.00 54.97 53.79 3ia8 s GLU 100 Cb 0.00 0.40 -0.02 0.00 -0.44 0.00 0.00 34.13 34.07 3ia8 s GLU 100 CO 0.00 -0.41 -0.08 0.54 0.95 0.00 0.00 175.26 176.26 3ia8 s VAL 101 N -3.91 3.53 -0.12 1.83 0.11 -0.33 -1.47 120.40 120.03 3ia8 s VAL 101 Ca 0.11 -0.50 -0.01 0.00 -2.93 0.00 0.00 61.98 58.66 3ia8 s VAL 101 Cb 0.03 -2.51 0.03 0.00 -1.53 0.00 0.00 36.38 32.40 3ia8 s VAL 101 CO -0.05 0.52 -0.05 0.20 -3.33 0.00 0.00 175.10 172.39 3ia8 s ASN 102 N 0.18 2.30 1.77 3.54 0.01 0.18 -4.82 114.94 118.10 3ia8 s ASN 102 Ca -0.04 -0.39 0.00 0.00 -0.71 0.00 0.00 52.86 51.72 3ia8 s ASN 102 Cb -0.14 -0.79 0.00 0.00 0.41 0.00 0.00 41.25 40.73 3ia8 s ASN 102 CO 0.04 -0.16 0.00 0.61 -1.51 0.00 0.00 177.10 176.08 3ia8 n GLY 103 N 4.96 3.40 2.58 0.66 0.00 -1.26 -2.20 105.19 113.33 3ia8 n GLY 103 Ca -0.11 -0.17 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 3ia8 n GLY 103 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3ia8 n GLN 104 N 13.94 2.90 -3.78 1.61 6.02 -1.26 -4.89 117.38 131.91 3ia8 n GLN 104 Ca 0.00 -3.63 -0.15 0.00 -0.01 0.00 0.00 57.00 53.21 3ia8 n GLN 104 Cb 0.00 -2.28 -0.16 0.00 1.02 0.00 0.00 30.24 28.83 3ia8 n GLN 104 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 3ia8 s GLU 105 N -3.88 -0.03 -0.13 -1.09 2.12 -0.94 -1.42 118.70 113.34 3ia8 s GLU 105 Ca 0.56 0.18 0.01 0.00 0.36 0.00 0.00 54.97 56.08 3ia8 s GLU 105 Cb 0.46 -0.25 -0.01 0.00 0.26 0.00 0.00 34.13 34.59 3ia8 s GLU 105 CO -0.21 -0.16 -0.17 -1.17 -0.54 0.00 0.00 175.26 173.01 3ia8 s LEU 106 N 1.05 2.49 -0.17 2.70 2.96 0.09 -0.64 118.68 127.16 3ia8 s LEU 106 Ca -0.09 -0.42 0.00 0.00 -0.22 0.00 0.00 54.13 53.40 3ia8 s LEU 106 Cb -0.13 -1.55 0.03 0.00 0.50 0.00 0.00 46.19 45.05 3ia8 s LEU 106 CO -0.03 0.15 -0.11 0.00 -1.32 0.00 0.00 176.35 175.04 3ia8 s ILE 108 N 1.49 1.07 -0.01 0.00 -4.36 -0.39 -1.72 121.20 117.27 3ia8 s ILE 108 Ca 0.02 -1.70 -0.03 0.00 -0.26 0.00 0.00 60.65 58.69 3ia8 s ILE 108 Cb -0.14 -1.45 0.00 0.00 1.25 0.00 0.00 42.46 42.12 3ia8 s ILE 108 CO -0.09 -0.53 0.06 0.00 0.24 0.00 0.00 174.94 174.61 3ia8 s ALA 109 N -2.43 -0.13 0.40 2.27 0.00 -0.37 -0.82 121.76 120.68 3ia8 s ALA 109 Ca 0.07 -0.02 -0.26 0.00 0.00 0.00 0.00 51.96 51.76 3ia8 s ALA 109 Cb -0.03 -0.02 -0.08 0.00 0.00 0.00 0.00 23.12 22.98 3ia8 s ALA 109 CO 0.01 -0.08 1.22 -1.54 0.00 0.00 0.00 175.76 175.36 3ia8 s SER 110 N -0.48 6.45 -0.00 0.00 1.04 0.46 -1.12 113.70 120.04 3ia8 s SER 110 Ca -0.05 2.47 0.03 0.00 0.48 0.00 0.00 55.95 58.87 3ia8 s SER 110 Cb -0.03 -2.62 -0.05 0.00 0.10 0.00 0.00 66.02 63.41 3ia8 s SER 110 CO 0.00 -0.74 0.10 0.00 0.98 0.00 0.00 173.24 173.59 3ia8 n HIS 111 N 0.11 0.00 -3.76 5.02 1.44 -0.04 -4.78 115.22 113.22 3ia8 n HIS 111 Ca 0.04 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.62 3ia8 n HIS 111 Cb 0.45 -0.05 -0.14 0.00 0.12 0.00 0.00 29.99 30.38 3ia8 n HIS 111 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 3ia8 s SER 112 N -1.97 -0.12 -0.01 4.39 0.01 -1.20 -5.02 113.70 109.78 3ia8 s SER 112 Ca -0.00 0.31 0.01 0.00 1.31 0.00 0.00 55.95 57.58 3ia8 s SER 112 Cb 0.02 0.22 0.00 0.00 0.21 0.00 0.00 66.02 66.47 3ia8 s SER 112 CO 0.14 -0.13 -0.03 -0.63 0.41 0.00 0.00 173.24 172.99 3ia8 s ILE 113 N 0.99 0.30 0.12 1.44 1.01 -1.26 -1.04 121.20 122.76 3ia8 s ILE 113 Ca -0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 60.65 60.42 3ia8 s ILE 113 Cb -0.10 -0.28 -0.03 0.00 0.01 0.00 0.00 42.46 42.06 3ia8 s ILE 113 CO -0.05 0.10 0.07 0.00 0.00 0.00 0.00 174.94 175.06 3ia8 s ALA 114 N 0.09 0.65 0.13 9.38 0.00 -0.48 -5.00 121.76 126.53 3ia8 s ALA 114 Ca -0.01 -1.32 -0.17 0.00 0.00 0.00 0.00 51.96 50.47 3ia8 s ALA 114 Cb -0.04 0.74 0.04 0.00 0.00 0.00 0.00 23.12 23.86 3ia8 s ALA 114 CO -0.00 -0.49 0.43 -0.98 0.00 0.00 0.00 175.76 174.72 3ia8 s ARG 115 N -4.01 1.11 0.55 0.00 1.70 -1.26 -0.84 118.95 116.20 3ia8 s ARG 115 Ca 0.19 -0.71 -0.18 0.00 -0.47 0.00 0.00 55.73 54.56 3ia8 s ARG 115 Cb 0.07 0.48 -0.06 0.00 -0.57 0.00 0.00 34.95 34.88 3ia8 s ARG 115 CO -0.01 -0.44 1.07 0.96 -1.08 0.00 0.00 175.30 175.79 3ia8 s ILE 116 N -3.81 3.62 0.50 4.99 -4.36 -0.30 -4.94 121.20 116.89 3ia8 s ILE 116 Ca 0.04 0.90 0.31 0.00 -0.26 0.00 0.00 60.65 61.64 3ia8 s ILE 116 Cb 0.01 -3.36 0.34 0.00 1.25 0.00 0.00 42.46 40.71 3ia8 s ILE 116 CO -0.11 -0.32 2.18 0.77 0.24 0.00 0.00 174.94 177.69 3ia8 h SER 117 N 0.97 0.00 -0.55 4.36 4.64 -2.00 -2.13 113.55 118.85 3ia8 h SER 117 Ca -0.48 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 60.57 3ia8 h SER 117 Cb 1.23 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.16 3ia8 h SER 117 CO 0.58 0.05 0.15 2.22 -0.87 0.00 0.00 176.83 178.96 3ia8 n PHE 118 N -3.59 1.71 -2.01 4.77 -1.74 -1.26 -5.02 117.46 110.32 3ia8 n PHE 118 Ca -0.02 -1.60 -0.37 0.00 -0.56 0.00 0.00 57.45 54.90 3ia8 n PHE 118 Cb 0.16 -0.62 0.03 0.00 1.52 0.00 0.00 39.48 40.57 3ia8 n PHE 118 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3ia8 s ALA 119 N -3.22 2.70 0.26 1.98 0.00 -0.80 -4.96 121.76 117.72 3ia8 s ALA 119 Ca 0.49 1.07 -0.30 0.00 0.00 0.00 0.00 51.96 53.22 3ia8 s ALA 119 Cb 0.42 -3.46 -0.09 0.00 0.00 0.00 0.00 23.12 19.99 3ia8 s ALA 119 CO 0.04 -1.10 1.08 0.21 0.00 0.00 0.00 175.76 175.99 3ia8 s LYS 120 N -3.10 4.66 0.37 0.00 2.20 -1.26 -5.03 119.74 117.58 3ia8 s LYS 120 Ca 0.73 1.76 -0.11 0.00 -0.36 0.00 0.00 55.97 57.98 3ia8 s LYS 120 Cb -0.32 -3.21 -0.07 0.00 -1.51 0.00 0.00 37.83 32.72 3ia8 s LYS 120 CO 0.37 0.24 0.75 -1.21 -0.36 0.00 0.00 175.35 175.13 3ia8 s GLU 121 N -1.30 3.83 0.45 4.03 2.02 -1.26 -4.29 118.70 122.18 3ia8 s GLU 121 Ca 0.45 0.50 -0.20 0.00 0.02 0.00 0.00 54.97 55.73 3ia8 s GLU 121 Cb -0.31 -2.42 -0.10 0.00 0.10 0.00 0.00 34.13 31.40 3ia8 s GLU 121 CO 0.39 0.03 0.96 -1.25 0.02 0.00 0.00 175.26 175.42 3ia8 s PRO 122 N -3.58 4.16 0.12 0.39 0.05 -1.26 -5.14 135.00 129.74 3ia8 s PRO 122 Ca 0.52 1.09 -0.26 0.00 0.05 0.00 0.00 61.00 62.39 3ia8 s PRO 122 Cb -0.10 -2.17 -0.07 0.00 0.05 0.00 0.00 34.50 32.21 3ia8 s PRO 122 CO 0.27 -0.09 0.80 -1.01 0.05 0.00 0.00 177.00 177.03 3ia8 s HIS 123 N -2.27 3.83 0.23 0.56 3.76 -1.26 -4.94 115.29 115.20 3ia8 s HIS 123 Ca 0.61 1.60 -0.30 0.00 -0.15 0.00 0.00 55.06 56.83 3ia8 s HIS 123 Cb -0.09 -2.83 -0.09 0.00 1.11 0.00 0.00 32.58 30.68 3ia8 s HIS 123 CO 0.17 0.38 1.24 0.54 -0.85 0.00 0.00 174.74 176.22 3ia8 s VAL 124 N -0.59 3.28 -0.08 -0.90 0.11 -1.26 -2.69 120.40 118.27 3ia8 s VAL 124 Ca 0.38 1.13 0.06 0.00 -2.93 0.00 0.00 61.98 60.62 3ia8 s VAL 124 Cb -0.22 -3.72 -0.09 0.00 -1.53 0.00 0.00 36.38 30.82 3ia8 s VAL 124 CO 0.26 0.21 0.01 -0.62 -3.33 0.00 0.00 175.10 171.62 3ia8 n GLU 125 N 2.04 2.38 -3.82 1.54 -0.58 0.53 -4.93 120.64 117.80 3ia8 n GLU 125 Ca 0.03 0.01 -0.12 0.00 -0.42 0.00 0.00 57.16 56.66 3ia8 n GLU 125 Cb 0.43 -1.19 -0.11 0.00 -0.57 0.00 0.00 31.44 30.00 3ia8 n GLU 125 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 3ia8 s GLN 126 N -2.18 0.37 0.02 3.49 -0.21 -1.04 -4.87 119.66 115.24 3ia8 s GLN 126 Ca -0.05 -0.00 0.03 0.00 0.02 0.00 0.00 55.36 55.35 3ia8 s GLN 126 Cb 0.02 0.16 -0.02 0.00 1.00 0.00 0.00 33.01 34.18 3ia8 s GLN 126 CO 0.30 -0.07 -0.08 0.42 -2.12 0.00 0.00 175.29 173.73 3ia8 s ILE 127 N -0.56 0.61 0.06 1.08 1.01 -1.26 -0.89 121.20 121.24 3ia8 s ILE 127 Ca -0.07 -0.72 0.04 0.00 0.00 0.00 0.00 60.65 59.90 3ia8 s ILE 127 Cb -0.04 -0.59 -0.03 0.00 0.01 0.00 0.00 42.46 41.81 3ia8 s ILE 127 CO 0.01 -0.10 -0.11 0.42 0.00 0.00 0.00 174.94 175.16 3ia8 s THR 128 N -0.77 0.88 0.02 2.92 -4.23 -0.32 -0.40 115.64 113.74 3ia8 s THR 128 Ca -0.03 -1.25 0.02 0.00 -1.18 0.00 0.00 61.69 59.26 3ia8 s THR 128 Cb -0.06 -0.92 -0.02 0.00 1.34 0.00 0.00 72.50 72.84 3ia8 s THR 128 CO 0.00 -0.31 -0.08 -0.13 -0.54 0.00 0.00 174.62 173.57 3ia8 s ARG 129 N -1.76 0.56 -0.11 3.99 0.52 0.00 -1.16 118.95 120.99 3ia8 s ARG 129 Ca -0.04 -0.53 0.02 0.00 -0.52 0.00 0.00 55.73 54.65 3ia8 s ARG 129 Cb -0.09 -0.45 0.01 0.00 0.52 0.00 0.00 34.95 34.94 3ia8 s ARG 129 CO 0.01 0.11 -0.16 0.21 0.02 0.00 0.00 175.30 175.49 3ia8 s LYS 130 N -0.93 2.35 -0.06 3.54 2.20 0.07 -1.26 119.74 125.65 3ia8 s LYS 130 Ca -0.03 -0.61 0.02 0.00 -0.36 0.00 0.00 55.97 54.99 3ia8 s LYS 130 Cb -0.06 -1.97 -0.03 0.00 -1.51 0.00 0.00 37.83 34.25 3ia8 s LYS 130 CO 0.00 -0.05 -0.11 -0.06 -0.36 0.00 0.00 175.35 174.78 3ia8 s PHE 131 N 0.95 2.82 -0.05 4.03 0.08 -0.30 -0.83 117.98 124.68 3ia8 s PHE 131 Ca -0.07 -0.07 -0.16 0.00 0.12 0.00 0.00 56.93 56.75 3ia8 s PHE 131 Cb -0.15 -1.67 0.03 0.00 -0.57 0.00 0.00 43.02 40.67 3ia8 s PHE 131 CO -0.01 0.26 0.38 0.50 -0.10 0.00 0.00 175.22 176.25 3ia8 s ARG 132 N -0.79 0.66 -0.28 0.44 3.52 -0.40 -0.73 118.95 121.37 3ia8 s ARG 132 Ca 0.12 0.05 -0.12 0.00 -0.13 0.00 0.00 55.73 55.65 3ia8 s ARG 132 Cb -0.11 0.30 -0.04 0.00 -1.56 0.00 0.00 34.95 33.54 3ia8 s ARG 132 CO 0.01 -0.17 0.24 -1.17 -0.81 0.00 0.00 175.30 173.41 3ia8 s LEU 133 N -0.91 4.05 0.90 -0.88 2.96 -0.50 -0.06 118.68 124.23 3ia8 s LEU 133 Ca -0.10 0.05 -0.11 0.00 -0.22 0.00 0.00 54.13 53.75 3ia8 s LEU 133 Cb -0.04 -2.21 0.19 0.00 0.50 0.00 0.00 46.19 44.63 3ia8 s LEU 133 CO 0.04 -0.10 1.23 0.54 -1.32 0.00 0.00 176.35 176.74 3ia8 s ASN 134 N 1.73 3.40 0.44 3.68 2.20 0.22 -4.92 114.94 121.69 3ia8 s ASN 134 Ca 0.09 0.02 0.30 0.00 -0.94 0.00 0.00 52.86 52.34 3ia8 s ASN 134 Cb -0.16 -0.13 1.33 0.00 -2.00 0.00 0.00 41.25 40.29 3ia8 s ASN 134 CO 0.11 -2.53 1.90 0.77 -2.94 0.00 0.00 177.10 174.41 3ia8 h SER 135 N -1.34 0.00 -0.17 3.54 4.64 -1.98 -1.84 113.55 116.40 3ia8 h SER 135 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 3ia8 h SER 135 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3ia8 h SER 135 CO 0.37 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.71 3ia8 n GLU 136 N -2.71 1.67 -0.97 4.77 1.02 -1.26 -4.92 120.64 118.23 3ia8 n GLU 136 Ca 0.01 -1.01 0.00 0.00 -0.02 0.00 0.00 57.16 56.14 3ia8 n GLU 136 Cb 0.23 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 3ia8 n GLU 136 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ia8 n GLY 137 N 1.09 0.48 3.89 0.62 0.00 -0.69 -5.04 105.19 105.54 3ia8 n GLY 137 Ca 0.15 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 3ia8 n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ia8 s LYS 138 N -0.53 3.58 0.15 1.61 1.02 -1.26 -4.72 119.74 119.59 3ia8 s LYS 138 Ca 0.00 -0.11 -0.21 0.00 0.02 0.00 0.00 55.97 55.67 3ia8 s LYS 138 Cb 0.00 -3.01 -0.08 0.00 -0.52 0.00 0.00 37.83 34.22 3ia8 s LYS 138 CO 0.00 0.59 0.68 -1.17 -0.92 0.00 0.00 175.35 174.53 3ia8 s LEU 139 N -2.08 4.48 -0.04 3.17 2.96 -0.89 -0.61 118.68 125.67 3ia8 s LEU 139 Ca 0.32 1.41 0.05 0.00 -0.22 0.00 0.00 54.13 55.69 3ia8 s LEU 139 Cb -0.13 -3.25 -0.01 0.00 0.50 0.00 0.00 46.19 43.30 3ia8 s LEU 139 CO 0.20 0.17 -0.19 -1.61 -1.32 0.00 0.00 176.35 173.60 3ia8 s GLU 140 N -1.45 1.85 -0.06 1.98 2.02 0.92 -0.07 118.70 123.89 3ia8 s GLU 140 Ca 0.36 -0.68 0.04 0.00 0.02 0.00 0.00 54.97 54.70 3ia8 s GLU 140 Cb -0.19 -1.65 0.00 0.00 0.10 0.00 0.00 34.13 32.39 3ia8 s GLU 140 CO 0.22 0.31 -0.18 -1.14 0.02 0.00 0.00 175.26 174.49 3ia8 s GLN 141 N -0.13 2.11 -0.10 1.61 0.74 -0.30 -1.27 119.66 122.31 3ia8 s GLN 141 Ca -0.01 -0.64 0.01 0.00 0.05 0.00 0.00 55.36 54.78 3ia8 s GLN 141 Cb -0.11 -1.73 0.02 0.00 1.10 0.00 0.00 33.01 32.29 3ia8 s GLN 141 CO 0.02 0.18 -0.14 0.99 -0.55 0.00 0.00 175.29 175.79 3ia8 s THR 142 N 0.26 1.38 -0.11 -0.34 2.01 -0.01 -1.45 115.64 117.39 3ia8 s THR 142 Ca -0.10 -0.57 0.03 0.00 0.31 0.00 0.00 61.69 61.36 3ia8 s THR 142 Cb -0.14 -1.28 0.00 0.00 0.01 0.00 0.00 72.50 71.09 3ia8 s THR 142 CO 0.04 0.42 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.47 3ia8 s VAL 143 N 1.06 2.13 0.37 3.82 1.01 -0.32 -0.75 120.40 127.71 3ia8 s VAL 143 Ca -0.06 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 60.94 3ia8 s VAL 143 Cb -0.15 -1.83 0.00 0.00 0.00 0.00 0.00 36.38 34.41 3ia8 s VAL 143 CO -0.02 0.55 0.02 -1.20 0.00 0.00 0.00 175.10 174.45 3ia8 n SER 144 N 3.68 2.97 -3.94 3.32 7.64 -0.31 -0.30 113.62 126.68 3ia8 n SER 144 Ca -0.19 -2.58 -0.16 0.00 1.01 0.00 0.00 58.87 56.95 3ia8 n SER 144 Cb 0.53 0.24 -0.15 0.00 -1.01 0.00 0.00 64.21 63.82 3ia8 n SER 144 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ia8 s ALA 146 N -2.62 0.42 0.27 -0.43 0.00 -0.07 -1.18 121.76 118.15 3ia8 s ALA 146 Ca 0.01 -0.18 0.03 0.00 0.00 0.00 0.00 51.96 51.82 3ia8 s ALA 146 Cb -0.00 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.02 3ia8 s ALA 146 CO 0.01 0.09 0.25 0.25 0.00 0.00 0.00 175.76 176.36 3ia8 n THR 147 N 3.08 0.00 -0.23 0.00 -2.24 0.11 -0.35 114.28 114.65 3ia8 n THR 147 Ca -0.14 -1.04 0.20 0.00 -2.27 0.00 0.00 64.05 60.79 3ia8 n THR 147 Cb 0.57 -0.40 0.53 0.00 -2.10 0.00 0.00 70.33 68.93 3ia8 n THR 147 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3ia8 h THR 148 N 0.44 0.68 0.00 4.28 2.02 -1.87 -3.21 112.91 115.24 3ia8 h THR 148 Ca -0.16 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 66.89 3ia8 h THR 148 Cb 0.62 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 3ia8 h THR 148 CO 0.25 0.07 -1.01 0.35 0.37 0.00 0.00 175.52 175.55 3ia8 n THR 149 N -4.49 0.00 -4.29 3.16 -2.24 -1.26 -4.99 114.28 100.17 3ia8 n THR 149 Ca 0.19 -0.13 -0.34 0.00 -2.27 0.00 0.00 64.05 61.50 3ia8 n THR 149 Cb 0.70 0.51 -0.14 0.00 -2.10 0.00 0.00 70.33 69.30 3ia8 n THR 149 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3ia8 s GLN 150 N -2.10 3.41 0.05 -0.78 -1.52 -1.21 -5.21 119.66 112.28 3ia8 s GLN 150 Ca -0.01 -0.64 -0.23 0.00 -1.95 0.00 0.00 55.36 52.53 3ia8 s GLN 150 Cb 0.02 -2.84 -0.15 0.00 -0.22 0.00 0.00 33.01 29.82 3ia8 s GLN 150 CO 0.14 0.01 1.50 -1.35 -0.25 0.00 0.00 175.29 175.34 3ia8 h PRO 151 N 7.41 0.12 0.00 2.91 0.11 -1.94 0.33 132.00 140.94 3ia8 h PRO 151 Ca -0.35 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3ia8 h PRO 151 Cb 1.18 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3ia8 h PRO 151 CO 0.59 0.35 0.00 -2.37 -0.21 0.00 0.00 178.00 176.37 3ia8 n THR 153 N -4.88 0.00 -1.81 -1.15 5.66 -1.26 -4.64 114.28 106.20 3ia8 n THR 153 Ca -0.06 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.53 3ia8 n THR 153 Cb 0.17 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.95 3ia8 n THR 153 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 3ia8 s GLN 154 N -2.69 3.99 -0.03 1.09 0.74 -1.26 -4.46 119.66 117.04 3ia8 s GLN 154 Ca 0.00 2.52 0.00 0.00 0.05 0.00 0.00 55.36 57.93 3ia8 s GLN 154 Cb 0.00 -2.88 -0.02 0.00 1.10 0.00 0.00 33.01 31.21 3ia8 s GLN 154 CO 0.00 -0.61 -0.03 1.58 -0.55 0.00 0.00 175.29 175.69 3ia8 n HIS 155 N 0.28 0.00 -4.24 1.67 -0.00 0.59 -4.39 115.22 109.13 3ia8 n HIS 155 Ca 0.02 0.00 -0.17 0.00 -0.00 0.00 0.00 57.72 57.57 3ia8 n HIS 155 Cb 0.40 -0.11 -0.14 0.00 -0.00 0.00 0.00 29.99 30.15 3ia8 n HIS 155 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 3ia8 s LEU 156 N -5.21 2.10 -0.07 0.27 1.43 -0.70 -0.60 118.68 115.89 3ia8 s LEU 156 Ca -0.04 -0.28 -0.03 0.00 -1.03 0.00 0.00 54.13 52.75 3ia8 s LEU 156 Cb 0.01 -0.36 0.04 0.00 0.03 0.00 0.00 46.19 45.91 3ia8 s LEU 156 CO 0.06 0.01 0.17 -2.28 0.23 0.00 0.00 176.35 174.54 3ia8 s HIS 157 N -0.56 -0.20 -0.07 0.29 2.46 -0.67 -1.18 115.29 115.37 3ia8 s HIS 157 Ca -0.00 0.55 -0.13 0.00 0.47 0.00 0.00 55.06 55.95 3ia8 s HIS 157 Cb -0.05 -0.06 0.03 0.00 -0.13 0.00 0.00 32.58 32.36 3ia8 s HIS 157 CO 0.00 -0.18 0.32 0.54 -2.47 0.00 0.00 174.74 172.94 3ia8 s VAL 158 N 1.23 0.03 0.03 0.89 0.11 -0.53 -0.90 120.40 121.26 3ia8 s VAL 158 Ca -0.09 -0.25 0.07 0.00 -2.93 0.00 0.00 61.98 58.78 3ia8 s VAL 158 Cb -0.11 -0.54 -0.03 0.00 -1.53 0.00 0.00 36.38 34.17 3ia8 s VAL 158 CO -0.06 -0.14 -0.18 0.42 -3.33 0.00 0.00 175.10 171.81 3ia8 s THR 159 N -0.61 2.78 0.04 5.04 -4.23 -1.26 -1.15 115.64 116.26 3ia8 s THR 159 Ca -0.07 -1.13 0.07 0.00 -1.18 0.00 0.00 61.69 59.38 3ia8 s THR 159 Cb -0.04 -2.15 -0.02 0.00 1.34 0.00 0.00 72.50 71.62 3ia8 s THR 159 CO 0.02 0.38 -0.20 -0.31 -0.54 0.00 0.00 174.62 173.97 3ia8 s TYR 160 N -0.89 1.76 0.10 3.99 2.02 0.91 -1.37 117.35 123.87 3ia8 s TYR 160 Ca 0.14 -0.37 -0.13 0.00 -0.37 0.00 0.00 57.07 56.34 3ia8 s TYR 160 Cb -0.10 -1.06 -0.06 0.00 -0.40 0.00 0.00 41.96 40.34 3ia8 s TYR 160 CO 0.04 0.08 0.48 -1.59 -1.57 0.00 0.00 175.55 172.99 3ia8 s LYS 161 N -1.12 3.90 0.04 -0.62 -2.85 0.55 -2.10 119.74 117.53 3ia8 s LYS 161 Ca 0.07 0.37 -0.30 0.00 -1.00 0.00 0.00 55.97 55.10 3ia8 s LYS 161 Cb -0.09 -3.00 -0.05 0.00 -2.06 0.00 0.00 37.83 32.63 3ia8 s LYS 161 CO 0.02 0.54 1.15 0.21 0.10 0.00 0.00 175.35 177.37 3ia8 s LYS 162 N -1.81 4.45 -0.01 1.78 2.20 -1.26 -0.93 119.74 124.16 3ia8 s LYS 162 Ca 0.34 1.69 0.03 0.00 -0.36 0.00 0.00 55.97 57.66 3ia8 s LYS 162 Cb -0.15 -3.39 -0.04 0.00 -1.51 0.00 0.00 37.83 32.73 3ia8 s LYS 162 CO 0.18 -0.24 0.05 1.33 -0.36 0.00 0.00 175.35 176.32 3ia8 n VAL 163 N 4.00 0.03 -1.88 4.02 0.24 0.55 -4.95 118.33 120.34 3ia8 n VAL 163 Ca 0.09 -0.07 0.00 0.00 -2.04 0.00 0.00 64.34 62.31 3ia8 n VAL 163 Cb 0.47 0.23 0.00 0.00 -1.47 0.00 0.00 33.84 33.07 3ia8 n VAL 163 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10