#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oy1 s LYS 5 N 0.00 0.07 -0.27 -0.78 1.02 -1.26 -5.14 119.74 113.37 1oy1 s LYS 5 Ca 0.00 0.23 -0.21 0.00 0.02 0.00 0.00 55.97 56.01 1oy1 s LYS 5 Cb 0.00 -0.45 -0.01 0.00 -0.52 0.00 0.00 37.83 36.85 1oy1 s LYS 5 CO 0.00 -0.23 0.69 0.15 -0.92 0.00 0.00 175.35 175.03 1oy1 s LYS 6 N 1.54 4.04 -0.30 1.68 1.02 -1.26 -0.36 119.74 126.11 1oy1 s LYS 6 Ca -0.03 0.55 -0.07 0.00 0.02 0.00 0.00 55.97 56.44 1oy1 s LYS 6 Cb -0.13 -3.68 0.01 0.00 -0.52 0.00 0.00 37.83 33.51 1oy1 s LYS 6 CO -0.03 -0.52 0.09 0.42 -0.92 0.00 0.00 175.35 174.39 1oy1 s ILE 7 N 2.66 4.06 0.20 2.17 -1.09 0.65 0.18 121.20 130.03 1oy1 s ILE 7 Ca 0.28 -0.64 -0.30 0.00 -2.23 0.00 0.00 60.65 57.76 1oy1 s ILE 7 Cb -0.15 -3.08 -0.08 0.00 -1.58 0.00 0.00 42.46 37.56 1oy1 s ILE 7 CO 0.10 0.08 1.14 -0.83 -1.23 0.00 0.00 174.94 174.20 1oy1 s GLY 8 N 1.52 2.83 -0.14 6.18 0.00 -0.29 -1.23 107.32 116.19 1oy1 s GLY 8 Ca 0.03 0.89 -0.00 0.00 0.00 0.00 0.00 44.72 45.64 1oy1 s GLY 8 CO 0.03 1.70 -0.09 0.14 0.00 0.00 0.00 173.10 174.88 1oy1 s VAL 9 N -0.38 1.22 -0.31 1.40 1.01 -0.64 -0.02 120.40 122.67 1oy1 s VAL 9 Ca 0.50 -0.52 -0.13 0.00 0.00 0.00 0.00 61.98 61.83 1oy1 s VAL 9 Cb -0.31 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 1oy1 s VAL 9 CO 0.37 0.31 0.27 -0.63 0.00 0.00 0.00 175.10 175.42 1oy1 s ILE 10 N 1.61 5.25 0.19 2.22 -1.09 -0.53 -1.16 121.20 127.69 1oy1 s ILE 10 Ca 0.03 0.05 0.04 0.00 -2.23 0.00 0.00 60.65 58.55 1oy1 s ILE 10 Cb -0.14 -3.68 -0.04 0.00 -1.58 0.00 0.00 42.46 37.03 1oy1 s ILE 10 CO -0.09 0.07 0.24 -0.76 -1.23 0.00 0.00 174.94 173.17 1oy1 s LEU 11 N 1.84 4.08 -0.06 2.97 1.43 0.62 -4.07 118.68 125.49 1oy1 s LEU 11 Ca 0.09 -0.01 0.10 0.00 -1.03 0.00 0.00 54.13 53.27 1oy1 s LEU 11 Cb -0.17 -2.66 0.16 0.00 0.03 0.00 0.00 46.19 43.56 1oy1 s LEU 11 CO 0.11 0.02 1.08 -1.54 0.23 0.00 0.00 176.35 176.25 1oy1 n SER 12 N -0.74 1.07 0.00 2.29 3.41 -1.26 -4.24 113.62 114.16 1oy1 n SER 12 Ca -0.08 -2.52 0.00 0.00 -0.26 0.00 0.00 58.87 56.01 1oy1 n SER 12 Cb 0.55 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 1oy1 n SER 12 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oy1 n GLY 13 N -0.59 0.96 2.56 5.00 0.00 -1.26 -4.03 105.19 107.82 1oy1 n GLY 13 Ca 0.08 -1.92 -0.27 0.00 0.00 0.00 0.00 46.02 43.90 1oy1 n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oy1 n GLY 15 N 2.19 4.70 0.16 0.00 0.00 0.59 -4.80 105.19 108.02 1oy1 n GLY 15 Ca 0.25 -0.78 -0.04 0.00 0.00 0.00 0.00 46.02 45.46 1oy1 n GLY 15 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1oy1 n VAL 16 N -1.73 -0.25 -0.02 1.61 0.31 -1.22 0.68 118.33 117.70 1oy1 n VAL 16 Ca 0.00 1.52 -0.09 0.00 -0.01 0.00 0.00 64.34 65.76 1oy1 n VAL 16 Cb 0.00 -1.94 0.08 0.00 -0.91 0.00 0.00 33.84 31.07 1oy1 n VAL 16 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 1oy1 h TYR 17 N 0.00 0.74 0.16 3.52 0.99 -1.95 0.34 116.97 120.77 1oy1 h TYR 17 Ca 0.06 -0.23 -0.33 0.00 2.00 0.00 0.00 58.73 60.23 1oy1 h TYR 17 Cb 0.15 -0.15 0.00 0.00 1.00 0.00 0.00 36.73 37.73 1oy1 h TYR 17 CO -0.77 0.94 -1.65 -0.44 -0.00 0.00 0.00 178.16 176.24 1oy1 h ASP 18 N 0.50 0.52 0.00 3.88 3.32 -1.78 -3.40 116.42 119.47 1oy1 h ASP 18 Ca 0.03 -0.76 0.00 0.00 0.02 0.00 0.00 57.03 56.33 1oy1 h ASP 18 Cb 0.96 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1oy1 h ASP 18 CO 0.09 1.63 0.00 0.61 -1.72 0.00 0.00 179.24 179.85 1oy1 n GLY 19 N 1.77 2.89 3.75 2.75 0.00 0.21 -4.36 105.19 112.20 1oy1 n GLY 19 Ca -0.21 0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 1oy1 n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oy1 s SER 20 N 1.89 7.04 -0.28 1.61 0.01 -1.10 -1.66 113.70 121.21 1oy1 s SER 20 Ca 0.00 2.39 -0.28 0.00 1.31 0.00 0.00 55.95 59.37 1oy1 s SER 20 Cb 0.00 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 1oy1 s SER 20 CO 0.00 -0.35 1.88 -0.70 0.41 0.00 0.00 173.24 174.47 1oy1 s GLU 21 N -1.08 3.37 0.27 12.44 2.56 -0.79 -0.30 118.70 135.17 1oy1 s GLU 21 Ca 0.49 1.63 0.00 0.00 0.00 0.00 0.00 54.97 57.09 1oy1 s GLU 21 Cb -0.35 -4.22 0.54 0.00 2.00 0.00 0.00 34.13 32.11 1oy1 s GLU 21 CO 0.43 -1.82 1.81 0.82 -0.56 0.00 0.00 175.26 175.94 1oy1 h ILE 22 N 6.78 0.85 0.11 -3.70 2.04 -1.92 0.93 117.51 122.60 1oy1 h ILE 22 Ca -0.36 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.20 1oy1 h ILE 22 Cb 1.18 -0.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 1oy1 h ILE 22 CO 1.01 0.16 -0.05 0.45 0.00 0.00 0.00 178.15 179.71 1oy1 h HIS 23 N 0.86 -0.13 -0.72 1.37 3.86 -1.99 -1.47 115.15 116.92 1oy1 h HIS 23 Ca 0.48 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.77 1oy1 h HIS 23 Cb 0.55 0.04 -0.06 0.00 1.06 0.00 0.00 27.41 29.00 1oy1 h HIS 23 CO -0.03 0.14 0.39 0.93 0.86 0.00 0.00 177.93 180.22 1oy1 h GLU 24 N -0.40 0.67 0.32 2.45 5.08 -1.81 0.31 114.58 121.21 1oy1 h GLU 24 Ca -0.01 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1oy1 h GLU 24 Cb 0.33 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1oy1 h GLU 24 CO 0.02 0.44 -0.16 0.00 -1.00 0.00 0.00 179.01 178.32 1oy1 h ALA 25 N 1.40 -0.44 -0.75 3.43 0.00 -0.76 -0.15 119.26 121.99 1oy1 h ALA 25 Ca 0.34 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1oy1 h ALA 25 Cb 0.28 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1oy1 h ALA 25 CO -0.22 -0.65 0.45 0.28 0.00 0.00 0.00 179.25 179.10 1oy1 h VAL 26 N -0.62 1.21 -0.47 0.00 2.07 -0.98 -0.35 116.25 117.12 1oy1 h VAL 26 Ca -0.04 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 66.96 1oy1 h VAL 26 Cb 0.45 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1oy1 h VAL 26 CO 0.07 0.23 0.15 -0.07 0.02 0.00 0.00 177.57 177.96 1oy1 h LEU 27 N 1.03 0.63 -0.06 2.57 3.38 -0.31 0.53 115.31 123.08 1oy1 h LEU 27 Ca 0.27 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1oy1 h LEU 27 Cb -0.03 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 1oy1 h LEU 27 CO -0.05 0.60 0.01 0.74 0.09 0.00 0.00 178.44 179.83 1oy1 h THR 28 N 0.68 1.23 -0.96 0.22 2.02 -0.18 -2.20 112.91 113.70 1oy1 h THR 28 Ca 0.16 -0.69 0.03 0.00 0.77 0.00 0.00 66.41 66.68 1oy1 h THR 28 Cb 0.20 1.58 -0.05 0.00 -1.74 0.00 0.00 68.15 68.14 1oy1 h THR 28 CO -0.01 0.19 0.63 -0.07 0.37 0.00 0.00 175.52 176.63 1oy1 h LEU 29 N -0.17 1.05 -0.51 2.58 3.38 -0.58 -0.88 115.31 120.18 1oy1 h LEU 29 Ca 0.02 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1oy1 h LEU 29 Cb 0.30 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1oy1 h LEU 29 CO 0.00 0.72 0.20 0.25 0.09 0.00 0.00 178.44 179.70 1oy1 h LEU 30 N 1.22 0.71 -0.46 1.67 5.85 -0.77 -1.32 115.31 122.20 1oy1 h LEU 30 Ca 0.38 -0.17 -0.08 0.00 0.84 0.00 0.00 57.88 58.85 1oy1 h LEU 30 Cb -0.01 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 1oy1 h LEU 30 CO -0.11 0.69 -0.01 0.00 -0.34 0.00 0.00 178.44 178.66 1oy1 h ALA 31 N 1.05 0.62 -0.45 1.25 0.00 -0.89 0.28 119.26 121.12 1oy1 h ALA 31 Ca 0.17 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.83 1oy1 h ALA 31 Cb 0.21 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1oy1 h ALA 31 CO -0.01 0.42 0.22 0.82 0.00 0.00 0.00 179.25 180.70 1oy1 h ILE 32 N 0.66 0.97 -0.30 0.00 1.08 -1.04 -0.18 117.51 118.69 1oy1 h ILE 32 Ca 0.13 -0.15 -0.06 0.00 -0.39 0.00 0.00 64.86 64.39 1oy1 h ILE 32 Cb 0.52 0.48 -0.01 0.00 -3.07 0.00 0.00 36.82 34.74 1oy1 h ILE 32 CO 0.03 0.08 -0.03 -1.28 -0.69 0.00 0.00 178.15 176.26 1oy1 h SER 33 N 0.45 0.55 0.32 1.72 0.87 -0.89 -0.28 113.55 116.29 1oy1 h SER 33 Ca 0.19 -0.33 -0.05 0.00 -1.23 0.00 0.00 61.79 60.37 1oy1 h SER 33 Cb 0.10 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 1oy1 h SER 33 CO -0.14 0.75 -0.25 0.03 -0.53 0.00 0.00 176.83 176.70 1oy1 h ARG 34 N 0.33 0.00 -0.42 2.24 3.08 -0.27 -1.55 114.38 117.79 1oy1 h ARG 34 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1oy1 h ARG 34 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1oy1 h ARG 34 CO 0.02 0.25 0.00 0.43 -1.07 0.00 0.00 179.97 179.60 1oy1 n SER 35 N -4.05 1.45 -0.29 7.04 7.64 -0.10 -4.88 113.62 120.42 1oy1 n SER 35 Ca -0.02 -2.08 -0.04 0.00 1.01 0.00 0.00 58.87 57.74 1oy1 n SER 35 Cb 0.32 -0.27 -0.02 0.00 -1.01 0.00 0.00 64.21 63.23 1oy1 n SER 35 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1oy1 n GLY 36 N 0.60 0.53 3.99 0.23 0.00 -0.58 -5.00 105.19 104.95 1oy1 n GLY 36 Ca 0.07 -0.11 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 1oy1 n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oy1 s ALA 37 N -1.68 3.99 -0.19 4.61 0.00 -0.13 -4.71 121.76 123.65 1oy1 s ALA 37 Ca 0.00 -1.54 -0.01 0.00 0.00 0.00 0.00 51.96 50.41 1oy1 s ALA 37 Cb 0.00 -1.95 -0.00 0.00 0.00 0.00 0.00 23.12 21.17 1oy1 s ALA 37 CO 0.00 -0.89 -0.11 -1.14 0.00 0.00 0.00 175.76 173.62 1oy1 s GLN 38 N -4.80 3.25 0.25 0.00 0.74 0.52 -4.24 119.66 115.37 1oy1 s GLN 38 Ca 0.60 -0.71 -0.27 0.00 0.05 0.00 0.00 55.36 55.03 1oy1 s GLN 38 Cb -0.09 -2.78 -0.09 0.00 1.10 0.00 0.00 33.01 31.15 1oy1 s GLN 38 CO 0.39 -0.11 0.90 0.00 -0.55 0.00 0.00 175.29 175.92 1oy1 s ALA 39 N 1.16 3.33 -0.30 1.58 0.00 -1.26 -0.26 121.76 126.01 1oy1 s ALA 39 Ca 0.01 0.51 -0.02 0.00 0.00 0.00 0.00 51.96 52.47 1oy1 s ALA 39 Cb -0.14 -3.13 0.10 0.00 0.00 0.00 0.00 23.12 19.95 1oy1 s ALA 39 CO -0.04 0.22 0.10 0.08 0.00 0.00 0.00 175.76 176.13 1oy1 s VAL 40 N -1.32 0.64 0.13 0.00 1.01 -0.36 -4.86 120.40 115.64 1oy1 s VAL 40 Ca 0.43 -1.22 -0.20 0.00 0.00 0.00 0.00 61.98 60.99 1oy1 s VAL 40 Cb -0.23 -1.48 -0.07 0.00 0.00 0.00 0.00 36.38 34.60 1oy1 s VAL 40 CO 0.28 -0.67 0.64 0.00 0.00 0.00 0.00 175.10 175.35 1oy1 s PHE 42 N -1.26 0.89 -0.24 0.00 0.40 -0.31 -1.13 117.98 116.33 1oy1 s PHE 42 Ca 0.35 -0.94 -0.22 0.00 -0.60 0.00 0.00 56.93 55.52 1oy1 s PHE 42 Cb -0.19 -0.52 0.06 0.00 0.51 0.00 0.00 43.02 42.88 1oy1 s PHE 42 CO 0.21 -0.17 0.64 0.00 0.70 0.00 0.00 175.22 176.59 1oy1 s ALA 43 N -3.65 -1.58 0.22 5.36 0.00 -0.76 -0.28 121.76 121.07 1oy1 s ALA 43 Ca 0.13 1.80 -0.31 0.00 0.00 0.00 0.00 51.96 53.58 1oy1 s ALA 43 Cb 0.06 -1.04 -0.10 0.00 0.00 0.00 0.00 23.12 22.03 1oy1 s ALA 43 CO -0.04 -0.30 1.50 -1.25 0.00 0.00 0.00 175.76 175.66 1oy1 s PRO 44 N 0.33 4.24 -1.30 0.00 0.04 -1.26 -0.73 135.00 136.31 1oy1 s PRO 44 Ca -0.00 2.34 -0.17 0.00 0.04 0.00 0.00 61.00 63.21 1oy1 s PRO 44 Cb -0.04 -3.12 0.08 0.00 0.04 0.00 0.00 34.50 31.46 1oy1 s PRO 44 CO 0.01 -0.50 1.75 -3.47 0.04 0.00 0.00 177.00 174.83 1oy1 n ASP 45 N 2.92 4.87 -3.76 6.66 -0.08 -1.26 -3.05 116.55 122.85 1oy1 n ASP 45 Ca 0.09 -2.92 -0.10 0.00 -1.51 0.00 0.00 54.79 50.35 1oy1 n ASP 45 Cb 0.39 -1.71 -0.05 0.00 2.34 0.00 0.00 41.12 42.10 1oy1 n ASP 45 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 1oy1 s LYS 46 N 3.69 1.27 0.36 -0.67 -2.85 -1.26 -4.98 119.74 115.30 1oy1 s LYS 46 Ca 0.52 -0.89 -0.27 0.00 -1.00 0.00 0.00 55.97 54.32 1oy1 s LYS 46 Cb 0.04 0.48 -0.09 0.00 -2.06 0.00 0.00 37.83 36.20 1oy1 s LYS 46 CO 0.05 -0.52 1.25 -1.14 0.10 0.00 0.00 175.35 175.10 1oy1 s GLN 47 N -3.88 4.23 0.52 1.78 0.74 -1.26 -0.85 119.66 120.94 1oy1 s GLN 47 Ca 0.09 2.08 -0.21 0.00 0.05 0.00 0.00 55.36 57.37 1oy1 s GLN 47 Cb 0.00 -2.93 -0.06 0.00 1.10 0.00 0.00 33.01 31.12 1oy1 s GLN 47 CO -0.04 -0.24 1.17 -0.65 -0.55 0.00 0.00 175.29 174.98 1oy1 s GLN 48 N -1.96 3.46 0.23 1.67 -0.21 -0.38 -4.76 119.66 117.70 1oy1 s GLN 48 Ca 0.52 1.75 -0.08 0.00 0.02 0.00 0.00 55.36 57.57 1oy1 s GLN 48 Cb -0.37 -2.18 0.24 0.00 1.00 0.00 0.00 33.01 31.71 1oy1 s GLN 48 CO 0.48 -0.80 1.88 0.28 -2.12 0.00 0.00 175.29 175.01 1oy1 h VAL 49 N 1.45 1.15 -3.77 1.09 2.07 -1.89 -3.46 116.25 112.89 1oy1 h VAL 49 Ca -0.50 -0.37 -0.17 0.00 0.82 0.00 0.00 66.70 66.49 1oy1 h VAL 49 Cb 1.26 -0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.95 1oy1 h VAL 49 CO 0.58 0.20 -0.07 1.51 0.02 0.00 0.00 177.57 179.80 1oy1 s ASP 50 N -5.89 0.48 -0.16 0.57 1.47 -1.26 -5.14 116.67 106.74 1oy1 s ASP 50 Ca -0.13 -1.28 -0.02 0.00 1.18 0.00 0.00 52.55 52.30 1oy1 s ASP 50 Cb 0.17 0.69 0.05 0.00 -0.34 0.00 0.00 42.92 43.48 1oy1 s ASP 50 CO 0.79 -1.34 0.01 -0.69 0.68 0.00 0.00 175.17 174.62 1oy1 s VAL 51 N -3.13 0.62 -0.12 2.11 1.01 -1.26 -4.88 120.40 114.75 1oy1 s VAL 51 Ca 0.25 -0.45 -0.05 0.00 0.00 0.00 0.00 61.98 61.74 1oy1 s VAL 51 Cb -0.01 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 1oy1 s VAL 51 CO 0.16 -0.05 0.06 -0.63 0.00 0.00 0.00 175.10 174.64 1oy1 s ILE 52 N 1.83 4.83 -0.48 2.22 -1.09 -1.26 -4.48 121.20 122.77 1oy1 s ILE 52 Ca 0.00 -0.04 -0.29 0.00 -2.23 0.00 0.00 60.65 58.09 1oy1 s ILE 52 Cb -0.16 -3.09 0.02 0.00 -1.58 0.00 0.00 42.46 37.66 1oy1 s ILE 52 CO -0.07 0.58 1.22 0.21 -1.23 0.00 0.00 174.94 175.65 1oy1 s ASN 53 N -0.69 6.52 0.00 3.58 3.84 0.07 -4.84 114.94 123.42 1oy1 s ASN 53 Ca 0.12 0.51 0.14 0.00 0.21 0.00 0.00 52.86 53.84 1oy1 s ASN 53 Cb -0.12 -2.55 0.64 0.00 -0.55 0.00 0.00 41.25 38.68 1oy1 s ASN 53 CO 0.02 -1.34 1.41 1.41 -2.79 0.00 0.00 177.10 175.81 1oy1 n HIS 54 N 8.21 0.00 0.00 0.43 8.25 -1.26 0.95 115.22 131.80 1oy1 n HIS 54 Ca 0.13 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.38 1oy1 n HIS 54 Cb 0.49 -0.40 -0.14 0.00 1.12 0.00 0.00 29.99 31.06 1oy1 n HIS 54 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1oy1 n LEU 55 N -1.40 2.57 -0.10 2.41 7.94 -1.26 -4.62 117.00 122.54 1oy1 n LEU 55 Ca 0.05 0.21 -0.18 0.00 -1.11 0.00 0.00 56.01 54.97 1oy1 n LEU 55 Cb 0.14 -1.06 -0.08 0.00 0.53 0.00 0.00 43.42 42.95 1oy1 n LEU 55 CO 0.12 0.84 -0.70 0.41 -1.11 0.00 0.00 177.39 176.95 1oy1 n THR 56 N -3.46 1.50 0.00 1.96 -1.04 -1.00 -5.01 114.28 107.24 1oy1 n THR 56 Ca -0.32 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.67 1oy1 n THR 56 Cb 1.05 -2.12 0.00 0.00 -1.82 0.00 0.00 70.33 67.43 1oy1 n THR 56 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1oy1 n GLY 57 N 1.44 1.53 3.83 3.41 0.00 0.27 -5.05 105.19 110.62 1oy1 n GLY 57 Ca -0.29 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.40 1oy1 n GLY 57 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1oy1 s GLU 58 N -0.26 4.17 0.00 1.61 -1.05 -1.25 -4.70 118.70 117.22 1oy1 s GLU 58 Ca 0.00 0.99 0.00 0.00 -0.15 0.00 0.00 54.97 55.81 1oy1 s GLU 58 Cb 0.00 -2.25 0.00 0.00 -0.44 0.00 0.00 34.13 31.44 1oy1 s GLU 58 CO 0.00 0.02 0.00 0.00 0.95 0.00 0.00 175.26 176.23 1oy1 n ALA 59 N -0.56 0.00 -3.29 -0.84 0.00 -1.26 -0.75 120.51 113.82 1oy1 n ALA 59 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.25 1oy1 n ALA 59 Cb 0.54 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.91 1oy1 n ALA 59 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1oy1 n THR 61 N -0.34 0.48 -3.79 0.00 -2.24 -1.26 -4.81 114.28 102.32 1oy1 n THR 61 Ca 0.00 -4.47 -0.09 0.00 -2.27 0.00 0.00 64.05 57.23 1oy1 n THR 61 Cb 0.00 -2.01 -0.03 0.00 -2.10 0.00 0.00 70.33 66.19 1oy1 n THR 61 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1oy1 s GLU 62 N -1.65 1.60 0.15 -0.78 -1.05 -1.26 -5.18 118.70 110.53 1oy1 s GLU 62 Ca 0.37 -0.92 0.09 0.00 -0.15 0.00 0.00 54.97 54.36 1oy1 s GLU 62 Cb 0.16 0.57 -0.04 0.00 -0.44 0.00 0.00 34.13 34.38 1oy1 s GLU 62 CO -0.08 -0.71 -0.16 0.99 0.95 0.00 0.00 175.26 176.25 1oy1 s THR 63 N -3.90 2.88 -0.09 1.83 2.01 -1.26 -4.58 115.64 112.53 1oy1 s THR 63 Ca 0.11 -1.64 -0.12 0.00 0.31 0.00 0.00 61.69 60.35 1oy1 s THR 63 Cb -0.04 -2.37 0.03 0.00 0.01 0.00 0.00 72.50 70.14 1oy1 s THR 63 CO 0.02 -0.00 0.31 -0.13 -0.69 0.00 0.00 174.62 174.13 1oy1 s ARG 64 N -2.46 0.44 -0.13 4.92 0.52 -1.26 -5.08 118.95 115.90 1oy1 s ARG 64 Ca 0.21 0.28 -0.18 0.00 -0.52 0.00 0.00 55.73 55.53 1oy1 s ARG 64 Cb -0.10 0.21 -0.04 0.00 0.52 0.00 0.00 34.95 35.54 1oy1 s ARG 64 CO 0.12 -0.08 0.45 1.21 0.02 0.00 0.00 175.30 177.02 1oy1 s ASN 65 N -0.20 6.63 0.16 0.23 3.84 -1.26 -1.25 114.94 123.09 1oy1 s ASN 65 Ca -0.03 0.75 -0.23 0.00 0.21 0.00 0.00 52.86 53.56 1oy1 s ASN 65 Cb -0.03 -2.27 0.04 0.00 -0.55 0.00 0.00 41.25 38.44 1oy1 s ASN 65 CO 0.01 -0.01 1.61 0.58 -2.79 0.00 0.00 177.10 176.51 1oy1 h VAL 66 N 4.77 0.31 0.02 -5.21 2.07 -1.23 -0.48 116.25 116.51 1oy1 h VAL 66 Ca -0.40 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.12 1oy1 h VAL 66 Cb 1.17 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1oy1 h VAL 66 CO 0.75 0.00 -0.01 0.25 0.02 0.00 0.00 177.57 178.58 1oy1 h LEU 67 N -0.26 -0.03 -0.41 2.57 5.85 -1.74 0.83 115.31 122.13 1oy1 h LEU 67 Ca 0.15 -0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.93 1oy1 h LEU 67 Cb 0.50 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.46 1oy1 h LEU 67 CO -0.45 0.01 -0.13 0.40 -0.34 0.00 0.00 178.44 177.92 1oy1 h ILE 68 N -0.06 0.53 -0.26 4.05 1.08 -1.80 -1.57 117.51 119.49 1oy1 h ILE 68 Ca -0.00 0.00 -0.12 0.00 -0.39 0.00 0.00 64.86 64.35 1oy1 h ILE 68 Cb 0.05 0.53 -0.00 0.00 -3.07 0.00 0.00 36.82 34.33 1oy1 h ILE 68 CO 0.01 0.00 -0.30 -0.33 -0.69 0.00 0.00 178.15 176.84 1oy1 h GLU 69 N -0.04 0.67 -0.25 2.37 4.39 -0.93 -2.87 114.58 117.91 1oy1 h GLU 69 Ca 0.20 -0.36 0.07 0.00 0.34 0.00 0.00 59.36 59.61 1oy1 h GLU 69 Cb 0.34 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 1oy1 h GLU 69 CO -0.44 0.98 0.19 0.00 -1.16 0.00 0.00 179.01 178.58 1oy1 h ALA 70 N 0.68 2.14 -0.01 3.43 0.00 -0.43 0.27 119.26 125.35 1oy1 h ALA 70 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1oy1 h ALA 70 Cb 0.87 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1oy1 h ALA 70 CO 0.07 -0.32 0.02 0.00 0.00 0.00 0.00 179.25 179.02 1oy1 h ALA 71 N 1.85 1.27 -0.42 0.00 0.00 -1.06 -1.59 119.26 119.31 1oy1 h ALA 71 Ca 0.12 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 1oy1 h ALA 71 Cb 0.51 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1oy1 h ALA 71 CO -0.00 -0.03 -0.24 0.00 0.00 0.00 0.00 179.25 178.98 1oy1 h ARG 72 N 0.00 0.86 0.00 0.00 3.08 -1.05 0.10 114.38 117.37 1oy1 h ARG 72 Ca 0.00 -0.36 -0.08 0.00 0.07 0.00 0.00 59.98 59.62 1oy1 h ARG 72 Cb 0.05 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1oy1 h ARG 72 CO -0.00 1.00 -0.36 0.82 -1.07 0.00 0.00 179.97 180.36 1oy1 h ILE 73 N 0.74 1.20 -0.58 2.04 2.04 -1.42 -3.11 117.51 118.42 1oy1 h ILE 73 Ca 0.10 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.70 1oy1 h ILE 73 Cb 0.78 1.69 0.00 0.00 -0.74 0.00 0.00 36.82 38.55 1oy1 h ILE 73 CO 0.06 0.35 0.00 0.35 0.00 0.00 0.00 178.15 178.92 1oy1 n THR 74 N -4.02 1.12 -3.34 -0.27 -2.24 -1.06 -4.95 114.28 99.52 1oy1 n THR 74 Ca -0.02 -1.04 -0.24 0.00 -2.27 0.00 0.00 64.05 60.48 1oy1 n THR 74 Cb 0.41 0.44 0.04 0.00 -2.10 0.00 0.00 70.33 69.12 1oy1 n THR 74 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1oy1 n ARG 75 N 1.15 -5.55 0.00 -0.78 1.74 -0.68 -1.33 116.66 111.21 1oy1 n ARG 75 Ca 0.20 0.79 0.00 0.00 -0.77 0.00 0.00 57.85 58.07 1oy1 n ARG 75 Cb 0.59 -5.68 0.00 0.00 -1.02 0.00 0.00 32.46 26.35 1oy1 n ARG 75 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1oy1 n GLY 76 N -1.62 2.93 3.05 -0.13 0.00 0.27 -4.93 105.19 104.75 1oy1 n GLY 76 Ca -0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 1oy1 n GLY 76 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1oy1 n GLU 77 N -2.00 2.41 -3.69 1.61 -0.58 -0.45 -4.84 120.64 113.11 1oy1 n GLU 77 Ca 0.00 -2.48 -0.14 0.00 -0.42 0.00 0.00 57.16 54.12 1oy1 n GLU 77 Cb 0.00 -3.26 -0.07 0.00 -0.57 0.00 0.00 31.44 27.54 1oy1 n GLU 77 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 1oy1 s ILE 78 N 4.57 0.05 0.20 -3.67 2.07 -1.26 -4.41 121.20 118.75 1oy1 s ILE 78 Ca 0.53 -0.39 0.05 0.00 -1.41 0.00 0.00 60.65 59.43 1oy1 s ILE 78 Cb 0.11 -0.80 -0.05 0.00 0.13 0.00 0.00 42.46 41.85 1oy1 s ILE 78 CO 0.02 -0.22 -0.06 -0.13 -1.91 0.00 0.00 174.94 172.64 1oy1 s ARG 79 N -1.69 1.26 0.37 3.50 0.52 -0.28 -5.00 118.95 117.63 1oy1 s ARG 79 Ca -0.10 -1.60 -0.28 0.00 -0.52 0.00 0.00 55.73 53.23 1oy1 s ARG 79 Cb -0.03 -0.75 -0.10 0.00 0.52 0.00 0.00 34.95 34.59 1oy1 s ARG 79 CO 0.03 0.02 1.39 -2.14 0.02 0.00 0.00 175.30 174.62 1oy1 s PRO 80 N -3.78 4.17 0.32 3.54 0.02 -1.26 -1.83 135.00 136.19 1oy1 s PRO 80 Ca 0.24 2.38 0.07 0.00 0.02 0.00 0.00 61.00 63.70 1oy1 s PRO 80 Cb 0.03 -2.97 0.74 0.00 0.02 0.00 0.00 34.50 32.33 1oy1 s PRO 80 CO 0.06 -0.40 1.83 1.25 -0.33 0.00 0.00 177.00 179.40 1oy1 h LEU 81 N 3.08 0.76 -0.85 -5.54 5.85 -1.26 -1.59 115.31 115.76 1oy1 h LEU 81 Ca -0.50 0.06 0.17 0.00 0.84 0.00 0.00 57.88 58.45 1oy1 h LEU 81 Cb 1.24 -0.08 -0.10 0.00 0.37 0.00 0.00 40.66 42.08 1oy1 h LEU 81 CO 0.64 0.34 0.41 0.00 -0.34 0.00 0.00 178.44 179.49 1oy1 h ALA 82 N 1.60 1.30 0.00 1.25 0.00 -1.90 -0.31 119.26 121.19 1oy1 h ALA 82 Ca 0.51 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.53 1oy1 h ALA 82 Cb 0.76 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1oy1 h ALA 82 CO -0.28 -0.18 0.00 1.04 0.00 0.00 0.00 179.25 179.84 1oy1 n GLN 83 N -4.94 0.48 -2.49 0.00 6.02 -0.60 -4.77 117.38 111.09 1oy1 n GLN 83 Ca 0.18 0.04 -0.43 0.00 -0.01 0.00 0.00 57.00 56.78 1oy1 n GLN 83 Cb 0.49 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.23 1oy1 n GLN 83 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1oy1 s ALA 84 N -2.19 3.66 -0.29 -1.58 0.00 -0.13 -5.00 121.76 116.23 1oy1 s ALA 84 Ca 0.25 0.39 -0.06 0.00 0.00 0.00 0.00 51.96 52.54 1oy1 s ALA 84 Cb 0.13 -3.60 0.02 0.00 0.00 0.00 0.00 23.12 19.67 1oy1 s ALA 84 CO 0.24 -1.13 0.05 0.34 0.00 0.00 0.00 175.76 175.27 1oy1 s ASP 85 N 1.75 4.98 0.31 0.00 2.15 -1.26 -4.99 116.67 119.61 1oy1 s ASP 85 Ca 0.52 -0.78 0.08 0.00 0.43 0.00 0.00 52.55 52.80 1oy1 s ASP 85 Cb -0.20 -1.83 0.85 0.00 -0.30 0.00 0.00 42.92 41.43 1oy1 s ASP 85 CO 0.12 -0.19 1.73 0.00 -0.17 0.00 0.00 175.17 176.67 1oy1 h ALA 86 N 8.18 1.73 -0.00 3.66 0.00 -1.92 0.14 119.26 131.04 1oy1 h ALA 86 Ca -0.31 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1oy1 h ALA 86 Cb 1.12 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1oy1 h ALA 86 CO 0.60 -0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.60 1oy1 h ALA 87 N 1.72 1.81 -0.10 0.00 0.00 -1.95 -2.02 119.26 118.72 1oy1 h ALA 87 Ca 0.63 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.54 1oy1 h ALA 87 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1oy1 h ALA 87 CO -0.47 -0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.17 1oy1 n GLU 88 N -4.26 1.94 -4.68 0.00 1.02 0.47 -4.91 120.64 110.21 1oy1 n GLU 88 Ca -0.03 -1.38 -0.31 0.00 -0.02 0.00 0.00 57.16 55.42 1oy1 n GLU 88 Cb 0.09 -1.46 -0.12 0.00 -0.02 0.00 0.00 31.44 29.92 1oy1 n GLU 88 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1oy1 s LEU 89 N -1.84 2.70 0.10 -4.62 1.43 -0.76 -4.73 118.68 110.95 1oy1 s LEU 89 Ca 0.34 -0.35 0.22 0.00 -1.03 0.00 0.00 54.13 53.32 1oy1 s LEU 89 Cb 0.20 -1.57 -0.09 0.00 0.03 0.00 0.00 46.19 44.76 1oy1 s LEU 89 CO 0.31 0.28 0.87 0.47 0.23 0.00 0.00 176.35 178.51 1oy1 n ASP 90 N 1.69 0.54 -3.19 2.29 9.92 0.13 -4.95 116.55 122.98 1oy1 n ASP 90 Ca -0.16 0.11 -0.06 0.00 -0.53 0.00 0.00 54.79 54.14 1oy1 n ASP 90 Cb 0.52 0.99 0.02 0.00 -0.64 0.00 0.00 41.12 42.01 1oy1 n ASP 90 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1oy1 s ALA 91 N -3.37 -1.14 -0.09 2.24 0.00 -1.19 -4.21 121.76 114.00 1oy1 s ALA 91 Ca -0.02 -0.52 -0.05 0.00 0.00 0.00 0.00 51.96 51.38 1oy1 s ALA 91 Cb 0.12 0.71 0.04 0.00 0.00 0.00 0.00 23.12 24.00 1oy1 s ALA 91 CO 0.83 -1.02 0.21 -1.17 0.00 0.00 0.00 175.76 174.61 1oy1 s LEU 92 N -3.18 0.57 -0.03 0.00 2.96 -0.89 -1.14 118.68 116.98 1oy1 s LEU 92 Ca 0.17 0.44 0.05 0.00 -0.22 0.00 0.00 54.13 54.57 1oy1 s LEU 92 Cb -0.04 0.62 -0.01 0.00 0.50 0.00 0.00 46.19 47.26 1oy1 s LEU 92 CO 0.08 -0.15 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.16 1oy1 s ILE 93 N 1.14 1.35 -0.33 6.68 -1.09 0.97 -0.29 121.20 129.63 1oy1 s ILE 93 Ca -0.09 -0.70 0.02 0.00 -2.23 0.00 0.00 60.65 57.66 1oy1 s ILE 93 Cb -0.10 -1.15 0.10 0.00 -1.58 0.00 0.00 42.46 39.73 1oy1 s ILE 93 CO -0.07 0.39 0.08 -0.69 -1.23 0.00 0.00 174.94 173.41 1oy1 s VAL 94 N -0.13 1.72 1.06 2.92 1.01 0.10 -1.46 120.40 125.62 1oy1 s VAL 94 Ca 0.01 -1.99 -0.12 0.00 0.00 0.00 0.00 61.98 59.87 1oy1 s VAL 94 Cb -0.09 -2.28 0.22 0.00 0.00 0.00 0.00 36.38 34.24 1oy1 s VAL 94 CO 0.01 -0.64 1.07 -2.84 0.00 0.00 0.00 175.10 172.70 1oy1 s PRO 95 N 1.15 -0.09 0.00 2.72 0.02 -1.26 -4.53 135.00 133.01 1oy1 s PRO 95 Ca 0.11 0.98 0.00 0.00 0.02 0.00 0.00 61.00 62.11 1oy1 s PRO 95 Cb -0.19 -1.64 0.00 0.00 0.02 0.00 0.00 34.50 32.70 1oy1 s PRO 95 CO -0.15 -3.21 0.00 0.41 -0.33 0.00 0.00 177.00 173.73 1oy1 n GLY 96 N 0.26 0.93 0.00 0.52 0.00 -1.26 -4.78 105.19 100.86 1oy1 n GLY 96 Ca 0.06 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1oy1 n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oy1 n GLY 97 N 5.00 2.53 0.27 -0.02 0.00 -1.26 -1.89 105.19 109.82 1oy1 n GLY 97 Ca 0.00 -1.77 0.18 0.00 0.00 0.00 0.00 46.02 44.43 1oy1 n GLY 97 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1oy1 h PHE 98 N 0.00 0.00 0.00 1.61 0.05 -0.32 -1.32 116.94 116.96 1oy1 h PHE 98 Ca 0.00 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.77 1oy1 h PHE 98 Cb 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 37.95 1oy1 h PHE 98 CO 0.00 0.00 -0.09 0.78 -0.18 0.00 0.00 178.31 178.82 1oy1 h GLY 99 N 0.54 0.00 2.00 -1.45 0.00 -1.42 0.94 103.07 103.68 1oy1 h GLY 99 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1oy1 h GLY 99 CO 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 176.54 176.44 1oy1 h ALA 100 N 1.91 0.99 -0.06 3.60 0.00 -1.44 0.22 119.26 124.48 1oy1 h ALA 100 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1oy1 h ALA 100 Cb 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1oy1 h ALA 100 CO 0.01 0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.38 1oy1 n ALA 101 N -2.14 2.46 0.00 0.00 0.00 0.19 -3.53 120.51 117.48 1oy1 n ALA 101 Ca 0.01 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1oy1 n ALA 101 Cb 0.41 -0.64 0.00 0.00 0.00 0.00 0.00 19.45 19.21 1oy1 n ALA 101 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1oy1 n LYS 102 N 1.07 0.53 -0.01 0.00 5.02 -0.37 -1.10 118.16 123.31 1oy1 n LYS 102 Ca 0.12 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.47 1oy1 n LYS 102 Cb 0.48 -0.86 -0.10 0.00 -0.02 0.00 0.00 35.03 34.53 1oy1 n LYS 102 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1oy1 n ASN 103 N -2.10 1.95 -0.38 4.39 3.02 0.73 -4.42 115.26 118.45 1oy1 n ASN 103 Ca 0.00 -0.05 0.09 0.00 -0.03 0.00 0.00 54.58 54.58 1oy1 n ASN 103 Cb 0.36 1.55 -0.00 0.00 -0.61 0.00 0.00 39.78 41.08 1oy1 n ASN 103 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1oy1 n LEU 104 N -1.91 1.69 -3.85 3.41 4.77 -0.89 -4.84 117.00 115.37 1oy1 n LEU 104 Ca -0.02 -0.76 0.02 0.00 -0.03 0.00 0.00 56.01 55.22 1oy1 n LEU 104 Cb 0.33 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.42 1oy1 n LEU 104 CO 0.27 0.32 1.10 -0.94 -1.33 0.00 0.00 177.39 176.81 1oy1 s SER 105 N -2.02 -0.01 -0.24 -1.43 1.04 -1.23 -0.33 113.70 109.47 1oy1 s SER 105 Ca 0.14 -0.17 0.10 0.00 0.48 0.00 0.00 55.95 56.51 1oy1 s SER 105 Cb 0.14 0.14 0.45 0.00 0.10 0.00 0.00 66.02 66.84 1oy1 s SER 105 CO 0.44 -0.27 1.20 -0.46 0.98 0.00 0.00 173.24 175.13 1oy1 n ASN 106 N -0.86 3.31 0.19 7.02 6.94 -1.06 -2.15 115.26 128.64 1oy1 n ASN 106 Ca -0.01 -3.63 0.15 0.00 -0.02 0.00 0.00 54.58 51.08 1oy1 n ASN 106 Cb 0.60 -0.42 0.77 0.00 -2.36 0.00 0.00 39.78 38.37 1oy1 n ASN 106 CO 0.00 0.00 0.00 0.15 -1.03 0.00 0.00 177.26 176.38 1oy1 h PHE 107 N 1.69 0.00 0.00 -2.53 3.57 -1.76 0.52 116.94 118.44 1oy1 h PHE 107 Ca 0.17 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.63 1oy1 h PHE 107 Cb 1.33 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.07 1oy1 h PHE 107 CO 0.76 0.00 -0.19 0.00 -2.23 0.00 0.00 178.31 176.66 1oy1 h ALA 108 N 1.84 1.36 0.00 2.41 0.00 -1.41 -2.07 119.26 121.40 1oy1 h ALA 108 Ca 0.09 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1oy1 h ALA 108 Cb 0.42 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1oy1 h ALA 108 CO -0.00 0.23 -1.21 0.43 0.00 0.00 0.00 179.25 178.70 1oy1 n SER 109 N -3.84 1.80 -0.23 0.00 7.64 0.05 -4.69 113.62 114.35 1oy1 n SER 109 Ca -0.02 0.30 0.14 0.00 1.01 0.00 0.00 58.87 60.31 1oy1 n SER 109 Cb 0.29 -0.69 0.62 0.00 -1.01 0.00 0.00 64.21 63.41 1oy1 n SER 109 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1oy1 n LEU 110 N -4.27 0.79 0.00 -3.43 4.32 -0.45 -4.99 117.00 108.97 1oy1 n LEU 110 Ca -0.20 -0.20 0.00 0.00 -0.02 0.00 0.00 56.01 55.59 1oy1 n LEU 110 Cb 0.54 -0.08 0.00 0.00 -1.62 0.00 0.00 43.42 42.26 1oy1 n LEU 110 CO 0.14 0.14 0.00 0.61 -1.22 0.00 0.00 177.39 177.06 1oy1 n GLY 111 N 1.20 2.48 0.33 -0.72 0.00 -0.78 0.69 105.19 108.39 1oy1 n GLY 111 Ca 0.18 0.34 0.22 0.00 0.00 0.00 0.00 46.02 46.76 1oy1 n GLY 111 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1oy1 h SER 112 N 0.00 0.00 -0.62 1.61 0.87 -1.88 -1.13 113.55 112.40 1oy1 h SER 112 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1oy1 h SER 112 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1oy1 h SER 112 CO 0.00 0.00 0.00 -0.62 -0.53 0.00 0.00 176.83 175.68 1oy1 n GLU 113 N -3.13 4.31 -1.34 2.24 -0.58 0.22 -5.00 120.64 117.36 1oy1 n GLU 113 Ca -0.03 -3.04 -0.30 0.00 -0.42 0.00 0.00 57.16 53.38 1oy1 n GLU 113 Cb 0.08 -2.08 0.13 0.00 -0.57 0.00 0.00 31.44 29.00 1oy1 n GLU 113 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1oy1 s THR 115 N -3.03 1.23 0.51 0.00 2.01 -1.26 -4.97 115.64 110.12 1oy1 s THR 115 Ca 0.63 -0.61 -0.06 0.00 0.31 0.00 0.00 61.69 61.96 1oy1 s THR 115 Cb -0.17 -1.06 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 1oy1 s THR 115 CO 0.56 0.36 0.83 -0.69 -0.69 0.00 0.00 174.62 174.98 1oy1 s VAL 116 N 0.05 4.76 0.24 3.82 1.01 -1.26 -2.57 120.40 126.45 1oy1 s VAL 116 Ca -0.03 0.26 -0.31 0.00 0.00 0.00 0.00 61.98 61.91 1oy1 s VAL 116 Cb -0.10 -3.83 -0.11 0.00 0.00 0.00 0.00 36.38 32.34 1oy1 s VAL 116 CO 0.01 -0.85 1.60 -0.62 0.00 0.00 0.00 175.10 175.24 1oy1 s ASP 117 N -4.14 6.46 0.11 3.32 2.15 0.55 -4.87 116.67 120.25 1oy1 s ASP 117 Ca 0.49 2.81 -0.27 0.00 0.43 0.00 0.00 52.55 56.01 1oy1 s ASP 117 Cb -0.10 -2.61 -0.09 0.00 -0.30 0.00 0.00 42.92 39.81 1oy1 s ASP 117 CO 0.46 -0.88 1.46 0.03 -0.17 0.00 0.00 175.17 176.07 1oy1 h ARG 118 N 5.84 -0.32 -0.35 4.34 3.08 -1.95 0.24 114.38 125.27 1oy1 h ARG 118 Ca -0.45 0.02 0.03 0.00 0.07 0.00 0.00 59.98 59.66 1oy1 h ARG 118 Cb 1.21 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 31.30 1oy1 h ARG 118 CO 0.86 -0.21 0.15 0.93 -1.07 0.00 0.00 179.97 180.63 1oy1 h GLU 119 N -0.33 0.30 -0.35 0.04 5.08 -1.98 0.62 114.58 117.96 1oy1 h GLU 119 Ca 0.06 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.44 1oy1 h GLU 119 Cb 0.49 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 1oy1 h GLU 119 CO -0.50 0.20 0.14 1.25 -1.00 0.00 0.00 179.01 179.10 1oy1 h LEU 120 N 0.31 0.18 -0.13 1.33 5.85 -1.84 0.33 115.31 121.34 1oy1 h LEU 120 Ca 0.15 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 1oy1 h LEU 120 Cb 0.10 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1oy1 h LEU 120 CO -0.14 0.14 0.07 0.50 -0.34 0.00 0.00 178.44 178.68 1oy1 h LYS 121 N 0.30 0.17 0.14 1.25 3.64 -0.53 0.21 116.57 121.75 1oy1 h LYS 121 Ca 0.15 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1oy1 h LYS 121 Cb 0.11 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1oy1 h LYS 121 CO -0.14 0.17 -0.23 0.00 -2.27 0.00 0.00 179.45 176.97 1oy1 h ALA 122 N 1.00 -0.41 -0.38 5.00 0.00 -0.44 -0.23 119.26 123.80 1oy1 h ALA 122 Ca 0.05 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.96 1oy1 h ALA 122 Cb 0.04 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1oy1 h ALA 122 CO -0.01 -0.77 0.14 1.25 0.00 0.00 0.00 179.25 179.86 1oy1 h LEU 123 N -0.44 0.15 -0.35 0.00 5.85 -0.16 -0.36 115.31 120.00 1oy1 h LEU 123 Ca 0.02 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.84 1oy1 h LEU 123 Cb 0.46 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.46 1oy1 h LEU 123 CO -0.12 0.12 0.02 0.00 -0.34 0.00 0.00 178.44 178.13 1oy1 h ALA 124 N 1.24 0.33 -0.27 1.25 0.00 -0.24 -2.67 119.26 118.90 1oy1 h ALA 124 Ca 0.17 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1oy1 h ALA 124 Cb 0.15 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1oy1 h ALA 124 CO -0.17 -0.38 0.09 1.96 0.00 0.00 0.00 179.25 180.74 1oy1 h GLN 125 N 0.12 0.41 -0.59 0.00 4.20 -0.62 -1.74 115.11 116.90 1oy1 h GLN 125 Ca 0.17 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1oy1 h GLN 125 Cb 0.22 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1oy1 h GLN 125 CO -0.26 0.48 0.00 0.00 -0.67 0.00 0.00 178.83 178.37 1oy1 n ALA 126 N -2.28 0.90 0.00 3.87 0.00 -0.18 0.03 120.51 122.84 1oy1 n ALA 126 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1oy1 n ALA 126 Cb 0.16 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 18.84 1oy1 n ALA 126 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1oy1 n HIS 128 N 0.55 0.00 0.26 0.00 -0.00 -0.66 -2.18 115.22 113.19 1oy1 n HIS 128 Ca 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.85 1oy1 n HIS 128 Cb 0.00 0.00 0.62 0.00 -0.00 0.00 0.00 29.99 30.61 1oy1 n HIS 128 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.34 176.71 1oy1 h GLN 129 N 0.00 0.00 -0.32 1.57 4.15 -0.66 -0.52 115.11 119.33 1oy1 h GLN 129 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1oy1 h GLN 129 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 1oy1 h GLN 129 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 178.83 176.90 1oy1 n ALA 130 N -1.82 2.41 -1.19 3.38 0.00 -0.93 -4.97 120.51 117.39 1oy1 n ALA 130 Ca -0.00 -1.47 -0.06 0.00 0.00 0.00 0.00 53.44 51.90 1oy1 n ALA 130 Cb 0.11 -0.51 -0.03 0.00 0.00 0.00 0.00 19.45 19.02 1oy1 n ALA 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oy1 n GLY 131 N 0.23 0.84 3.77 0.00 0.00 -0.20 -5.01 105.19 104.81 1oy1 n GLY 131 Ca 0.14 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.35 1oy1 n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oy1 s LYS 132 N -2.18 4.54 0.47 1.61 -0.14 -1.26 -4.99 119.74 117.79 1oy1 s LYS 132 Ca 0.00 1.13 -0.22 0.00 -1.36 0.00 0.00 55.97 55.52 1oy1 s LYS 132 Cb 0.00 -3.29 -0.07 0.00 -1.68 0.00 0.00 37.83 32.79 1oy1 s LYS 132 CO 0.00 0.49 1.15 -2.14 -0.76 0.00 0.00 175.35 174.09 1oy1 s PRO 133 N -0.83 3.73 0.01 -1.68 0.02 -1.26 -4.15 135.00 130.83 1oy1 s PRO 133 Ca 0.37 1.72 0.07 0.00 0.02 0.00 0.00 61.00 63.17 1oy1 s PRO 133 Cb -0.22 -2.35 -0.02 0.00 0.02 0.00 0.00 34.50 31.93 1oy1 s PRO 133 CO 0.25 -0.57 -0.21 -0.51 -0.33 0.00 0.00 177.00 175.64 1oy1 s LEU 134 N -3.13 2.10 -0.10 -5.54 1.43 -0.53 -2.09 118.68 110.81 1oy1 s LEU 134 Ca 0.65 -0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 53.29 1oy1 s LEU 134 Cb -0.27 -1.03 0.03 0.00 0.03 0.00 0.00 46.19 44.95 1oy1 s LEU 134 CO 0.33 0.21 -0.03 -0.83 0.23 0.00 0.00 176.35 176.26 1oy1 s GLY 135 N -0.81 0.67 0.37 -3.19 0.00 0.61 -0.19 107.32 104.78 1oy1 s GLY 135 Ca 0.08 -0.39 0.07 0.00 0.00 0.00 0.00 44.72 44.48 1oy1 s GLY 135 CO 0.00 1.01 -0.00 -1.36 0.00 0.00 0.00 173.10 172.75 1oy1 s PHE 136 N 1.83 2.35 0.00 1.90 0.40 -0.70 0.03 117.98 123.80 1oy1 s PHE 136 Ca 0.04 -0.70 0.00 0.00 -0.60 0.00 0.00 56.93 55.67 1oy1 s PHE 136 Cb -0.13 -1.57 0.00 0.00 0.51 0.00 0.00 43.02 41.83 1oy1 s PHE 136 CO -0.07 0.38 0.00 0.00 0.70 0.00 0.00 175.22 176.23 1oy1 n ILE 139 N 0.00 0.41 -0.32 0.00 0.13 -1.26 -4.24 119.36 114.08 1oy1 n ILE 139 Ca 0.00 -0.28 0.26 0.00 -1.10 0.00 0.00 62.75 61.64 1oy1 n ILE 139 Cb 0.00 -0.23 0.58 0.00 -0.84 0.00 0.00 39.64 39.15 1oy1 n ILE 139 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1oy1 h ALA 140 N 2.51 2.48 -0.08 1.51 0.00 -1.88 -1.34 119.26 122.47 1oy1 h ALA 140 Ca 0.00 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1oy1 h ALA 140 Cb 0.75 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1oy1 h ALA 140 CO 0.00 -0.88 0.16 -1.35 0.00 0.00 0.00 179.25 177.18 1oy1 h PRO 141 N 0.27 0.00 -2.00 0.00 0.11 -1.84 -3.37 132.00 125.18 1oy1 h PRO 141 Ca 0.59 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.70 1oy1 h PRO 141 Cb 1.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.84 1oy1 h PRO 141 CO -0.22 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.57 1oy1 n ALA 142 N -2.18 1.46 0.00 -0.75 0.00 -0.51 -4.22 120.51 114.31 1oy1 n ALA 142 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1oy1 n ALA 142 Cb 0.25 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 17.85 1oy1 n ALA 142 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1oy1 n LEU 144 N 1.88 0.00 0.23 0.00 4.77 -1.26 -4.44 117.00 118.18 1oy1 n LEU 144 Ca 0.00 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.15 1oy1 n LEU 144 Cb 0.00 0.00 0.86 0.00 -2.33 0.00 0.00 43.42 41.95 1oy1 n LEU 144 CO 0.00 0.00 1.15 -0.65 -1.33 0.00 0.00 177.39 176.56 1oy1 h PRO 145 N 0.00 0.00 0.00 3.23 0.11 -1.80 0.08 132.00 133.61 1oy1 h PRO 145 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1oy1 h PRO 145 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1oy1 h PRO 145 CO 0.00 0.00 -1.29 1.63 -0.21 0.00 0.00 178.00 178.13 1oy1 n LYS 146 N -3.68 0.53 0.06 1.05 4.76 -1.26 -4.17 118.16 115.45 1oy1 n LYS 146 Ca 0.01 -0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.27 1oy1 n LYS 146 Cb 0.30 -1.68 -0.14 0.00 -1.84 0.00 0.00 35.03 31.67 1oy1 n LYS 146 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 1oy1 h ILE 147 N 0.00 1.08 -4.43 -0.18 2.04 -1.44 -3.46 117.51 111.12 1oy1 h ILE 147 Ca 0.00 -2.73 -0.69 0.00 1.00 0.00 0.00 64.86 62.44 1oy1 h ILE 147 Cb 0.92 2.73 -0.28 0.00 -0.74 0.00 0.00 36.82 39.45 1oy1 h ILE 147 CO 0.00 0.81 -0.88 -0.36 0.00 0.00 0.00 178.15 177.72 1oy1 s PHE 148 N -2.61 2.27 0.06 1.37 0.40 -0.19 -4.90 117.98 114.39 1oy1 s PHE 148 Ca -0.10 -0.42 0.09 0.00 -0.60 0.00 0.00 56.93 55.89 1oy1 s PHE 148 Cb 0.07 -1.41 -0.22 0.00 0.51 0.00 0.00 43.02 41.97 1oy1 s PHE 148 CO 0.85 0.05 1.04 0.22 0.70 0.00 0.00 175.22 178.07 1oy1 h ASP 149 N 5.13 0.02 -4.07 1.36 3.58 -1.87 -3.41 116.42 117.15 1oy1 h ASP 149 Ca -0.44 -0.03 -0.45 0.00 0.42 0.00 0.00 57.03 56.53 1oy1 h ASP 149 Cb 1.13 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 42.18 1oy1 h ASP 149 CO 0.45 1.02 0.36 0.72 -2.88 0.00 0.00 179.24 178.91 1oy1 s PHE 150 N -2.67 3.18 0.53 0.28 -0.12 -1.26 -5.01 117.98 112.91 1oy1 s PHE 150 Ca -0.01 1.59 -0.22 0.00 -0.05 0.00 0.00 56.93 58.23 1oy1 s PHE 150 Cb 0.09 -2.94 -0.06 0.00 -0.63 0.00 0.00 43.02 39.48 1oy1 s PHE 150 CO 0.82 -0.43 1.29 -2.30 -0.05 0.00 0.00 175.22 174.56 1oy1 n PRO 151 N -0.83 1.65 -4.06 1.99 -0.02 -1.26 -4.98 135.00 127.50 1oy1 n PRO 151 Ca 0.08 0.61 -0.12 0.00 -2.02 0.00 0.00 63.50 62.05 1oy1 n PRO 151 Cb 0.53 -2.49 -0.11 0.00 -0.02 0.00 0.00 33.50 31.42 1oy1 n PRO 151 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1oy1 s LEU 152 N -2.89 2.29 -0.29 2.45 1.43 -1.26 -4.96 118.68 115.45 1oy1 s LEU 152 Ca 0.70 -0.61 -0.16 0.00 -1.03 0.00 0.00 54.13 53.03 1oy1 s LEU 152 Cb -0.44 -0.08 -0.03 0.00 0.03 0.00 0.00 46.19 45.67 1oy1 s LEU 152 CO 0.51 -0.27 0.40 -0.13 0.23 0.00 0.00 176.35 177.09 1oy1 s ARG 153 N -1.91 3.89 0.35 1.70 0.52 -1.26 -0.72 118.95 121.52 1oy1 s ARG 153 Ca -0.08 -0.04 -0.01 0.00 -0.52 0.00 0.00 55.73 55.08 1oy1 s ARG 153 Cb -0.07 -3.70 0.01 0.00 0.52 0.00 0.00 34.95 31.70 1oy1 s ARG 153 CO -0.01 -0.37 0.47 1.47 0.02 0.00 0.00 175.30 176.88 1oy1 n LEU 154 N 5.41 0.00 -3.96 2.53 -0.00 -0.97 -4.18 117.00 115.82 1oy1 n LEU 154 Ca -0.08 -2.84 -0.09 0.00 -0.00 0.00 0.00 56.01 53.01 1oy1 n LEU 154 Cb 0.50 2.48 -0.08 0.00 -0.00 0.00 0.00 43.42 46.32 1oy1 n LEU 154 CO 0.39 -0.64 -0.16 -0.89 -0.00 0.00 0.00 177.39 176.09 1oy1 s THR 155 N -2.83 0.14 0.00 1.47 2.01 -1.26 -0.86 115.64 114.30 1oy1 s THR 155 Ca 0.29 -1.45 0.00 0.00 0.31 0.00 0.00 61.69 60.85 1oy1 s THR 155 Cb -0.01 -1.58 0.00 0.00 0.01 0.00 0.00 72.50 70.92 1oy1 s THR 155 CO 0.21 -0.61 0.72 2.30 -0.69 0.00 0.00 174.62 176.55 1oy1 n ILE 156 N -0.07 0.00 0.00 1.82 -6.64 -1.26 -4.71 119.36 108.50 1oy1 n ILE 156 Ca -0.12 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.86 1oy1 n ILE 156 Cb 0.62 0.56 0.00 0.00 -1.44 0.00 0.00 39.64 39.38 1oy1 n ILE 156 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1oy1 n GLY 157 N 0.00 0.67 0.00 3.28 0.00 -1.26 -4.52 105.19 103.36 1oy1 n GLY 157 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.86 1oy1 n GLY 157 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1oy1 n THR 158 N 0.00 0.00 -1.51 2.61 -2.24 -1.26 -1.25 114.28 110.63 1oy1 n THR 158 Ca 0.00 -0.18 -0.42 0.00 -2.27 0.00 0.00 64.05 61.18 1oy1 n THR 158 Cb 0.00 1.14 -0.06 0.00 -2.10 0.00 0.00 70.33 69.31 1oy1 n THR 158 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1oy1 n ASP 159 N -0.28 2.00 -0.20 3.42 2.03 -1.26 -4.81 116.55 117.45 1oy1 n ASP 159 Ca 0.00 -0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.30 1oy1 n ASP 159 Cb 0.04 -1.36 0.11 0.00 -0.72 0.00 0.00 41.12 39.19 1oy1 n ASP 159 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 1oy1 h ILE 160 N 7.51 0.71 -0.56 5.18 3.07 -1.98 -1.92 117.51 129.51 1oy1 h ILE 160 Ca -0.23 -0.12 0.07 0.00 1.55 0.00 0.00 64.86 66.13 1oy1 h ILE 160 Cb 1.29 0.34 -0.06 0.00 -0.27 0.00 0.00 36.82 38.12 1oy1 h ILE 160 CO 1.13 0.06 0.25 0.44 -1.05 0.00 0.00 178.15 178.98 1oy1 h ASP 161 N 0.34 0.30 -0.17 2.16 3.32 -2.00 -0.82 116.42 119.55 1oy1 h ASP 161 Ca 0.31 0.05 -0.22 0.00 0.02 0.00 0.00 57.03 57.19 1oy1 h ASP 161 Cb 0.43 0.01 0.01 0.00 0.22 0.00 0.00 39.33 39.99 1oy1 h ASP 161 CO -0.35 0.20 -0.76 0.74 -1.72 0.00 0.00 179.24 177.35 1oy1 h THR 162 N 0.46 1.27 -0.73 0.35 2.02 -1.87 -2.99 112.91 111.42 1oy1 h THR 162 Ca 0.27 -1.95 0.04 0.00 0.77 0.00 0.00 66.41 65.55 1oy1 h THR 162 Cb 0.26 1.94 -0.04 0.00 -1.74 0.00 0.00 68.15 68.56 1oy1 h THR 162 CO -0.23 0.62 0.48 0.00 0.37 0.00 0.00 175.52 176.76 1oy1 h ALA 163 N 0.57 1.61 0.74 6.16 0.00 -1.02 -0.86 119.26 126.46 1oy1 h ALA 163 Ca -0.05 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1oy1 h ALA 163 Cb 1.39 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1oy1 h ALA 163 CO 0.16 0.30 -0.48 1.49 0.00 0.00 0.00 179.25 180.71 1oy1 h GLU 164 N 0.85 -1.11 -1.03 0.00 4.81 -1.03 0.39 114.58 117.45 1oy1 h GLU 164 Ca 0.30 0.08 0.26 0.00 -0.13 0.00 0.00 59.36 59.86 1oy1 h GLU 164 Cb 0.12 0.25 -0.10 0.00 0.63 0.00 0.00 28.75 29.65 1oy1 h GLU 164 CO -0.09 -0.74 0.64 0.28 -0.73 0.00 0.00 179.01 178.37 1oy1 h VAL 165 N -1.16 0.54 -0.17 0.32 2.07 -1.25 0.50 116.25 117.10 1oy1 h VAL 165 Ca -0.10 -0.16 -0.14 0.00 0.82 0.00 0.00 66.70 67.13 1oy1 h VAL 165 Cb 0.94 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1oy1 h VAL 165 CO 0.08 0.09 -0.42 -0.07 0.02 0.00 0.00 177.57 177.26 1oy1 h LEU 166 N 0.47 0.67 -0.74 2.57 3.38 -0.58 -3.14 115.31 117.93 1oy1 h LEU 166 Ca 0.61 -0.57 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 1oy1 h LEU 166 Cb 1.39 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 1oy1 h LEU 166 CO -0.36 1.12 -0.19 -0.33 0.09 0.00 0.00 178.44 178.77 1oy1 h GLU 167 N 0.25 0.76 -2.48 1.13 5.08 0.89 -3.03 114.58 117.17 1oy1 h GLU 167 Ca -0.00 -0.29 -0.08 0.00 -1.00 0.00 0.00 59.36 57.99 1oy1 h GLU 167 Cb 1.03 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.21 1oy1 h GLU 167 CO 0.09 0.89 0.08 0.39 -1.00 0.00 0.00 179.01 179.46 1oy1 n GLU 168 N -4.13 0.88 -2.92 2.33 1.02 0.16 -3.38 120.64 114.60 1oy1 n GLU 168 Ca 0.00 -0.42 -0.18 0.00 -0.02 0.00 0.00 57.16 56.55 1oy1 n GLU 168 Cb 0.41 -1.69 -0.01 0.00 -0.02 0.00 0.00 31.44 30.13 1oy1 n GLU 168 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1oy1 n GLY 170 N 2.67 3.52 3.19 0.62 0.00 -1.15 -5.04 105.19 109.00 1oy1 n GLY 170 Ca 0.18 -1.84 -0.13 0.00 0.00 0.00 0.00 46.02 44.23 1oy1 n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oy1 s ALA 171 N -2.91 -0.71 -0.60 4.61 0.00 -1.17 -4.22 121.76 116.77 1oy1 s ALA 171 Ca 0.38 0.59 -0.21 0.00 0.00 0.00 0.00 51.96 52.72 1oy1 s ALA 171 Cb 0.38 -0.26 0.07 0.00 0.00 0.00 0.00 23.12 23.31 1oy1 s ALA 171 CO -0.06 -0.18 0.82 -2.00 0.00 0.00 0.00 175.76 174.34 1oy1 s GLU 172 N -0.44 3.12 0.07 0.00 2.12 0.10 -3.89 118.70 119.79 1oy1 s GLU 172 Ca -0.06 -0.91 -0.28 0.00 0.36 0.00 0.00 54.97 54.08 1oy1 s GLU 172 Cb -0.04 -4.19 -0.05 0.00 0.26 0.00 0.00 34.13 30.11 1oy1 s GLU 172 CO 0.02 -1.59 0.87 -1.58 -0.54 0.00 0.00 175.26 172.44 1oy1 s HIS 173 N 3.38 3.77 -0.24 5.30 5.65 -1.26 -2.29 115.29 129.60 1oy1 s HIS 173 Ca 0.19 1.64 -0.00 0.00 0.25 0.00 0.00 55.06 57.14 1oy1 s HIS 173 Cb -0.19 -2.95 0.03 0.00 -1.18 0.00 0.00 32.58 28.29 1oy1 s HIS 173 CO 0.10 0.22 -0.09 0.08 -0.65 0.00 0.00 174.74 174.41 1oy1 s VAL 174 N 0.03 2.63 0.30 0.89 1.01 -0.04 -4.94 120.40 120.29 1oy1 s VAL 174 Ca 0.43 -1.13 -0.29 0.00 0.00 0.00 0.00 61.98 60.99 1oy1 s VAL 174 Cb -0.22 -2.35 -0.13 0.00 0.00 0.00 0.00 36.38 33.68 1oy1 s VAL 174 CO 0.27 0.20 1.19 -2.65 0.00 0.00 0.00 175.10 174.10 1oy1 n PRO 175 N 4.62 1.76 -3.77 2.72 -0.02 -1.26 -4.54 135.00 134.50 1oy1 n PRO 175 Ca -0.17 0.62 -0.13 0.00 -2.02 0.00 0.00 63.50 61.81 1oy1 n PRO 175 Cb 0.46 -2.12 -0.12 0.00 -0.02 0.00 0.00 33.50 31.71 1oy1 n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oy1 s PRO 177 N 0.36 2.79 0.24 0.00 0.02 -1.26 -4.28 135.00 132.87 1oy1 s PRO 177 Ca -0.02 0.95 -0.05 0.00 0.02 0.00 0.00 61.00 61.90 1oy1 s PRO 177 Cb -0.03 -1.97 0.40 0.00 0.02 0.00 0.00 34.50 32.91 1oy1 s PRO 177 CO -0.01 -1.20 1.77 0.28 -0.33 0.00 0.00 177.00 177.51 1oy1 h VAL 178 N -0.79 0.81 -0.14 3.83 2.07 -1.92 -2.39 116.25 117.72 1oy1 h VAL 178 Ca -0.44 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1oy1 h VAL 178 Cb 1.22 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1oy1 h VAL 178 CO 0.56 0.11 0.00 -0.90 0.02 0.00 0.00 177.57 177.37 1oy1 n ASP 179 N -4.86 0.74 -4.32 0.57 3.85 -1.26 -3.60 116.55 107.66 1oy1 n ASP 179 Ca 0.13 -2.00 -0.17 0.00 -0.71 0.00 0.00 54.79 52.05 1oy1 n ASP 179 Cb 0.32 -0.09 -0.10 0.00 -1.35 0.00 0.00 41.12 39.90 1oy1 n ASP 179 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1oy1 s ASP 180 N -1.00 1.40 0.34 -1.12 2.15 -0.90 -4.48 116.67 113.05 1oy1 s ASP 180 Ca 0.09 -1.33 0.04 0.00 0.43 0.00 0.00 52.55 51.79 1oy1 s ASP 180 Cb 0.05 0.11 -0.07 0.00 -0.30 0.00 0.00 42.92 42.71 1oy1 s ASP 180 CO 0.06 -0.67 0.05 0.27 -0.17 0.00 0.00 175.17 174.72 1oy1 s ILE 181 N -3.65 1.35 -0.03 4.11 -0.00 -1.26 -4.50 121.20 117.21 1oy1 s ILE 181 Ca 0.34 -2.00 0.06 0.00 -0.00 0.00 0.00 60.65 59.05 1oy1 s ILE 181 Cb 0.07 -2.84 -0.01 0.00 -0.00 0.00 0.00 42.46 39.69 1oy1 s ILE 181 CO 0.12 0.00 -0.20 -0.69 -0.00 0.00 0.00 174.94 174.17 1oy1 s VAL 182 N -3.18 1.58 -0.05 8.37 1.01 -0.30 -4.98 120.40 122.84 1oy1 s VAL 182 Ca 0.36 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.54 1oy1 s VAL 182 Cb 0.09 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 35.15 1oy1 s VAL 182 CO 0.16 0.45 -0.14 -0.69 0.00 0.00 0.00 175.10 174.88 1oy1 s VAL 183 N -0.29 1.20 -1.09 2.92 1.01 -1.26 -1.02 120.40 121.87 1oy1 s VAL 183 Ca 0.03 -0.55 -0.12 0.00 0.00 0.00 0.00 61.98 61.34 1oy1 s VAL 183 Cb -0.09 -1.07 0.22 0.00 0.00 0.00 0.00 36.38 35.43 1oy1 s VAL 183 CO 0.00 0.36 1.18 -0.62 0.00 0.00 0.00 175.10 176.03 1oy1 s ASP 184 N 0.42 7.09 0.17 3.32 2.15 -0.15 -4.90 116.67 124.76 1oy1 s ASP 184 Ca -0.10 -3.10 -0.13 0.00 0.43 0.00 0.00 52.55 49.64 1oy1 s ASP 184 Cb -0.14 -2.30 0.17 0.00 -0.30 0.00 0.00 42.92 40.36 1oy1 s ASP 184 CO 0.03 -0.57 1.17 -0.62 -0.17 0.00 0.00 175.17 175.01 1oy1 n GLU 185 N 4.31 -0.18 0.08 4.34 -0.58 -1.26 -0.88 120.64 126.46 1oy1 n GLU 185 Ca 0.27 1.16 -0.12 0.00 -0.42 0.00 0.00 57.16 58.05 1oy1 n GLU 185 Cb 0.43 -1.72 -0.05 0.00 -0.57 0.00 0.00 31.44 29.53 1oy1 n GLU 185 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 1oy1 h ASP 186 N 0.00 -0.45 -0.39 1.62 3.32 -1.98 -2.71 116.42 115.83 1oy1 h ASP 186 Ca 0.26 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.37 1oy1 h ASP 186 Cb 0.45 0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1oy1 h ASP 186 CO -0.75 -0.23 0.00 0.59 -1.72 0.00 0.00 179.24 177.14 1oy1 n ASN 187 N -5.29 2.08 -3.82 6.45 4.13 -0.64 -4.95 115.26 113.22 1oy1 n ASN 187 Ca -0.06 -2.00 -0.31 0.00 1.68 0.00 0.00 54.58 53.90 1oy1 n ASN 187 Cb 0.21 -0.26 0.02 0.00 -1.54 0.00 0.00 39.78 38.21 1oy1 n ASN 187 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1oy1 n LYS 188 N 0.64 -1.86 -4.01 3.52 5.02 -0.06 -4.77 118.16 116.64 1oy1 n LYS 188 Ca 0.13 0.40 -0.30 0.00 -2.02 0.00 0.00 58.31 56.51 1oy1 n LYS 188 Cb 0.33 -4.09 -0.16 0.00 -0.02 0.00 0.00 35.03 31.09 1oy1 n LYS 188 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1oy1 s ILE 189 N -3.65 1.60 -0.09 -0.18 1.01 -1.18 -1.46 121.20 117.25 1oy1 s ILE 189 Ca 0.31 -0.81 -0.02 0.00 0.00 0.00 0.00 60.65 60.14 1oy1 s ILE 189 Cb -0.12 -1.58 -0.03 0.00 0.01 0.00 0.00 42.46 40.73 1oy1 s ILE 189 CO 0.88 0.32 -0.01 -0.69 0.00 0.00 0.00 174.94 175.44 1oy1 s VAL 190 N 1.45 4.19 0.03 2.92 1.01 0.73 -0.98 120.40 129.75 1oy1 s VAL 190 Ca 0.02 -0.29 -0.00 0.00 0.00 0.00 0.00 61.98 61.71 1oy1 s VAL 190 Cb -0.14 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 1oy1 s VAL 190 CO -0.10 0.59 -0.03 0.42 0.00 0.00 0.00 175.10 175.99 1oy1 s THR 191 N -0.74 0.16 -0.09 3.92 -4.23 -0.18 -1.72 115.64 112.75 1oy1 s THR 191 Ca 0.12 -1.22 -0.12 0.00 -1.18 0.00 0.00 61.69 59.28 1oy1 s THR 191 Cb -0.11 -0.69 0.03 0.00 1.34 0.00 0.00 72.50 73.06 1oy1 s THR 191 CO 0.02 -0.66 0.33 -0.89 -0.54 0.00 0.00 174.62 172.88 1oy1 s THR 192 N -2.28 0.02 0.04 3.99 2.01 -1.11 -1.15 115.64 117.15 1oy1 s THR 192 Ca -0.08 -0.13 -0.30 0.00 0.31 0.00 0.00 61.69 61.48 1oy1 s THR 192 Cb -0.04 -0.51 -0.05 0.00 0.01 0.00 0.00 72.50 71.91 1oy1 s THR 192 CO -0.04 -0.07 1.14 -2.84 -0.69 0.00 0.00 174.62 172.12 1oy1 s PRO 193 N -0.24 4.46 0.00 4.92 0.02 -1.26 -1.46 135.00 141.44 1oy1 s PRO 193 Ca -0.04 1.67 0.00 0.00 0.02 0.00 0.00 61.00 62.65 1oy1 s PRO 193 Cb -0.03 -3.39 0.00 0.00 0.02 0.00 0.00 34.50 31.10 1oy1 s PRO 193 CO 0.01 -0.22 0.00 0.00 -0.33 0.00 0.00 177.00 176.47 1oy1 n ALA 194 N 4.01 0.00 -1.64 -1.55 0.00 -1.26 -4.73 120.51 115.35 1oy1 n ALA 194 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.10 1oy1 n ALA 194 Cb 0.48 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.90 1oy1 n ALA 194 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1oy1 n TYR 195 N 0.00 3.07 -0.09 0.00 4.02 -1.26 0.94 117.16 123.83 1oy1 n TYR 195 Ca 0.00 -2.52 0.14 0.00 -0.01 0.00 0.00 57.90 55.51 1oy1 n TYR 195 Cb 0.00 -2.30 0.21 0.00 -0.02 0.00 0.00 39.34 37.24 1oy1 n TYR 195 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1oy1 n LEU 197 N 7.14 0.00 -4.66 7.72 4.77 -1.26 -4.98 117.00 125.73 1oy1 n LEU 197 Ca 0.51 0.40 -0.44 0.00 -0.03 0.00 0.00 56.01 56.45 1oy1 n LEU 197 Cb 0.40 -0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.35 1oy1 n LEU 197 CO 0.92 -0.40 0.86 0.00 -1.33 0.00 0.00 177.39 177.44 1oy1 n ALA 198 N -1.74 0.85 0.09 -1.18 0.00 0.27 -4.91 120.51 113.89 1oy1 n ALA 198 Ca 0.12 0.39 0.07 0.00 0.00 0.00 0.00 53.44 54.02 1oy1 n ALA 198 Cb 0.82 -2.20 -0.11 0.00 0.00 0.00 0.00 19.45 17.95 1oy1 n ALA 198 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1oy1 n GLN 199 N 1.08 0.70 -3.93 0.00 1.13 -1.26 -5.00 117.38 110.09 1oy1 n GLN 199 Ca 0.08 -0.12 -0.09 0.00 -1.94 0.00 0.00 57.00 54.93 1oy1 n GLN 199 Cb 0.33 -1.33 -0.05 0.00 0.11 0.00 0.00 30.24 29.30 1oy1 n GLN 199 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1oy1 s ASN 200 N -3.53 -0.11 0.41 1.08 2.20 -1.26 -5.05 114.94 108.68 1oy1 s ASN 200 Ca -0.04 -0.82 0.15 0.00 -0.94 0.00 0.00 52.86 51.22 1oy1 s ASN 200 Cb 0.10 0.57 0.90 0.00 -2.00 0.00 0.00 41.25 40.81 1oy1 s ASN 200 CO 0.62 -1.09 1.90 -0.29 -2.94 0.00 0.00 177.10 175.30 1oy1 h ILE 201 N 2.28 1.12 -0.58 0.54 2.10 -1.99 -2.63 117.51 118.34 1oy1 h ILE 201 Ca -0.27 -0.99 -0.05 0.00 1.08 0.00 0.00 64.86 64.62 1oy1 h ILE 201 Cb 1.25 1.55 -0.02 0.00 -1.09 0.00 0.00 36.82 38.50 1oy1 h ILE 201 CO 0.37 0.28 0.15 0.00 -1.08 0.00 0.00 178.15 177.87 1oy1 h ALA 202 N 1.72 0.77 0.11 0.18 0.00 -1.99 0.54 119.26 120.58 1oy1 h ALA 202 Ca -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1oy1 h ALA 202 Cb 0.52 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1oy1 h ALA 202 CO 0.04 0.46 -0.05 0.93 0.00 0.00 0.00 179.25 180.63 1oy1 h GLU 203 N 0.84 -0.14 -0.55 0.00 5.08 -1.90 -1.13 114.58 116.78 1oy1 h GLU 203 Ca 0.18 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.62 1oy1 h GLU 203 Cb 0.33 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.56 1oy1 h GLU 203 CO -0.00 -0.06 0.24 0.00 -1.00 0.00 0.00 179.01 178.19 1oy1 h ALA 204 N 0.71 0.70 -0.60 3.43 0.00 -1.24 -1.20 119.26 121.06 1oy1 h ALA 204 Ca -0.01 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.00 1oy1 h ALA 204 Cb 0.14 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 1oy1 h ALA 204 CO 0.02 -0.14 0.31 0.00 0.00 0.00 0.00 179.25 179.45 1oy1 h ALA 205 N 1.34 0.79 -0.75 0.00 0.00 -0.55 -1.60 119.26 118.48 1oy1 h ALA 205 Ca 0.26 0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.29 1oy1 h ALA 205 Cb 0.24 -0.08 -0.12 0.00 0.00 0.00 0.00 17.79 17.83 1oy1 h ALA 205 CO -0.22 -0.03 -0.49 1.03 0.00 0.00 0.00 179.25 179.53 1oy1 h SER 206 N 0.58 -1.73 -0.14 0.00 0.87 0.06 0.13 113.55 113.33 1oy1 h SER 206 Ca 0.27 0.28 -0.12 0.00 -1.23 0.00 0.00 61.79 60.99 1oy1 h SER 206 Cb 0.19 0.79 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1oy1 h SER 206 CO -0.19 -0.31 -0.39 1.23 -0.53 0.00 0.00 176.83 176.65 1oy1 h GLY 207 N -0.15 0.55 0.67 5.77 0.00 -1.38 -3.12 103.07 105.41 1oy1 h GLY 207 Ca 0.19 -0.71 0.09 0.00 0.00 0.00 0.00 47.33 46.90 1oy1 h GLY 207 CO -0.80 0.63 0.63 -2.22 0.00 0.00 0.00 176.54 174.78 1oy1 h ILE 208 N 0.12 1.02 -0.32 2.60 2.04 -0.77 0.00 117.51 122.20 1oy1 h ILE 208 Ca -0.01 -0.36 -0.00 0.00 1.00 0.00 0.00 64.86 65.48 1oy1 h ILE 208 Cb 1.01 -0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1oy1 h ILE 208 CO 0.08 0.19 0.19 0.44 0.00 0.00 0.00 178.15 179.06 1oy1 h ASP 209 N 1.06 0.38 -0.78 1.72 3.32 -0.77 -0.41 116.42 120.95 1oy1 h ASP 209 Ca 0.44 -0.05 0.02 0.00 0.02 0.00 0.00 57.03 57.46 1oy1 h ASP 209 Cb 0.31 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 1oy1 h ASP 209 CO -0.20 0.32 0.51 0.11 -1.72 0.00 0.00 179.24 178.26 1oy1 h LYS 210 N 0.40 0.99 0.14 3.56 1.57 -1.22 -0.49 116.57 121.52 1oy1 h LYS 210 Ca 0.11 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1oy1 h LYS 210 Cb 0.01 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.10 1oy1 h LYS 210 CO -0.02 0.65 -0.07 1.25 -0.57 0.00 0.00 179.45 180.69 1oy1 h LEU 211 N 1.02 -0.16 -0.56 2.94 6.46 -0.49 -1.58 115.31 122.93 1oy1 h LEU 211 Ca 0.30 -0.04 0.00 0.00 -0.12 0.00 0.00 57.88 58.03 1oy1 h LEU 211 Cb -0.06 0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 39.88 1oy1 h LEU 211 CO -0.09 -0.07 0.37 0.58 -0.62 0.00 0.00 178.44 178.62 1oy1 h VAL 212 N -0.23 1.15 -0.91 1.05 2.07 -0.79 -0.20 116.25 118.38 1oy1 h VAL 212 Ca -0.02 -0.28 0.04 0.00 0.82 0.00 0.00 66.70 67.26 1oy1 h VAL 212 Cb 0.18 0.33 -0.06 0.00 -1.52 0.00 0.00 31.29 30.22 1oy1 h VAL 212 CO 0.03 0.14 0.59 0.28 0.02 0.00 0.00 177.57 178.64 1oy1 h SER 213 N 0.77 0.98 -0.17 0.57 0.02 -0.95 0.35 113.55 115.11 1oy1 h SER 213 Ca 0.21 -0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.95 1oy1 h SER 213 Cb -0.08 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.25 1oy1 h SER 213 CO -0.04 0.66 -0.65 -0.09 -1.14 0.00 0.00 176.83 175.57 1oy1 h ARG 214 N 1.13 0.78 -0.61 3.45 9.65 -0.83 0.15 114.38 128.11 1oy1 h ARG 214 Ca 0.37 -0.56 -0.04 0.00 -1.10 0.00 0.00 59.98 58.65 1oy1 h ARG 214 Cb 0.03 0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.67 1oy1 h ARG 214 CO -0.13 1.18 0.22 0.28 2.80 0.00 0.00 179.97 184.32 1oy1 h VAL 215 N 0.57 1.24 -0.64 0.20 2.07 -0.68 -0.35 116.25 118.66 1oy1 h VAL 215 Ca -0.01 -0.77 -0.07 0.00 0.82 0.00 0.00 66.70 66.66 1oy1 h VAL 215 Cb 1.26 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 1oy1 h VAL 215 CO 0.14 0.30 0.12 -0.07 0.02 0.00 0.00 177.57 178.08 1oy1 h LEU 216 N 0.87 1.00 0.17 2.57 3.38 -0.77 0.17 115.31 122.70 1oy1 h LEU 216 Ca 0.20 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1oy1 h LEU 216 Cb 0.24 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1oy1 h LEU 216 CO -0.01 1.00 -0.08 0.58 0.09 0.00 0.00 178.44 180.01 1oy1 h VAL 217 N 0.97 0.87 -0.00 1.22 2.07 -0.71 -2.13 116.25 118.55 1oy1 h VAL 217 Ca 0.20 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1oy1 h VAL 217 Cb 0.41 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1oy1 h VAL 217 CO 0.01 0.04 0.00 -0.07 0.02 0.00 0.00 177.57 177.57 1oy1 h LEU 218 N -0.31 0.00 0.00 2.57 3.38 -0.87 -3.51 115.31 116.56 1oy1 h LEU 218 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1oy1 h LEU 218 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1oy1 h LEU 218 CO 0.04 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.57