#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iy8 n PHE 11 N 0.00 0.00 -1.65 -1.55 3.72 -0.86 -4.79 117.46 112.34 1iy8 n PHE 11 Ca 0.00 -0.85 -0.54 0.00 -0.05 0.00 0.00 57.45 56.02 1iy8 n PHE 11 Cb 0.00 -0.13 -0.06 0.00 -0.94 0.00 0.00 39.48 38.35 1iy8 n PHE 11 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1iy8 n THR 12 N -1.18 0.37 -1.85 4.37 -1.04 -1.12 -0.78 114.28 113.05 1iy8 n THR 12 Ca 0.12 -0.11 -0.19 0.00 -2.04 0.00 0.00 64.05 61.83 1iy8 n THR 12 Cb 0.58 -1.50 -0.06 0.00 -1.82 0.00 0.00 70.33 67.53 1iy8 n THR 12 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1iy8 n ASP 13 N 6.64 -5.19 -4.81 8.00 8.00 -0.82 -4.95 116.55 123.41 1iy8 n ASP 13 Ca 0.28 0.32 -0.37 0.00 0.71 0.00 0.00 54.79 55.73 1iy8 n ASP 13 Cb 0.20 -4.52 -0.06 0.00 -0.02 0.00 0.00 41.12 36.71 1iy8 n ASP 13 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1iy8 s ARG 14 N -4.11 3.91 -0.24 -1.24 0.52 0.04 -4.84 118.95 113.00 1iy8 s ARG 14 Ca 0.00 0.17 -0.18 0.00 -0.52 0.00 0.00 55.73 55.20 1iy8 s ARG 14 Cb 0.00 -3.28 -0.03 0.00 0.52 0.00 0.00 34.95 32.16 1iy8 s ARG 14 CO 0.00 0.56 0.52 0.08 0.02 0.00 0.00 175.30 176.48 1iy8 s VAL 15 N -0.54 5.08 -0.12 3.52 1.01 -1.26 -0.64 120.40 127.44 1iy8 s VAL 15 Ca 0.19 0.91 0.03 0.00 0.00 0.00 0.00 61.98 63.11 1iy8 s VAL 15 Cb -0.14 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.41 1iy8 s VAL 15 CO 0.08 0.11 -0.23 -0.69 0.00 0.00 0.00 175.10 174.37 1iy8 s VAL 16 N 2.10 2.06 -0.22 2.92 1.01 -0.44 -0.48 120.40 127.35 1iy8 s VAL 16 Ca 0.22 -0.99 -0.10 0.00 0.00 0.00 0.00 61.98 61.11 1iy8 s VAL 16 Cb -0.16 -1.80 -0.05 0.00 0.00 0.00 0.00 36.38 34.37 1iy8 s VAL 16 CO 0.09 0.55 0.14 -0.22 0.00 0.00 0.00 175.10 175.66 1iy8 s LEU 17 N 0.64 4.13 -0.11 3.92 2.96 -0.05 -1.45 118.68 128.71 1iy8 s LEU 17 Ca -0.12 0.16 0.01 0.00 -0.22 0.00 0.00 54.13 53.96 1iy8 s LEU 17 Cb -0.16 -2.08 0.02 0.00 0.50 0.00 0.00 46.19 44.46 1iy8 s LEU 17 CO 0.02 0.13 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.42 1iy8 s ILE 18 N 0.69 1.32 0.13 6.68 1.01 -0.02 -0.66 121.20 130.35 1iy8 s ILE 18 Ca 0.07 -0.51 -0.03 0.00 0.00 0.00 0.00 60.65 60.18 1iy8 s ILE 18 Cb -0.12 -1.24 -0.05 0.00 0.01 0.00 0.00 42.46 41.05 1iy8 s ILE 18 CO 0.01 0.41 0.33 0.42 0.00 0.00 0.00 174.94 176.12 1iy8 s THR 19 N 1.24 5.23 -0.70 2.92 -4.23 -0.77 -0.51 115.64 118.82 1iy8 s THR 19 Ca -0.02 -0.12 0.00 0.00 -1.18 0.00 0.00 61.69 60.37 1iy8 s THR 19 Cb -0.14 -3.64 0.00 0.00 1.34 0.00 0.00 72.50 70.06 1iy8 s THR 19 CO -0.05 0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1iy8 n GLY 20 N 0.06 0.38 0.00 3.99 0.00 0.93 -3.01 105.19 107.54 1iy8 n GLY 20 Ca -0.03 -0.62 0.07 0.00 0.00 0.00 0.00 46.02 45.44 1iy8 n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iy8 n GLY 21 N -1.39 -0.90 0.84 -0.02 0.00 -0.65 -3.65 105.19 99.42 1iy8 n GLY 21 Ca -0.08 -0.09 0.11 0.00 0.00 0.00 0.00 46.02 45.95 1iy8 n GLY 21 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iy8 n GLY 22 N 0.60 0.98 3.78 -0.02 0.00 -1.26 -4.07 105.19 105.21 1iy8 n GLY 22 Ca 0.11 -0.57 -0.02 0.00 0.00 0.00 0.00 46.02 45.54 1iy8 n GLY 22 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1iy8 s SER 23 N -1.50 -0.09 0.00 1.61 0.15 -1.24 -4.31 113.70 108.33 1iy8 s SER 23 Ca 0.35 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1iy8 s SER 23 Cb 0.20 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.93 1iy8 s SER 23 CO 0.28 -0.81 0.00 0.61 1.20 0.00 0.00 173.24 174.52 1iy8 n GLY 24 N -0.57 2.04 0.33 9.45 0.00 -1.26 -1.72 105.19 113.47 1iy8 n GLY 24 Ca -0.05 0.22 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 1iy8 n GLY 24 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1iy8 h LEU 25 N 0.00 0.85 -0.43 0.99 3.38 -1.92 -1.01 115.31 117.17 1iy8 h LEU 25 Ca 0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1iy8 h LEU 25 Cb 0.00 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1iy8 h LEU 25 CO 0.00 0.70 0.21 1.23 0.09 0.00 0.00 178.44 180.67 1iy8 h GLY 26 N 1.01 0.65 0.89 0.83 0.00 -1.53 -0.96 103.07 103.96 1iy8 h GLY 26 Ca 0.24 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.19 1iy8 h GLY 26 CO -0.03 0.30 -0.01 -0.09 0.00 0.00 0.00 176.54 176.71 1iy8 h ARG 27 N 0.55 0.55 -0.65 4.80 2.43 -0.95 -1.60 114.38 119.50 1iy8 h ARG 27 Ca 0.15 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1iy8 h ARG 27 Cb 0.11 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 1iy8 h ARG 27 CO -0.02 0.70 0.30 0.00 -1.51 0.00 0.00 179.97 179.44 1iy8 h ALA 28 N 0.83 1.32 -0.32 2.80 0.00 -1.08 -1.52 119.26 121.29 1iy8 h ALA 28 Ca 0.08 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 54.69 1iy8 h ALA 28 Cb 0.46 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1iy8 h ALA 28 CO 0.02 0.53 -0.47 1.15 0.00 0.00 0.00 179.25 180.48 1iy8 h THR 29 N 0.91 1.28 -0.47 0.00 2.02 -1.07 -2.04 112.91 113.54 1iy8 h THR 29 Ca 0.22 -1.65 0.03 0.00 0.77 0.00 0.00 66.41 65.78 1iy8 h THR 29 Cb 0.10 1.52 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 1iy8 h THR 29 CO -0.03 0.54 0.27 0.00 0.37 0.00 0.00 175.52 176.67 1iy8 h ALA 30 N 0.78 0.60 -0.23 6.16 0.00 -0.76 -0.01 119.26 125.81 1iy8 h ALA 30 Ca 0.04 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1iy8 h ALA 30 Cb 1.06 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1iy8 h ALA 30 CO 0.11 -0.05 0.13 0.28 0.00 0.00 0.00 179.25 179.71 1iy8 h VAL 31 N 0.53 1.11 -0.53 0.00 2.07 -1.17 -1.08 116.25 117.19 1iy8 h VAL 31 Ca 0.19 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 1iy8 h VAL 31 Cb 0.05 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1iy8 h VAL 31 CO -0.10 0.11 0.25 -0.09 0.02 0.00 0.00 177.57 177.75 1iy8 h ARG 32 N 0.27 0.77 -0.60 1.57 9.65 -1.06 -1.75 114.38 123.23 1iy8 h ARG 32 Ca 0.08 -0.12 -0.09 0.00 -1.10 0.00 0.00 59.98 58.75 1iy8 h ARG 32 Cb 0.06 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.48 1iy8 h ARG 32 CO -0.01 0.64 0.00 -0.07 2.80 0.00 0.00 179.97 183.33 1iy8 h LEU 33 N 0.71 1.03 -1.05 3.80 3.38 -0.89 -2.57 115.31 119.72 1iy8 h LEU 33 Ca 0.18 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 1iy8 h LEU 33 Cb 0.14 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1iy8 h LEU 33 CO -0.02 1.07 0.02 0.00 0.09 0.00 0.00 178.44 179.61 1iy8 h ALA 34 N 1.03 1.22 0.00 1.53 0.00 -1.03 -0.73 119.26 121.27 1iy8 h ALA 34 Ca 0.17 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1iy8 h ALA 34 Cb 0.55 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1iy8 h ALA 34 CO 0.03 0.52 -0.10 0.00 0.00 0.00 0.00 179.25 179.70 1iy8 h ALA 35 N 1.36 1.30 -0.57 0.00 0.00 -0.97 -0.98 119.26 119.41 1iy8 h ALA 35 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1iy8 h ALA 35 Cb 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1iy8 h ALA 35 CO 0.01 0.13 0.00 0.39 0.00 0.00 0.00 179.25 179.78 1iy8 n GLU 36 N -3.64 2.70 -0.47 0.00 1.02 -0.37 -4.94 120.64 114.93 1iy8 n GLU 36 Ca -0.02 -2.19 0.00 0.00 -0.02 0.00 0.00 57.16 54.93 1iy8 n GLU 36 Cb 0.22 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 1iy8 n GLU 36 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1iy8 n GLY 37 N 1.26 0.76 3.81 0.62 0.00 -0.37 -2.02 105.19 109.25 1iy8 n GLY 37 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 1iy8 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iy8 s ALA 38 N -2.08 2.67 -0.10 4.61 0.00 -0.69 -1.95 121.76 124.22 1iy8 s ALA 38 Ca 0.00 0.16 -0.05 0.00 0.00 0.00 0.00 51.96 52.07 1iy8 s ALA 38 Cb 0.00 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 1iy8 s ALA 38 CO 0.00 -1.16 0.11 0.15 0.00 0.00 0.00 175.76 174.87 1iy8 s LYS 39 N -4.81 3.33 0.09 0.00 1.02 0.18 -4.57 119.74 114.98 1iy8 s LYS 39 Ca 0.59 -0.22 0.08 0.00 0.02 0.00 0.00 55.97 56.45 1iy8 s LYS 39 Cb -0.15 -3.08 -0.03 0.00 -0.52 0.00 0.00 37.83 34.05 1iy8 s LYS 39 CO 0.51 0.75 -0.22 -0.51 -0.92 0.00 0.00 175.35 174.96 1iy8 s LEU 40 N -1.12 2.27 -0.26 3.17 1.43 -0.02 -1.33 118.68 122.83 1iy8 s LEU 40 Ca 0.16 -0.66 -0.01 0.00 -1.03 0.00 0.00 54.13 52.59 1iy8 s LEU 40 Cb -0.12 -0.95 0.08 0.00 0.03 0.00 0.00 46.19 45.23 1iy8 s LEU 40 CO 0.05 0.10 0.04 -0.55 0.23 0.00 0.00 176.35 176.22 1iy8 s SER 41 N -1.76 3.67 -0.15 2.29 0.15 -0.53 -0.66 113.70 116.71 1iy8 s SER 41 Ca 0.08 -1.30 -0.10 0.00 0.70 0.00 0.00 55.95 55.32 1iy8 s SER 41 Cb -0.10 -0.88 -0.05 0.00 -1.71 0.00 0.00 66.02 63.29 1iy8 s SER 41 CO 0.04 -0.34 0.19 -0.76 1.20 0.00 0.00 173.24 173.56 1iy8 s LEU 42 N 1.61 4.31 -0.03 3.45 1.43 0.31 -0.84 118.68 128.92 1iy8 s LEU 42 Ca 0.03 0.43 0.05 0.00 -1.03 0.00 0.00 54.13 53.61 1iy8 s LEU 42 Cb -0.18 -2.17 -0.01 0.00 0.03 0.00 0.00 46.19 43.86 1iy8 s LEU 42 CO -0.15 0.26 -0.17 -0.69 0.23 0.00 0.00 176.35 175.84 1iy8 s VAL 43 N -0.27 1.38 0.01 -1.59 1.01 0.33 -1.08 120.40 120.19 1iy8 s VAL 43 Ca 0.13 -0.71 -0.29 0.00 0.00 0.00 0.00 61.98 61.12 1iy8 s VAL 43 Cb -0.12 -1.17 0.10 0.00 0.00 0.00 0.00 36.38 35.19 1iy8 s VAL 43 CO 0.03 0.39 0.93 -0.62 0.00 0.00 0.00 175.10 175.83 1iy8 s ASP 44 N -0.14 -0.31 0.30 3.32 -1.08 -1.00 -0.05 116.67 117.71 1iy8 s ASP 44 Ca 0.01 -0.07 0.24 0.00 -0.52 0.00 0.00 52.55 52.21 1iy8 s ASP 44 Cb -0.09 0.38 0.48 0.00 -1.46 0.00 0.00 42.92 42.23 1iy8 s ASP 44 CO 0.01 -0.64 1.59 -0.37 0.52 0.00 0.00 175.17 176.28 1iy8 h VAL 45 N 2.00 0.00 -3.47 1.11 -1.51 -1.87 -0.88 116.25 111.63 1iy8 h VAL 45 Ca -0.22 -0.76 -0.72 0.00 -1.23 0.00 0.00 66.70 63.77 1iy8 h VAL 45 Cb 1.23 1.68 -0.22 0.00 -2.13 0.00 0.00 31.29 31.85 1iy8 h VAL 45 CO 0.29 0.00 -0.42 -0.55 -1.23 0.00 0.00 177.57 175.66 1iy8 s SER 46 N -5.33 6.08 0.20 4.19 0.15 -1.26 -4.79 113.70 112.93 1iy8 s SER 46 Ca 0.08 -0.99 -0.09 0.00 0.70 0.00 0.00 55.95 55.64 1iy8 s SER 46 Cb 0.09 -2.15 0.14 0.00 -1.71 0.00 0.00 66.02 62.39 1iy8 s SER 46 CO 0.66 -0.48 1.78 -1.28 1.20 0.00 0.00 173.24 175.12 1iy8 h SER 47 N 8.63 1.00 -0.79 5.45 0.87 -1.97 -1.87 113.55 124.88 1iy8 h SER 47 Ca -0.27 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.12 1iy8 h SER 47 Cb 1.12 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 62.78 1iy8 h SER 47 CO 0.75 0.88 0.43 -0.08 -0.53 0.00 0.00 176.83 178.28 1iy8 h GLU 48 N 1.06 1.10 -0.58 2.24 4.81 -1.98 -1.18 114.58 120.05 1iy8 h GLU 48 Ca 0.25 -0.13 -0.11 0.00 -0.13 0.00 0.00 59.36 59.24 1iy8 h GLU 48 Cb 0.18 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 1iy8 h GLU 48 CO -0.03 0.82 -0.06 0.78 -0.73 0.00 0.00 179.01 179.79 1iy8 h GLY 49 N 1.09 1.14 1.02 1.92 0.00 -1.73 -2.35 103.07 104.17 1iy8 h GLY 49 Ca 0.28 -0.88 -0.01 0.00 0.00 0.00 0.00 47.33 46.72 1iy8 h GLY 49 CO -0.04 0.81 0.51 1.41 0.00 0.00 0.00 176.54 179.23 1iy8 h LEU 50 N 0.95 1.05 -0.47 3.11 3.38 -0.93 -1.04 115.31 121.35 1iy8 h LEU 50 Ca 0.16 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1iy8 h LEU 50 Cb 0.63 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1iy8 h LEU 50 CO 0.04 0.82 0.30 -0.08 0.09 0.00 0.00 178.44 179.61 1iy8 h GLU 51 N 1.20 0.63 -0.49 1.13 4.22 -0.98 -1.40 114.58 118.89 1iy8 h GLU 51 Ca 0.31 -0.05 -0.09 0.00 0.08 0.00 0.00 59.36 59.61 1iy8 h GLU 51 Cb -0.03 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 1iy8 h GLU 51 CO -0.06 0.44 -0.06 0.00 -2.18 0.00 0.00 179.01 177.16 1iy8 h ALA 52 N 1.16 0.97 -0.45 2.92 0.00 -1.05 -1.77 119.26 121.04 1iy8 h ALA 52 Ca 0.17 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1iy8 h ALA 52 Cb -0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1iy8 h ALA 52 CO -0.03 0.62 -0.05 0.77 0.00 0.00 0.00 179.25 180.55 1iy8 h SER 53 N 0.79 0.82 -0.69 0.00 0.02 -0.95 -1.38 113.55 112.17 1iy8 h SER 53 Ca 0.14 -0.34 -0.04 0.00 -0.84 0.00 0.00 61.79 60.72 1iy8 h SER 53 Cb 0.56 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.84 1iy8 h SER 53 CO 0.03 0.96 0.29 0.50 -1.14 0.00 0.00 176.83 177.48 1iy8 h LYS 54 N 0.67 1.02 -0.68 3.45 3.64 -1.08 -0.20 116.57 123.38 1iy8 h LYS 54 Ca 0.12 -0.18 -0.03 0.00 -1.27 0.00 0.00 60.65 59.29 1iy8 h LYS 54 Cb 0.57 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.19 1iy8 h LYS 54 CO 0.03 0.84 0.29 0.00 -2.27 0.00 0.00 179.45 178.34 1iy8 h ALA 55 N 1.13 0.88 -0.72 5.00 0.00 -1.18 -0.67 119.26 123.70 1iy8 h ALA 55 Ca 0.23 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1iy8 h ALA 55 Cb 0.18 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1iy8 h ALA 55 CO -0.02 0.48 0.38 0.00 0.00 0.00 0.00 179.25 180.09 1iy8 h ALA 56 N 1.13 0.92 -0.39 0.00 0.00 -0.78 -1.88 119.26 118.26 1iy8 h ALA 56 Ca 0.23 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1iy8 h ALA 56 Cb 0.17 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1iy8 h ALA 56 CO -0.02 0.44 0.14 0.28 0.00 0.00 0.00 179.25 180.08 1iy8 h VAL 57 N 0.99 1.21 0.00 0.00 2.07 -0.62 -2.72 116.25 117.17 1iy8 h VAL 57 Ca 0.25 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1iy8 h VAL 57 Cb 0.05 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1iy8 h VAL 57 CO -0.04 0.23 0.00 -0.07 0.02 0.00 0.00 177.57 177.71 1iy8 h LEU 58 N 0.48 0.00 -0.11 2.57 3.38 -0.78 0.21 115.31 121.06 1iy8 h LEU 58 Ca 0.13 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.87 1iy8 h LEU 58 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1iy8 h LEU 58 CO -0.01 0.00 -1.01 -0.33 0.09 0.00 0.00 178.44 177.18 1iy8 h GLU 59 N 0.00 0.26 0.15 1.13 5.08 -1.03 -2.87 114.58 117.31 1iy8 h GLU 59 Ca 0.00 -0.34 -0.35 0.00 -1.00 0.00 0.00 59.36 57.68 1iy8 h GLU 59 Cb 0.31 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 1iy8 h GLU 59 CO 0.00 1.08 -1.78 1.15 -1.00 0.00 0.00 179.01 178.46 1iy8 h THR 60 N 0.12 0.88 -2.81 1.13 2.02 -1.35 -3.42 112.91 109.49 1iy8 h THR 60 Ca -0.08 -2.52 -0.60 0.00 0.77 0.00 0.00 66.41 63.97 1iy8 h THR 60 Cb 1.68 2.68 -0.40 0.00 -1.74 0.00 0.00 68.15 70.37 1iy8 h THR 60 CO 0.16 0.85 -0.78 0.00 0.37 0.00 0.00 175.52 176.12 1iy8 s ALA 61 N -2.58 2.10 0.53 6.16 0.00 0.70 -4.91 121.76 123.76 1iy8 s ALA 61 Ca -0.16 -2.68 0.29 0.00 0.00 0.00 0.00 51.96 49.41 1iy8 s ALA 61 Cb 0.06 -1.83 1.43 0.00 0.00 0.00 0.00 23.12 22.78 1iy8 s ALA 61 CO 0.83 -2.05 1.92 -1.35 0.00 0.00 0.00 175.76 175.11 1iy8 h PRO 62 N 6.28 0.03 -0.63 0.00 0.11 -1.73 -1.66 132.00 134.40 1iy8 h PRO 62 Ca 0.09 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1iy8 h PRO 62 Cb 0.90 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1iy8 h PRO 62 CO 0.47 0.02 0.00 -0.25 -0.21 0.00 0.00 178.00 178.03 1iy8 n ASP 63 N -4.32 3.49 -4.77 -2.05 8.00 -1.26 -4.97 116.55 110.67 1iy8 n ASP 63 Ca 0.16 -1.99 -0.40 0.00 0.71 0.00 0.00 54.79 53.27 1iy8 n ASP 63 Cb 0.84 -0.42 -0.02 0.00 -0.02 0.00 0.00 41.12 41.50 1iy8 n ASP 63 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1iy8 s ALA 64 N -1.16 3.32 -0.35 2.24 0.00 -0.62 -4.99 121.76 120.19 1iy8 s ALA 64 Ca 0.43 1.15 -0.17 0.00 0.00 0.00 0.00 51.96 53.38 1iy8 s ALA 64 Cb 0.23 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.90 1iy8 s ALA 64 CO 0.30 -0.65 0.44 -1.21 0.00 0.00 0.00 175.76 174.65 1iy8 s GLU 65 N -2.06 3.57 -0.16 0.00 2.02 -1.26 -5.00 118.70 115.82 1iy8 s GLU 65 Ca 0.54 -0.30 0.00 0.00 0.02 0.00 0.00 54.97 55.23 1iy8 s GLU 65 Cb -0.36 -3.81 0.04 0.00 0.10 0.00 0.00 34.13 30.09 1iy8 s GLU 65 CO 0.47 -0.60 -0.09 0.08 0.02 0.00 0.00 175.26 175.14 1iy8 s VAL 66 N 2.22 1.34 -0.07 2.63 1.01 -1.26 -0.84 120.40 125.43 1iy8 s VAL 66 Ca 0.15 -0.68 -0.05 0.00 0.00 0.00 0.00 61.98 61.40 1iy8 s VAL 66 Cb -0.16 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 1iy8 s VAL 66 CO 0.13 0.25 0.17 -0.22 0.00 0.00 0.00 175.10 175.42 1iy8 s LEU 67 N 1.55 4.38 -0.00 3.92 2.96 0.16 -5.01 118.68 126.65 1iy8 s LEU 67 Ca 0.02 0.43 0.06 0.00 -0.22 0.00 0.00 54.13 54.42 1iy8 s LEU 67 Cb -0.15 -2.33 -0.02 0.00 0.50 0.00 0.00 46.19 44.20 1iy8 s LEU 67 CO -0.09 0.34 -0.18 0.42 -1.32 0.00 0.00 176.35 175.52 1iy8 s THR 68 N -1.16 1.43 -0.07 3.68 -4.23 -1.26 -0.53 115.64 113.50 1iy8 s THR 68 Ca 0.21 -0.85 -0.03 0.00 -1.18 0.00 0.00 61.69 59.84 1iy8 s THR 68 Cb -0.12 -1.21 0.04 0.00 1.34 0.00 0.00 72.50 72.55 1iy8 s THR 68 CO 0.11 0.34 0.15 -0.89 -0.54 0.00 0.00 174.62 173.78 1iy8 s THR 69 N -0.51 -0.08 -0.18 3.99 2.01 -0.24 -4.96 115.64 115.67 1iy8 s THR 69 Ca 0.07 0.21 -0.24 0.00 0.31 0.00 0.00 61.69 62.03 1iy8 s THR 69 Cb -0.07 -0.25 -0.02 0.00 0.01 0.00 0.00 72.50 72.17 1iy8 s THR 69 CO -0.00 0.08 0.77 -0.69 -0.69 0.00 0.00 174.62 174.09 1iy8 s VAL 70 N 1.34 4.93 -0.22 3.82 1.01 -1.26 -2.38 120.40 127.64 1iy8 s VAL 70 Ca -0.07 1.49 -0.27 0.00 0.00 0.00 0.00 61.98 63.13 1iy8 s VAL 70 Cb -0.12 -4.08 0.09 0.00 0.00 0.00 0.00 36.38 32.28 1iy8 s VAL 70 CO -0.06 0.06 0.81 0.00 0.00 0.00 0.00 175.10 175.91 1iy8 s ALA 71 N 2.04 -1.84 -0.35 5.51 0.00 -0.33 -4.93 121.76 121.86 1iy8 s ALA 71 Ca 0.35 1.83 -0.16 0.00 0.00 0.00 0.00 51.96 53.98 1iy8 s ALA 71 Cb -0.16 -0.98 -0.01 0.00 0.00 0.00 0.00 23.12 21.96 1iy8 s ALA 71 CO 0.12 -0.32 0.40 0.34 0.00 0.00 0.00 175.76 176.30 1iy8 s ASP 72 N -0.07 6.21 0.38 0.00 -1.08 -1.26 -3.32 116.67 117.53 1iy8 s ASP 72 Ca -0.01 -0.21 0.27 0.00 -0.52 0.00 0.00 52.55 52.07 1iy8 s ASP 72 Cb -0.04 -2.21 1.35 0.00 -1.46 0.00 0.00 42.92 40.56 1iy8 s ASP 72 CO 0.01 -0.38 1.82 -0.37 0.52 0.00 0.00 175.17 176.77 1iy8 h VAL 73 N 5.56 0.00 -0.00 1.11 -1.51 -1.94 -2.11 116.25 117.36 1iy8 h VAL 73 Ca -0.29 -0.11 0.00 0.00 -1.23 0.00 0.00 66.70 65.07 1iy8 h VAL 73 Cb 1.14 0.79 0.00 0.00 -2.13 0.00 0.00 31.29 31.09 1iy8 h VAL 73 CO 0.71 0.00 -0.03 -1.54 -1.23 0.00 0.00 177.57 175.48 1iy8 n SER 74 N -2.46 0.06 -4.40 4.19 3.41 -1.26 -4.19 113.62 108.97 1iy8 n SER 74 Ca -0.01 0.11 -0.39 0.00 -0.26 0.00 0.00 58.87 58.33 1iy8 n SER 74 Cb 0.12 -0.34 -0.12 0.00 -0.26 0.00 0.00 64.21 63.61 1iy8 n SER 74 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1iy8 s ASP 75 N -2.78 5.51 0.30 4.04 -1.08 -0.79 -4.94 116.67 116.93 1iy8 s ASP 75 Ca 0.21 -0.70 0.02 0.00 -0.52 0.00 0.00 52.55 51.56 1iy8 s ASP 75 Cb 0.20 -1.98 0.59 0.00 -1.46 0.00 0.00 42.92 40.26 1iy8 s ASP 75 CO 0.51 -0.25 1.87 -0.08 0.52 0.00 0.00 175.17 177.74 1iy8 h GLU 76 N 8.35 0.93 -0.88 4.34 4.81 -1.85 -1.26 114.58 129.01 1iy8 h GLU 76 Ca -0.30 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 58.85 1iy8 h GLU 76 Cb 1.13 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 30.26 1iy8 h GLU 76 CO 0.63 0.62 0.47 0.00 -0.73 0.00 0.00 179.01 179.99 1iy8 h ALA 77 N 1.53 1.14 0.00 2.92 0.00 -1.94 -1.47 119.26 121.45 1iy8 h ALA 77 Ca 0.44 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1iy8 h ALA 77 Cb 0.41 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1iy8 h ALA 77 CO -0.20 0.66 -0.58 1.96 0.00 0.00 0.00 179.25 181.09 1iy8 h GLN 78 N 1.25 0.00 -0.20 0.00 4.20 -1.58 -1.94 115.11 116.84 1iy8 h GLN 78 Ca 0.31 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.96 1iy8 h GLN 78 Cb 0.06 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.83 1iy8 h GLN 78 CO -0.05 0.58 -0.11 0.28 -0.67 0.00 0.00 178.83 178.86 1iy8 h VAL 79 N 0.00 1.31 -0.35 -0.54 2.07 -0.78 -1.86 116.25 116.10 1iy8 h VAL 79 Ca -0.01 -1.19 -0.02 0.00 0.82 0.00 0.00 66.70 66.30 1iy8 h VAL 79 Cb 1.11 1.67 -0.02 0.00 -1.52 0.00 0.00 31.29 32.54 1iy8 h VAL 79 CO 0.08 0.36 0.15 -0.33 0.02 0.00 0.00 177.57 177.84 1iy8 h GLU 80 N 0.11 0.49 -0.49 1.57 5.08 -1.19 -2.20 114.58 117.96 1iy8 h GLU 80 Ca 0.04 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1iy8 h GLU 80 Cb 0.61 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 1iy8 h GLU 80 CO 0.03 0.41 0.11 0.00 -1.00 0.00 0.00 179.01 178.56 1iy8 h ALA 81 N 1.67 0.64 0.00 3.43 0.00 -1.00 -0.89 119.26 123.11 1iy8 h ALA 81 Ca 0.12 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1iy8 h ALA 81 Cb 0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1iy8 h ALA 81 CO -0.01 0.34 -0.65 0.10 0.00 0.00 0.00 179.25 179.03 1iy8 h TYR 82 N 0.67 0.00 -0.20 0.00 -0.00 -0.95 -0.70 116.97 115.78 1iy8 h TYR 82 Ca 0.15 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 58.76 1iy8 h TYR 82 Cb 0.34 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.07 1iy8 h TYR 82 CO 0.02 0.65 -0.34 0.28 -0.00 0.00 0.00 178.16 178.77 1iy8 h VAL 83 N 0.00 1.33 -0.59 -0.90 2.07 -1.29 -2.11 116.25 114.77 1iy8 h VAL 83 Ca -0.01 -1.56 -0.04 0.00 0.82 0.00 0.00 66.70 65.91 1iy8 h VAL 83 Cb 1.17 1.83 -0.03 0.00 -1.52 0.00 0.00 31.29 32.75 1iy8 h VAL 83 CO 0.08 0.48 0.20 0.74 0.02 0.00 0.00 177.57 179.10 1iy8 h THR 84 N 0.27 1.24 -0.85 2.57 2.02 -1.06 -1.61 112.91 115.48 1iy8 h THR 84 Ca 0.01 -0.78 0.02 0.00 0.77 0.00 0.00 66.41 66.43 1iy8 h THR 84 Cb 0.93 0.64 -0.04 0.00 -1.74 0.00 0.00 68.15 67.94 1iy8 h THR 84 CO 0.08 0.30 0.56 0.00 0.37 0.00 0.00 175.52 176.83 1iy8 h ALA 85 N 1.06 1.42 -0.19 6.16 0.00 -1.09 -0.67 119.26 125.95 1iy8 h ALA 85 Ca 0.19 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1iy8 h ALA 85 Cb 0.25 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1iy8 h ALA 85 CO -0.01 0.53 -0.07 1.15 0.00 0.00 0.00 179.25 180.84 1iy8 h THR 86 N 1.12 1.30 -0.03 0.00 2.02 -0.84 -2.57 112.91 113.91 1iy8 h THR 86 Ca 0.32 -1.10 -0.13 0.00 0.77 0.00 0.00 66.41 66.26 1iy8 h THR 86 Cb -0.08 1.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.93 1iy8 h THR 86 CO -0.08 0.33 -0.60 0.71 0.37 0.00 0.00 175.52 176.25 1iy8 h THR 87 N 0.10 1.41 -0.07 3.16 1.35 -1.07 0.09 112.91 117.87 1iy8 h THR 87 Ca 0.05 -2.01 -0.12 0.00 -0.55 0.00 0.00 66.41 63.78 1iy8 h THR 87 Cb 0.54 2.05 -0.01 0.00 -1.73 0.00 0.00 68.15 69.01 1iy8 h THR 87 CO 0.02 0.58 -0.48 -0.33 -0.25 0.00 0.00 175.52 175.07 1iy8 h GLU 88 N 0.08 0.18 0.09 4.72 5.08 -1.13 0.26 114.58 123.86 1iy8 h GLU 88 Ca -0.01 -0.10 -0.17 0.00 -1.00 0.00 0.00 59.36 58.09 1iy8 h GLU 88 Cb 1.08 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.34 1iy8 h GLU 88 CO 0.09 0.62 -0.83 -0.09 -1.00 0.00 0.00 179.01 177.80 1iy8 h ARG 89 N 0.14 0.19 0.00 2.33 9.65 -1.29 -3.41 114.38 122.00 1iy8 h ARG 89 Ca 0.01 -0.33 0.00 0.00 -1.10 0.00 0.00 59.98 58.56 1iy8 h ARG 89 Cb 0.90 0.12 0.00 0.00 -1.39 0.00 0.00 29.97 29.60 1iy8 h ARG 89 CO 0.07 1.16 -1.07 1.19 2.80 0.00 0.00 179.97 184.12 1iy8 n PHE 90 N -4.21 0.00 -0.68 2.20 3.72 0.00 -5.02 117.46 113.47 1iy8 n PHE 90 Ca -0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 1iy8 n PHE 90 Cb 0.75 -0.14 0.00 0.00 -0.94 0.00 0.00 39.48 39.15 1iy8 n PHE 90 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1iy8 n GLY 91 N 1.53 1.36 3.71 1.37 0.00 0.90 -4.94 105.19 109.13 1iy8 n GLY 91 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1iy8 n GLY 91 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1iy8 s ARG 92 N -0.09 0.92 -0.19 1.61 1.70 -1.26 -5.00 118.95 116.64 1iy8 s ARG 92 Ca 0.00 -0.51 -0.04 0.00 -0.47 0.00 0.00 55.73 54.71 1iy8 s ARG 92 Cb 0.00 0.32 0.06 0.00 -0.57 0.00 0.00 34.95 34.76 1iy8 s ARG 92 CO 0.00 -0.42 0.07 0.42 -1.08 0.00 0.00 175.30 174.29 1iy8 s ILE 93 N -2.99 0.17 -0.08 4.99 1.01 -1.26 -4.76 121.20 118.28 1iy8 s ILE 93 Ca 0.13 -0.39 0.08 0.00 0.00 0.00 0.00 60.65 60.46 1iy8 s ILE 93 Cb 0.01 -0.81 -0.24 0.00 0.01 0.00 0.00 42.46 41.43 1iy8 s ILE 93 CO 0.00 -0.30 0.53 0.47 0.00 0.00 0.00 174.94 175.64 1iy8 n ASP 94 N 5.18 1.17 -4.05 3.58 8.00 0.37 -4.80 116.55 126.00 1iy8 n ASP 94 Ca -0.07 0.32 -0.13 0.00 0.71 0.00 0.00 54.79 55.62 1iy8 n ASP 94 Cb 0.48 -0.21 -0.11 0.00 -0.02 0.00 0.00 41.12 41.25 1iy8 n ASP 94 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1iy8 s GLY 95 N -5.29 0.46 -0.08 0.44 0.00 -0.10 -1.68 107.32 101.07 1iy8 s GLY 95 Ca -0.10 -0.73 -0.03 0.00 0.00 0.00 0.00 44.72 43.86 1iy8 s GLY 95 CO 0.81 -0.78 0.07 -0.12 0.00 0.00 0.00 173.10 173.08 1iy8 s PHE 96 N -1.36 0.09 -0.58 1.90 5.36 -0.35 -0.87 117.98 122.17 1iy8 s PHE 96 Ca -0.11 0.11 -0.09 0.00 -0.96 0.00 0.00 56.93 55.88 1iy8 s PHE 96 Cb -0.10 -0.53 0.15 0.00 -0.34 0.00 0.00 43.02 42.20 1iy8 s PHE 96 CO 0.00 -0.29 0.46 0.12 -1.46 0.00 0.00 175.22 174.05 1iy8 s PHE 97 N 2.17 3.48 -1.17 10.12 5.36 0.17 -0.83 117.98 137.28 1iy8 s PHE 97 Ca 0.04 -2.05 -0.18 0.00 -0.96 0.00 0.00 56.93 53.78 1iy8 s PHE 97 Cb -0.13 -3.51 0.10 0.00 -0.34 0.00 0.00 43.02 39.13 1iy8 s PHE 97 CO -0.05 -0.96 1.52 1.21 -1.46 0.00 0.00 175.22 175.48 1iy8 s ASN 98 N 2.20 6.80 -0.01 6.13 3.84 -0.24 -1.85 114.94 131.81 1iy8 s ASN 98 Ca 0.10 -2.32 0.06 0.00 0.21 0.00 0.00 52.86 50.91 1iy8 s ASN 98 Cb -0.22 -2.51 -0.08 0.00 -0.55 0.00 0.00 41.25 37.89 1iy8 s ASN 98 CO -0.03 -1.12 0.15 -3.20 -2.79 0.00 0.00 177.10 170.11 1iy8 n ASN 99 N 7.59 2.94 -4.66 -4.21 5.15 -1.25 -1.52 115.26 119.30 1iy8 n ASN 99 Ca 0.39 -0.14 -0.42 0.00 -0.60 0.00 0.00 54.58 53.82 1iy8 n ASN 99 Cb 0.47 1.21 0.01 0.00 -0.53 0.00 0.00 39.78 40.93 1iy8 n ASN 99 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1iy8 n ALA 100 N -1.58 0.79 -3.61 5.20 0.00 -1.17 -4.81 120.51 115.34 1iy8 n ALA 100 Ca -0.01 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1iy8 n ALA 100 Cb 0.14 -2.18 -0.01 0.00 0.00 0.00 0.00 19.45 17.40 1iy8 n ALA 100 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1iy8 s GLY 101 N -0.56 -0.33 0.21 0.00 0.00 -1.26 -4.68 107.32 100.71 1iy8 s GLY 101 Ca 0.60 1.50 0.04 0.00 0.00 0.00 0.00 44.72 46.86 1iy8 s GLY 101 CO 0.59 0.44 -0.04 -0.26 0.00 0.00 0.00 173.10 173.82 1iy8 s ILE 102 N -2.04 1.16 -0.17 0.90 -4.36 -1.26 -5.04 121.20 110.38 1iy8 s ILE 102 Ca 0.13 -2.06 -0.23 0.00 -0.26 0.00 0.00 60.65 58.23 1iy8 s ILE 102 Cb 0.03 -2.20 -0.22 0.00 1.25 0.00 0.00 42.46 41.32 1iy8 s ILE 102 CO -0.04 -0.45 0.42 -0.08 0.24 0.00 0.00 174.94 175.02 1iy8 h GLU 103 N 2.55 0.03 0.00 0.37 4.81 -1.99 -3.47 114.58 116.88 1iy8 h GLU 103 Ca -0.38 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 1iy8 h GLU 103 Cb 1.21 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1iy8 h GLU 103 CO 0.64 1.03 0.00 0.41 -0.73 0.00 0.00 179.01 180.36 1iy8 n GLY 104 N 1.53 2.03 3.69 1.92 0.00 -1.26 -4.36 105.19 108.74 1iy8 n GLY 104 Ca -0.25 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.58 1iy8 n GLY 104 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1iy8 s LYS 105 N -3.72 4.28 0.31 1.61 2.20 -1.26 -4.97 119.74 118.19 1iy8 s LYS 105 Ca 0.00 2.00 -0.29 0.00 -0.36 0.00 0.00 55.97 57.32 1iy8 s LYS 105 Cb 0.00 -3.53 -0.10 0.00 -1.51 0.00 0.00 37.83 32.68 1iy8 s LYS 105 CO 0.00 -0.56 1.38 -0.65 -0.36 0.00 0.00 175.35 175.15 1iy8 s GLN 106 N 2.24 4.29 -0.26 4.03 -0.21 -1.26 -4.95 119.66 123.53 1iy8 s GLN 106 Ca 0.65 2.30 -0.29 0.00 0.02 0.00 0.00 55.36 58.03 1iy8 s GLN 106 Cb -0.33 -3.07 0.18 0.00 1.00 0.00 0.00 33.01 30.80 1iy8 s GLN 106 CO 0.27 -0.32 1.29 -0.80 -2.12 0.00 0.00 175.29 173.62 1iy8 s ASN 107 N -0.14 -0.10 0.88 5.90 0.01 -0.74 -5.03 114.94 115.72 1iy8 s ASN 107 Ca 0.53 0.11 -0.11 0.00 -0.71 0.00 0.00 52.86 52.68 1iy8 s ASN 107 Cb -0.41 0.08 0.12 0.00 0.41 0.00 0.00 41.25 41.45 1iy8 s ASN 107 CO 0.51 -0.09 1.10 -2.84 -1.51 0.00 0.00 177.10 174.27 1iy8 s PRO 108 N -1.01 1.36 0.24 -0.60 0.02 -1.26 -4.04 135.00 129.71 1iy8 s PRO 108 Ca 0.07 1.14 -0.05 0.00 0.02 0.00 0.00 61.00 62.17 1iy8 s PRO 108 Cb -0.01 -1.80 0.45 0.00 0.02 0.00 0.00 34.50 33.16 1iy8 s PRO 108 CO -0.06 -2.26 1.70 1.15 -0.33 0.00 0.00 177.00 177.19 1iy8 h THR 109 N -1.58 0.56 0.00 0.99 2.02 -2.00 -0.95 112.91 111.95 1iy8 h THR 109 Ca -0.47 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 66.61 1iy8 h THR 109 Cb 1.26 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.90 1iy8 h THR 109 CO 0.50 0.06 0.00 1.05 0.37 0.00 0.00 175.52 177.49 1iy8 h GLU 110 N 0.31 0.00 0.00 6.66 4.11 -2.04 -2.88 114.58 120.74 1iy8 h GLU 110 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.84 1iy8 h GLU 110 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1iy8 h GLU 110 CO -0.47 0.00 -0.03 -1.13 0.07 0.00 0.00 179.01 177.44 1iy8 n SER 111 N -2.39 1.80 0.10 3.06 3.41 -0.45 -4.77 113.62 114.38 1iy8 n SER 111 Ca 0.00 -2.29 -0.02 0.00 -0.26 0.00 0.00 58.87 56.31 1iy8 n SER 111 Cb 0.15 -0.16 0.23 0.00 -0.26 0.00 0.00 64.21 64.17 1iy8 n SER 111 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1iy8 h PHE 112 N 0.00 0.25 -0.63 7.33 3.04 -1.09 -3.45 116.94 122.38 1iy8 h PHE 112 Ca 0.00 -0.07 0.00 0.00 3.98 0.00 0.00 57.97 61.88 1iy8 h PHE 112 Cb 0.78 -0.05 0.00 0.00 2.56 0.00 0.00 35.95 39.24 1iy8 h PHE 112 CO 0.01 0.61 -0.16 0.25 -2.02 0.00 0.00 178.31 177.00 1iy8 n THR 113 N -4.02 -1.54 -0.17 4.41 -2.24 -1.26 -4.38 114.28 105.08 1iy8 n THR 113 Ca -0.02 0.38 -0.04 0.00 -2.27 0.00 0.00 64.05 62.11 1iy8 n THR 113 Cb 0.48 -0.54 0.15 0.00 -2.10 0.00 0.00 70.33 68.33 1iy8 n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1iy8 h ALA 114 N 0.24 1.15 -0.29 6.98 0.00 -1.97 -1.81 119.26 123.55 1iy8 h ALA 114 Ca 0.00 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.72 1iy8 h ALA 114 Cb 0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1iy8 h ALA 114 CO 0.00 0.58 0.13 0.00 0.00 0.00 0.00 179.25 179.97 1iy8 h ALA 115 N 1.28 0.35 -0.15 0.00 0.00 -1.99 0.67 119.26 119.41 1iy8 h ALA 115 Ca 0.20 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.96 1iy8 h ALA 115 Cb 0.30 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1iy8 h ALA 115 CO -0.00 -0.26 -0.57 1.49 0.00 0.00 0.00 179.25 179.92 1iy8 h GLU 116 N 0.29 0.48 -0.06 0.00 4.57 -1.73 -1.90 114.58 116.23 1iy8 h GLU 116 Ca 0.12 -0.31 -0.00 0.00 -1.18 0.00 0.00 59.36 57.99 1iy8 h GLU 116 Cb 0.05 0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.68 1iy8 h GLU 116 CO -0.09 0.91 0.03 0.35 -1.18 0.00 0.00 179.01 179.03 1iy8 h PHE 117 N 0.36 0.08 -0.67 0.92 3.57 -0.97 -1.93 116.94 118.30 1iy8 h PHE 117 Ca 0.00 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 1iy8 h PHE 117 Cb 1.10 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.78 1iy8 h PHE 117 CO 0.04 0.14 0.34 -0.44 -2.23 0.00 0.00 178.31 176.17 1iy8 h ASP 118 N -0.00 0.84 0.19 0.41 3.32 -0.82 -1.56 116.42 118.80 1iy8 h ASP 118 Ca 0.02 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 1iy8 h ASP 118 Cb 0.09 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.43 1iy8 h ASP 118 CO -0.00 0.70 -0.09 0.50 -1.72 0.00 0.00 179.24 178.63 1iy8 h LYS 119 N 0.94 -0.25 -0.85 3.56 3.64 -1.07 -1.18 116.57 121.36 1iy8 h LYS 119 Ca 0.24 0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.61 1iy8 h LYS 119 Cb 0.06 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 1iy8 h LYS 119 CO -0.03 -0.04 0.43 0.28 -2.27 0.00 0.00 179.45 177.82 1iy8 h VAL 120 N -0.42 1.26 -0.59 2.00 2.07 -1.23 -2.78 116.25 116.56 1iy8 h VAL 120 Ca -0.03 -0.69 -0.10 0.00 0.82 0.00 0.00 66.70 66.70 1iy8 h VAL 120 Cb 0.32 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 1iy8 h VAL 120 CO 0.04 0.30 -0.03 0.58 0.02 0.00 0.00 177.57 178.48 1iy8 h VAL 121 N 1.21 1.27 -0.64 2.57 2.07 -1.23 -0.21 116.25 121.28 1iy8 h VAL 121 Ca 0.30 -1.19 -0.01 0.00 0.82 0.00 0.00 66.70 66.61 1iy8 h VAL 121 Cb 0.09 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1iy8 h VAL 121 CO -0.04 0.43 0.34 0.77 0.02 0.00 0.00 177.57 179.09 1iy8 h SER 122 N 0.96 0.79 0.00 0.57 4.64 -0.95 0.00 113.55 119.57 1iy8 h SER 122 Ca 0.16 -0.06 -0.15 0.00 -0.47 0.00 0.00 61.79 61.27 1iy8 h SER 122 Cb 0.60 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.47 1iy8 h SER 122 CO 0.04 0.64 -0.97 0.40 -0.87 0.00 0.00 176.83 176.07 1iy8 h ILE 123 N 0.89 0.72 -0.05 0.95 2.04 -1.41 -2.39 117.51 118.26 1iy8 h ILE 123 Ca 0.23 -1.87 -0.14 0.00 1.00 0.00 0.00 64.86 64.08 1iy8 h ILE 123 Cb 0.03 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 1iy8 h ILE 123 CO -0.04 0.24 -0.61 0.78 0.00 0.00 0.00 178.15 178.52 1iy8 h ASN 124 N -1.00 0.19 0.00 1.72 4.21 -1.12 -3.05 115.58 116.53 1iy8 h ASN 124 Ca -0.23 -0.11 -0.17 0.00 1.21 0.00 0.00 56.30 57.00 1iy8 h ASN 124 Cb 1.06 -0.06 -0.02 0.00 -1.12 0.00 0.00 38.32 38.17 1iy8 h ASN 124 CO -0.14 0.76 -1.39 -0.11 -1.29 0.00 0.00 177.43 175.26 1iy8 n LEU 125 N -3.85 1.40 -0.30 1.61 7.94 -0.51 -4.25 117.00 119.05 1iy8 n LEU 125 Ca -0.02 0.23 -0.05 0.00 -1.11 0.00 0.00 56.01 55.06 1iy8 n LEU 125 Cb 0.62 -0.55 0.08 0.00 0.53 0.00 0.00 43.42 44.10 1iy8 n LEU 125 CO 0.44 0.01 1.09 -0.09 -1.11 0.00 0.00 177.39 177.72 1iy8 h ARG 126 N -0.63 1.20 -0.95 1.96 2.43 -1.11 -1.49 114.38 115.79 1iy8 h ARG 126 Ca -0.25 -0.19 0.02 0.00 -0.81 0.00 0.00 59.98 58.74 1iy8 h ARG 126 Cb 1.06 -0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 30.35 1iy8 h ARG 126 CO -0.15 0.94 0.63 0.78 -1.51 0.00 0.00 179.97 180.66 1iy8 h GLY 127 N 1.19 1.35 1.10 2.80 0.00 -1.31 -0.47 103.07 107.72 1iy8 h GLY 127 Ca 0.28 -0.49 -0.13 0.00 0.00 0.00 0.00 47.33 46.99 1iy8 h GLY 127 CO -0.03 0.46 -0.22 -2.08 0.00 0.00 0.00 176.54 174.67 1iy8 h VAL 128 N 1.26 1.27 0.10 4.60 2.07 -1.60 -2.16 116.25 121.79 1iy8 h VAL 128 Ca 0.36 -1.39 -0.00 0.00 0.82 0.00 0.00 66.70 66.48 1iy8 h VAL 128 Cb -0.11 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1iy8 h VAL 128 CO -0.09 0.48 -0.05 0.15 0.02 0.00 0.00 177.57 178.08 1iy8 h PHE 129 N 0.82 -0.12 -0.90 1.57 3.57 -0.72 -1.73 116.94 119.43 1iy8 h PHE 129 Ca 0.10 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.65 1iy8 h PHE 129 Cb 0.81 0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.53 1iy8 h PHE 129 CO 0.05 -0.01 0.58 -0.07 -2.23 0.00 0.00 178.31 176.63 1iy8 h LEU 130 N -0.20 0.93 -0.23 0.59 3.38 -1.09 0.14 115.31 118.84 1iy8 h LEU 130 Ca -0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1iy8 h LEU 130 Cb 0.16 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1iy8 h LEU 130 CO 0.02 0.61 0.15 1.23 0.09 0.00 0.00 178.44 180.54 1iy8 h GLY 131 N 1.07 0.32 0.99 0.83 0.00 -1.19 -2.22 103.07 102.87 1iy8 h GLY 131 Ca 0.38 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.57 1iy8 h GLY 131 CO -0.15 0.11 0.27 1.41 0.00 0.00 0.00 176.54 178.18 1iy8 h LEU 132 N 0.30 0.78 -0.79 3.11 3.38 -0.57 -0.73 115.31 120.79 1iy8 h LEU 132 Ca 0.08 -0.14 0.08 0.00 0.09 0.00 0.00 57.88 57.99 1iy8 h LEU 132 Cb -0.03 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.45 1iy8 h LEU 132 CO -0.02 0.71 0.46 -0.08 0.09 0.00 0.00 178.44 179.60 1iy8 h GLU 133 N 0.81 0.79 0.15 1.13 4.81 -0.43 -1.02 114.58 120.82 1iy8 h GLU 133 Ca 0.20 -0.05 -0.23 0.00 -0.13 0.00 0.00 59.36 59.16 1iy8 h GLU 133 Cb 0.14 -0.18 0.02 0.00 0.63 0.00 0.00 28.75 29.36 1iy8 h GLU 133 CO -0.02 0.52 -1.04 0.87 -0.73 0.00 0.00 179.01 178.61 1iy8 h LYS 134 N 0.81 0.31 -0.21 1.92 1.79 -1.25 -3.36 116.57 116.58 1iy8 h LYS 134 Ca 0.36 -0.53 -0.19 0.00 -2.18 0.00 0.00 60.65 58.11 1iy8 h LYS 134 Cb 0.26 0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.11 1iy8 h LYS 134 CO -0.21 1.25 -0.65 0.28 -1.08 0.00 0.00 179.45 179.05 1iy8 h VAL 135 N -0.31 1.29 0.00 0.50 2.07 -1.09 -3.23 116.25 115.49 1iy8 h VAL 135 Ca -0.20 -1.86 -0.02 0.00 0.82 0.00 0.00 66.70 65.44 1iy8 h VAL 135 Cb 1.73 1.82 -0.00 0.00 -1.52 0.00 0.00 31.29 33.31 1iy8 h VAL 135 CO 0.14 0.59 -0.10 -0.07 0.02 0.00 0.00 177.57 178.16 1iy8 h LEU 136 N 0.55 0.00 -0.25 2.57 3.38 -1.37 -1.01 115.31 119.18 1iy8 h LEU 136 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1iy8 h LEU 136 Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 1iy8 h LEU 136 CO 0.13 0.10 -0.01 0.50 0.09 0.00 0.00 178.44 179.25 1iy8 h LYS 137 N 0.00 0.44 -0.66 1.13 3.64 -1.70 -0.71 116.57 118.70 1iy8 h LYS 137 Ca -0.00 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.20 1iy8 h LYS 137 Cb 0.20 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 1iy8 h LYS 137 CO 0.01 0.62 0.27 0.82 -2.27 0.00 0.00 179.45 178.90 1iy8 h ILE 138 N 0.21 1.24 -0.32 2.00 2.04 -1.43 -2.06 117.51 119.19 1iy8 h ILE 138 Ca 0.07 -0.74 -0.13 0.00 1.00 0.00 0.00 64.86 65.05 1iy8 h ILE 138 Cb 0.42 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1iy8 h ILE 138 CO 0.01 0.30 -0.33 0.24 0.00 0.00 0.00 178.15 178.37 1iy8 h MET 139 N 0.94 0.71 -0.64 2.37 2.86 -1.11 -1.79 114.93 118.26 1iy8 h MET 139 Ca 0.22 -0.33 -0.04 0.00 -2.06 0.00 0.00 59.70 57.49 1iy8 h MET 139 Cb 0.20 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.83 1iy8 h MET 139 CO -0.02 0.94 0.26 -0.09 1.06 0.00 0.00 176.91 179.06 1iy8 h ARG 140 N 0.59 0.96 -0.15 1.72 2.43 -0.92 0.83 114.38 119.84 1iy8 h ARG 140 Ca 0.06 -0.17 -0.05 0.00 -0.81 0.00 0.00 59.98 59.01 1iy8 h ARG 140 Cb 0.85 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 1iy8 h ARG 140 CO 0.07 0.81 -0.13 0.93 -1.51 0.00 0.00 179.97 180.14 1iy8 h GLU 141 N 0.90 0.24 0.00 0.20 5.08 -1.19 -2.27 114.58 117.54 1iy8 h GLU 141 Ca 0.21 -0.06 -0.18 0.00 -1.00 0.00 0.00 59.36 58.34 1iy8 h GLU 141 Cb 0.21 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 1iy8 h GLU 141 CO -0.02 0.38 -0.84 1.96 -1.00 0.00 0.00 179.01 179.49 1iy8 h GLN 142 N 0.23 0.00 0.00 2.33 4.20 -0.66 -3.47 115.11 117.73 1iy8 h GLN 142 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1iy8 h GLN 142 Cb 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1iy8 h GLN 142 CO 0.02 0.84 0.00 0.41 -0.67 0.00 0.00 178.83 179.43 1iy8 n GLY 143 N 0.93 0.50 3.51 3.46 0.00 0.22 -5.02 105.19 108.79 1iy8 n GLY 143 Ca -0.00 -0.80 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 1iy8 n GLY 143 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1iy8 s SER 144 N -2.73 -0.42 0.00 1.61 1.04 -0.97 -4.71 113.70 107.51 1iy8 s SER 144 Ca 0.00 0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.58 1iy8 s SER 144 Cb 0.00 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1iy8 s SER 144 CO 0.00 -0.61 0.00 0.61 0.98 0.00 0.00 173.24 174.22 1iy8 n GLY 145 N 0.05 3.90 3.12 7.32 0.00 -1.26 -4.58 105.19 113.74 1iy8 n GLY 145 Ca -0.11 -0.54 -0.26 0.00 0.00 0.00 0.00 46.02 45.11 1iy8 n GLY 145 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1iy8 s MET 146 N -2.07 1.78 -0.02 1.61 -1.94 -0.68 -1.99 119.30 116.00 1iy8 s MET 146 Ca 0.00 -0.58 0.04 0.00 -1.71 0.00 0.00 55.69 53.44 1iy8 s MET 146 Cb 0.00 -1.52 -0.01 0.00 2.01 0.00 0.00 34.83 35.31 1iy8 s MET 146 CO 0.00 0.21 -0.13 0.08 -0.01 0.00 0.00 175.02 175.16 1iy8 s VAL 147 N 0.14 1.06 -0.13 -6.03 1.01 0.34 -1.22 120.40 115.57 1iy8 s VAL 147 Ca -0.06 -0.55 -0.00 0.00 0.00 0.00 0.00 61.98 61.37 1iy8 s VAL 147 Cb -0.12 -0.90 0.03 0.00 0.00 0.00 0.00 36.38 35.39 1iy8 s VAL 147 CO 0.03 0.31 -0.08 -0.69 0.00 0.00 0.00 175.10 174.66 1iy8 s VAL 148 N -0.13 1.13 -0.14 2.92 1.01 -0.01 -1.48 120.40 123.70 1iy8 s VAL 148 Ca 0.02 -0.43 -0.08 0.00 0.00 0.00 0.00 61.98 61.49 1iy8 s VAL 148 Cb -0.07 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 1iy8 s VAL 148 CO 0.00 0.32 0.15 0.20 0.00 0.00 0.00 175.10 175.77 1iy8 s ASN 149 N 1.66 6.35 -0.44 3.32 0.01 -0.01 -1.08 114.94 124.75 1iy8 s ASN 149 Ca 0.04 0.41 -0.23 0.00 -0.71 0.00 0.00 52.86 52.37 1iy8 s ASN 149 Cb -0.13 -2.08 0.02 0.00 0.41 0.00 0.00 41.25 39.47 1iy8 s ASN 149 CO -0.08 0.33 0.77 -0.89 -1.51 0.00 0.00 177.10 175.72 1iy8 s THR 150 N -0.59 4.68 0.00 1.60 2.01 -0.58 -1.84 115.64 120.92 1iy8 s THR 150 Ca 0.13 0.46 0.00 0.00 0.31 0.00 0.00 61.69 62.59 1iy8 s THR 150 Cb -0.12 -4.29 0.00 0.00 0.01 0.00 0.00 72.50 68.10 1iy8 s THR 150 CO 0.02 -0.66 0.00 0.00 -0.69 0.00 0.00 174.62 173.29 1iy8 n ALA 151 N 6.63 0.00 0.00 7.40 0.00 0.07 -4.94 120.51 129.67 1iy8 n ALA 151 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1iy8 n ALA 151 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1iy8 n ALA 151 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1iy8 n SER 152 N 0.00 0.00 0.30 0.00 2.88 -1.23 -4.59 113.62 110.98 1iy8 n SER 152 Ca 0.00 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.73 1iy8 n SER 152 Cb 0.00 0.00 0.86 0.00 -0.75 0.00 0.00 64.21 64.32 1iy8 n SER 152 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 1iy8 h VAL 153 N 0.15 0.00 0.00 2.46 -1.51 -1.53 0.21 116.25 116.03 1iy8 h VAL 153 Ca 0.00 -0.34 0.00 0.00 -1.23 0.00 0.00 66.70 65.13 1iy8 h VAL 153 Cb 0.00 1.34 0.00 0.00 -2.13 0.00 0.00 31.29 30.50 1iy8 h VAL 153 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 1iy8 n GLY 154 N -0.33 -0.98 0.48 5.19 0.00 -1.26 -0.78 105.19 107.51 1iy8 n GLY 154 Ca -0.01 -0.16 0.11 0.00 0.00 0.00 0.00 46.02 45.97 1iy8 n GLY 154 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iy8 n GLY 155 N 0.82 -0.02 0.00 -0.02 0.00 0.74 -4.36 105.19 102.34 1iy8 n GLY 155 Ca 0.18 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1iy8 n GLY 155 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1iy8 n ILE 156 N -0.06 0.00 -4.12 -0.61 -5.35 -0.90 -4.16 119.36 104.16 1iy8 n ILE 156 Ca 0.10 -0.15 -0.11 0.00 -0.27 0.00 0.00 62.75 62.32 1iy8 n ILE 156 Cb 0.45 1.24 -0.09 0.00 -1.74 0.00 0.00 39.64 39.51 1iy8 n ILE 156 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1iy8 s ARG 157 N -0.20 1.23 -0.30 6.28 1.81 0.04 -5.12 118.95 122.70 1iy8 s ARG 157 Ca 0.00 -1.46 -0.11 0.00 -1.72 0.00 0.00 55.73 52.44 1iy8 s ARG 157 Cb 0.00 0.32 -0.04 0.00 -0.45 0.00 0.00 34.95 34.79 1iy8 s ARG 157 CO 0.00 -0.43 0.19 0.20 -0.68 0.00 0.00 175.30 174.58 1iy8 s GLY 158 N -3.09 1.92 -0.13 -3.53 0.00 -1.26 -4.40 107.32 96.83 1iy8 s GLY 158 Ca 0.31 -1.20 0.04 0.00 0.00 0.00 0.00 44.72 43.87 1iy8 s GLY 158 CO 0.08 0.68 0.32 1.39 0.00 0.00 0.00 173.10 175.57 1iy8 n ILE 159 N 5.05 1.63 0.00 0.90 5.41 -1.26 -5.10 119.36 126.00 1iy8 n ILE 159 Ca -0.14 -0.71 0.00 0.00 1.00 0.00 0.00 62.75 62.90 1iy8 n ILE 159 Cb 0.51 -1.31 0.00 0.00 -0.71 0.00 0.00 39.64 38.13 1iy8 n ILE 159 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1iy8 n GLY 160 N 1.87 1.45 2.42 7.39 0.00 -1.26 -4.96 105.19 112.10 1iy8 n GLY 160 Ca -0.30 -1.57 -0.15 0.00 0.00 0.00 0.00 46.02 44.01 1iy8 n GLY 160 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1iy8 n ASN 161 N -0.16 -4.76 -2.88 1.61 5.03 -1.26 -4.92 115.26 107.92 1iy8 n ASN 161 Ca 0.00 0.33 -0.13 0.00 0.87 0.00 0.00 54.58 55.66 1iy8 n ASN 161 Cb 0.00 -3.60 0.01 0.00 -1.02 0.00 0.00 39.78 35.16 1iy8 n ASN 161 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1iy8 n GLN 162 N -2.56 1.07 -0.22 3.52 10.64 -1.26 -1.78 117.38 126.80 1iy8 n GLN 162 Ca -0.15 -3.27 -0.04 0.00 -1.83 0.00 0.00 57.00 51.71 1iy8 n GLN 162 Cb 0.50 -1.41 0.02 0.00 -0.86 0.00 0.00 30.24 28.49 1iy8 n GLN 162 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.06 176.00 1iy8 h SER 163 N 2.99 -1.09 -0.19 2.61 0.02 -1.91 0.18 113.55 116.15 1iy8 h SER 163 Ca -0.02 0.23 0.01 0.00 -0.84 0.00 0.00 61.79 61.16 1iy8 h SER 163 Cb 1.09 0.56 -0.01 0.00 0.14 0.00 0.00 62.40 64.18 1iy8 h SER 163 CO 0.49 -0.29 0.11 1.23 -1.14 0.00 0.00 176.83 177.23 1iy8 h GLY 164 N -0.13 0.26 0.94 -3.77 0.00 -1.91 -1.16 103.07 97.30 1iy8 h GLY 164 Ca 0.26 -0.09 -0.06 0.00 0.00 0.00 0.00 47.33 47.44 1iy8 h GLY 164 CO -0.70 0.08 0.00 -1.82 0.00 0.00 0.00 176.54 174.10 1iy8 h TYR 165 N 0.23 0.74 -0.47 5.60 3.20 -1.59 -1.10 116.97 123.59 1iy8 h TYR 165 Ca 0.07 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.81 1iy8 h TYR 165 Cb -0.01 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.05 1iy8 h TYR 165 CO -0.08 0.76 0.26 0.00 -1.64 0.00 0.00 178.16 177.47 1iy8 h ALA 166 N 0.88 0.60 -0.18 1.82 0.00 -0.58 0.11 119.26 121.91 1iy8 h ALA 166 Ca 0.11 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1iy8 h ALA 166 Cb 0.46 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1iy8 h ALA 166 CO 0.02 0.12 0.01 0.00 0.00 0.00 0.00 179.25 179.40 1iy8 h ALA 167 N 1.11 0.24 -0.21 0.00 0.00 -1.15 -1.77 119.26 117.49 1iy8 h ALA 167 Ca 0.17 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1iy8 h ALA 167 Cb 0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1iy8 h ALA 167 CO -0.03 -0.06 0.06 0.00 0.00 0.00 0.00 179.25 179.22 1iy8 h ALA 168 N 0.79 0.27 -0.10 0.00 0.00 -1.05 -1.25 119.26 117.92 1iy8 h ALA 168 Ca 0.05 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1iy8 h ALA 168 Cb 0.36 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1iy8 h ALA 168 CO 0.01 -0.10 -0.41 0.87 0.00 0.00 0.00 179.25 179.63 1iy8 h LYS 169 N 0.16 0.23 -0.28 0.00 1.79 -0.80 -0.62 116.57 117.05 1iy8 h LYS 169 Ca 0.07 -0.11 -0.12 0.00 -2.18 0.00 0.00 60.65 58.31 1iy8 h LYS 169 Cb 0.24 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.88 1iy8 h LYS 169 CO -0.00 0.60 -0.32 0.45 -1.08 0.00 0.00 179.45 179.10 1iy8 h HIS 170 N 0.19 0.70 -0.64 -1.35 3.86 -1.26 -2.69 115.15 113.96 1iy8 h HIS 170 Ca 0.02 -0.18 -0.03 0.00 -1.16 0.00 0.00 60.37 59.02 1iy8 h HIS 170 Cb 0.80 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 29.08 1iy8 h HIS 170 CO 0.01 0.85 0.28 0.78 0.86 0.00 0.00 177.93 180.71 1iy8 h GLY 171 N 1.02 0.98 1.33 2.45 0.00 -0.35 -1.88 103.07 106.62 1iy8 h GLY 171 Ca 0.06 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 46.88 1iy8 h GLY 171 CO 0.07 0.46 0.24 -2.08 0.00 0.00 0.00 176.54 175.23 1iy8 h VAL 172 N 0.91 1.21 -0.56 4.60 2.07 -0.82 -0.68 116.25 122.98 1iy8 h VAL 172 Ca 0.22 -0.65 -0.09 0.00 0.82 0.00 0.00 66.70 67.00 1iy8 h VAL 172 Cb 0.14 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1iy8 h VAL 172 CO -0.02 0.26 -0.01 0.58 0.02 0.00 0.00 177.57 178.40 1iy8 h VAL 173 N 0.85 1.26 -0.53 2.57 2.07 -1.16 -1.21 116.25 120.11 1iy8 h VAL 173 Ca 0.20 -1.12 -0.04 0.00 0.82 0.00 0.00 66.70 66.57 1iy8 h VAL 173 Cb 0.16 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1iy8 h VAL 173 CO -0.02 0.40 0.19 1.23 0.02 0.00 0.00 177.57 179.40 1iy8 h GLY 174 N 0.99 0.87 1.06 2.17 0.00 -0.56 -0.99 103.07 106.61 1iy8 h GLY 174 Ca 0.16 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 1iy8 h GLY 174 CO 0.03 0.46 0.30 1.41 0.00 0.00 0.00 176.54 178.73 1iy8 h LEU 175 N 0.72 1.10 0.15 3.11 3.38 -0.96 -0.74 115.31 122.07 1iy8 h LEU 175 Ca 0.18 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1iy8 h LEU 175 Cb 0.23 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 1iy8 h LEU 175 CO -0.01 0.99 -0.08 0.74 0.09 0.00 0.00 178.44 180.17 1iy8 h THR 176 N 1.15 0.84 -0.25 0.22 2.02 -0.80 -0.73 112.91 115.36 1iy8 h THR 176 Ca 0.26 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.42 1iy8 h THR 176 Cb 0.24 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1iy8 h THR 176 CO -0.02 0.00 0.08 0.03 0.37 0.00 0.00 175.52 175.98 1iy8 h ARG 177 N -0.21 0.39 -0.05 6.66 3.08 -1.01 -1.19 114.38 122.05 1iy8 h ARG 177 Ca -0.02 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 1iy8 h ARG 177 Cb 0.17 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 1iy8 h ARG 177 CO 0.03 0.45 0.02 -0.97 -1.07 0.00 0.00 179.97 178.43 1iy8 h ASN 178 N 0.24 0.07 -0.33 7.04 -1.24 -1.12 -2.59 115.58 117.66 1iy8 h ASN 178 Ca 0.08 -0.20 -0.07 0.00 0.71 0.00 0.00 56.30 56.82 1iy8 h ASN 178 Cb 0.23 -0.02 -0.02 0.00 0.73 0.00 0.00 38.32 39.24 1iy8 h ASN 178 CO -0.00 0.25 -0.03 0.28 -1.29 0.00 0.00 177.43 176.64 1iy8 h SER 179 N -0.12 0.68 -0.51 1.15 0.02 -1.16 -2.76 113.55 110.85 1iy8 h SER 179 Ca 0.02 -0.16 -0.04 0.00 -0.84 0.00 0.00 61.79 60.76 1iy8 h SER 179 Cb 0.20 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 1iy8 h SER 179 CO -0.00 0.77 0.18 0.00 -1.14 0.00 0.00 176.83 176.64 1iy8 h ALA 180 N 1.31 1.27 0.00 3.77 0.00 -1.14 -0.61 119.26 123.86 1iy8 h ALA 180 Ca 0.13 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1iy8 h ALA 180 Cb 0.45 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1iy8 h ALA 180 CO 0.02 0.52 -0.44 0.28 0.00 0.00 0.00 179.25 179.63 1iy8 h VAL 181 N 0.81 1.28 0.18 0.00 2.07 -1.19 -2.00 116.25 117.40 1iy8 h VAL 181 Ca 0.19 -1.53 -0.25 0.00 0.82 0.00 0.00 66.70 65.93 1iy8 h VAL 181 Cb 0.22 1.83 0.03 0.00 -1.52 0.00 0.00 31.29 31.85 1iy8 h VAL 181 CO -0.01 0.43 -1.11 -0.33 0.02 0.00 0.00 177.57 176.57 1iy8 h GLU 182 N 0.00 0.38 -0.02 1.57 5.08 -1.16 -3.39 114.58 117.04 1iy8 h GLU 182 Ca -0.00 -0.65 0.00 0.00 -1.00 0.00 0.00 59.36 57.71 1iy8 h GLU 182 Cb 0.80 0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1iy8 h GLU 182 CO 0.06 1.31 -0.40 0.66 -1.00 0.00 0.00 179.01 179.64 1iy8 n TYR 183 N -3.96 0.00 0.13 4.33 4.02 -0.30 -4.45 117.16 116.94 1iy8 n TYR 183 Ca -0.16 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 57.85 1iy8 n TYR 183 Cb 0.93 -0.02 0.63 0.00 -0.02 0.00 0.00 39.34 40.86 1iy8 n TYR 183 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1iy8 h GLY 184 N 4.85 0.08 2.00 2.72 0.00 -1.49 -1.82 103.07 109.41 1iy8 h GLY 184 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1iy8 h GLY 184 CO 0.00 0.02 0.00 0.07 0.00 0.00 0.00 176.54 176.63 1iy8 h ARG 185 N 0.07 0.00 -0.01 4.80 0.11 -1.86 -1.72 114.38 115.77 1iy8 h ARG 185 Ca 0.11 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.19 1iy8 h ARG 185 Cb 0.36 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.44 1iy8 h ARG 185 CO -0.01 0.00 -0.18 0.66 0.10 0.00 0.00 179.97 180.54 1iy8 n TYR 186 N -2.56 0.00 -0.13 4.08 4.01 -0.68 -4.91 117.16 116.97 1iy8 n TYR 186 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1iy8 n TYR 186 Cb 0.14 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 1iy8 n TYR 186 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1iy8 n GLY 187 N 1.31 0.61 3.76 2.72 0.00 -0.65 -4.32 105.19 108.62 1iy8 n GLY 187 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1iy8 n GLY 187 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iy8 s ILE 188 N -2.34 3.69 -0.07 -0.61 1.01 -1.24 -4.59 121.20 117.05 1iy8 s ILE 188 Ca 0.00 1.66 0.05 0.00 0.00 0.00 0.00 60.65 62.36 1iy8 s ILE 188 Cb 0.00 -4.04 -0.00 0.00 0.01 0.00 0.00 42.46 38.43 1iy8 s ILE 188 CO 0.00 0.36 -0.22 -0.13 0.00 0.00 0.00 174.94 174.95 1iy8 s ARG 189 N -1.47 2.48 -0.12 2.79 1.81 -0.84 -4.00 118.95 119.60 1iy8 s ARG 189 Ca 0.45 -0.80 -0.00 0.00 -1.72 0.00 0.00 55.73 53.65 1iy8 s ARG 189 Cb -0.29 -2.02 0.02 0.00 -0.45 0.00 0.00 34.95 32.21 1iy8 s ARG 189 CO 0.37 0.27 -0.08 0.42 -0.68 0.00 0.00 175.30 175.60 1iy8 s ILE 190 N 0.08 1.09 0.23 1.52 1.01 -1.26 -0.50 121.20 123.37 1iy8 s ILE 190 Ca -0.09 -0.33 0.00 0.00 0.00 0.00 0.00 60.65 60.24 1iy8 s ILE 190 Cb -0.15 -1.10 -0.05 0.00 0.01 0.00 0.00 42.46 41.18 1iy8 s ILE 190 CO 0.05 0.38 0.10 0.20 0.00 0.00 0.00 174.94 175.67 1iy8 s ASN 191 N 1.68 0.82 0.06 3.58 0.01 -0.55 -0.81 114.94 119.73 1iy8 s ASN 191 Ca 0.05 -1.36 0.05 0.00 -0.71 0.00 0.00 52.86 50.89 1iy8 s ASN 191 Cb -0.13 0.23 -0.03 0.00 0.41 0.00 0.00 41.25 41.74 1iy8 s ASN 191 CO -0.08 -0.75 -0.15 0.00 -1.51 0.00 0.00 177.10 174.61 1iy8 s ALA 192 N -3.89 1.21 0.08 0.60 0.00 -0.19 -0.83 121.76 118.74 1iy8 s ALA 192 Ca 0.37 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.40 1iy8 s ALA 192 Cb 0.07 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 1iy8 s ALA 192 CO 0.12 0.19 0.01 0.96 0.00 0.00 0.00 175.76 177.05 1iy8 s ILE 193 N -1.14 4.12 -0.63 0.00 -4.36 -0.77 -0.91 121.20 117.51 1iy8 s ILE 193 Ca -0.00 -0.91 0.05 0.00 -0.26 0.00 0.00 60.65 59.53 1iy8 s ILE 193 Cb -0.09 -2.96 0.18 0.00 1.25 0.00 0.00 42.46 40.84 1iy8 s ILE 193 CO 0.02 0.15 0.49 0.00 0.24 0.00 0.00 174.94 175.84 1iy8 n ALA 194 N 0.63 3.34 -1.76 2.27 0.00 0.14 -0.75 120.51 124.38 1iy8 n ALA 194 Ca -0.11 -4.23 -0.37 0.00 0.00 0.00 0.00 53.44 48.74 1iy8 n ALA 194 Cb 0.52 -0.95 0.01 0.00 0.00 0.00 0.00 19.45 19.03 1iy8 n ALA 194 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1iy8 s PRO 195 N -1.24 3.36 0.00 0.00 0.04 -1.26 -1.70 135.00 134.20 1iy8 s PRO 195 Ca 0.28 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.20 1iy8 s PRO 195 Cb -0.00 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.34 1iy8 s PRO 195 CO -0.16 -0.91 0.00 0.41 0.04 0.00 0.00 177.00 176.38 1iy8 n GLY 196 N 0.50 0.92 3.57 0.56 0.00 -0.47 -1.95 105.19 108.31 1iy8 n GLY 196 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1iy8 n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iy8 s ALA 197 N -2.72 2.66 -0.14 4.61 0.00 -1.26 -4.95 121.76 119.96 1iy8 s ALA 197 Ca 0.00 -2.33 -0.03 0.00 0.00 0.00 0.00 51.96 49.60 1iy8 s ALA 197 Cb 0.00 -4.58 -0.03 0.00 0.00 0.00 0.00 23.12 18.52 1iy8 s ALA 197 CO 0.00 -3.82 -0.05 0.42 0.00 0.00 0.00 175.76 172.31 1iy8 s ILE 198 N 5.94 3.80 -0.74 0.00 -1.09 -1.26 -0.20 121.20 127.65 1iy8 s ILE 198 Ca 0.53 -0.40 -0.27 0.00 -2.23 0.00 0.00 60.65 58.29 1iy8 s ILE 198 Cb 0.00 -2.65 0.02 0.00 -1.58 0.00 0.00 42.46 38.25 1iy8 s ILE 198 CO -0.02 0.51 1.43 0.86 -1.23 0.00 0.00 174.94 176.49 1iy8 s TRP 199 N 0.21 2.16 0.29 3.97 -0.11 -0.33 -4.61 118.94 120.52 1iy8 s TRP 199 Ca -0.03 0.08 0.02 0.00 1.22 0.00 0.00 56.10 57.39 1iy8 s TRP 199 Cb -0.14 -4.51 -0.04 0.00 -1.50 0.00 0.00 33.47 27.28 1iy8 s TRP 199 CO 0.03 -2.11 0.13 0.95 -4.62 0.00 0.00 176.95 171.33 1iy8 s THR 200 N 6.47 0.44 0.40 5.86 -4.23 -1.26 -4.51 115.64 118.80 1iy8 s THR 200 Ca 0.43 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 59.04 1iy8 s THR 200 Cb -0.08 -2.56 0.31 0.00 1.34 0.00 0.00 72.50 71.51 1iy8 s THR 200 CO 0.14 0.00 1.97 -0.65 -0.54 0.00 0.00 174.62 175.54 1iy8 h PRO 201 N 2.27 0.56 -0.38 3.99 0.11 -1.99 -0.48 132.00 136.09 1iy8 h PRO 201 Ca -0.36 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.66 1iy8 h PRO 201 Cb 1.25 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1iy8 h PRO 201 CO 0.56 0.37 -0.01 1.98 -0.21 0.00 0.00 178.00 180.69 1iy8 h MET 202 N 0.58 0.67 -0.29 1.05 4.05 -1.96 -1.44 114.93 117.58 1iy8 h MET 202 Ca 0.30 -0.22 -0.13 0.00 -0.28 0.00 0.00 59.70 59.37 1iy8 h MET 202 Cb 0.41 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.14 1iy8 h MET 202 CO -0.10 0.78 -0.36 0.28 0.23 0.00 0.00 176.91 177.74 1iy8 h VAL 203 N 0.49 1.29 -0.42 -5.77 2.07 -1.67 0.23 116.25 112.47 1iy8 h VAL 203 Ca 0.11 -1.52 -0.00 0.00 0.82 0.00 0.00 66.70 66.11 1iy8 h VAL 203 Cb 0.48 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1iy8 h VAL 203 CO 0.02 0.49 0.25 -0.08 0.02 0.00 0.00 177.57 178.27 1iy8 h GLU 204 N 0.56 0.57 -0.03 1.57 4.81 -0.98 -1.54 114.58 119.53 1iy8 h GLU 204 Ca 0.05 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.14 1iy8 h GLU 204 Cb 0.88 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1iy8 h GLU 204 CO 0.08 0.43 -0.42 -0.97 -0.73 0.00 0.00 179.01 177.40 1iy8 h ASN 205 N 0.55 0.07 -0.68 1.04 -0.73 -1.02 -2.67 115.58 112.14 1iy8 h ASN 205 Ca 0.15 -0.03 -0.06 0.00 1.87 0.00 0.00 56.30 58.23 1iy8 h ASN 205 Cb 0.01 -0.02 -0.03 0.00 0.27 0.00 0.00 38.32 38.55 1iy8 h ASN 205 CO -0.03 0.48 0.19 -1.28 -0.37 0.00 0.00 177.43 176.43 1iy8 h SER 206 N 0.06 1.01 0.56 1.15 0.87 -0.24 -1.77 113.55 115.18 1iy8 h SER 206 Ca 0.00 -0.22 -0.08 0.00 -1.23 0.00 0.00 61.79 60.26 1iy8 h SER 206 Cb 0.76 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 1iy8 h SER 206 CO 0.06 0.97 -0.40 0.24 -0.53 0.00 0.00 176.83 177.16 1iy8 h MET 207 N 1.01 0.00 -0.35 2.24 2.86 -1.09 -1.22 114.93 118.38 1iy8 h MET 207 Ca 0.22 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.74 1iy8 h MET 207 Cb 0.33 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 1iy8 h MET 207 CO -0.00 0.40 -0.25 -0.22 1.06 0.00 0.00 176.91 177.90 1iy8 h LYS 208 N 0.00 0.70 -0.32 1.72 3.64 -1.08 -2.22 116.57 119.00 1iy8 h LYS 208 Ca -0.00 -0.29 -0.11 0.00 -1.27 0.00 0.00 60.65 58.98 1iy8 h LYS 208 Cb 0.78 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.57 1iy8 h LYS 208 CO 0.05 0.88 -0.24 1.96 -2.27 0.00 0.00 179.45 179.83 1iy8 h GLN 209 N 0.61 0.73 -0.79 1.90 4.20 -0.71 -1.49 115.11 119.55 1iy8 h GLN 209 Ca 0.08 -0.36 0.05 0.00 0.06 0.00 0.00 58.65 58.48 1iy8 h GLN 209 Cb 0.74 -0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.47 1iy8 h GLN 209 CO 0.06 0.97 0.49 1.25 -0.67 0.00 0.00 178.83 180.93 1iy8 h LEU 210 N 0.49 0.78 -6.09 1.46 5.85 -1.06 -3.37 115.31 113.38 1iy8 h LEU 210 Ca 0.06 0.01 -0.32 0.00 0.84 0.00 0.00 57.88 58.47 1iy8 h LEU 210 Cb 0.80 -0.15 -0.28 0.00 0.37 0.00 0.00 40.66 41.40 1iy8 h LEU 210 CO 0.06 0.52 -0.66 -0.62 -0.34 0.00 0.00 178.44 177.40 1iy8 s ASP 211 N -5.76 0.37 0.48 1.25 -1.08 -0.85 -5.01 116.67 106.07 1iy8 s ASP 211 Ca -0.13 -1.71 0.18 0.00 -0.52 0.00 0.00 52.55 50.38 1iy8 s ASP 211 Cb 0.17 0.85 1.19 0.00 -1.46 0.00 0.00 42.92 43.67 1iy8 s ASP 211 CO 0.78 -0.20 2.00 -0.65 0.52 0.00 0.00 175.17 177.62 1iy8 h PRO 212 N 6.51 0.21 -0.03 4.34 0.11 -1.45 -1.91 132.00 139.79 1iy8 h PRO 212 Ca 0.08 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 66.03 1iy8 h PRO 212 Cb 1.06 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 1iy8 h PRO 212 CO 0.18 0.14 -0.67 0.93 -0.21 0.00 0.00 178.00 178.37 1iy8 h GLU 213 N 0.22 0.13 -1.55 1.05 4.39 -1.95 -3.40 114.58 113.47 1iy8 h GLU 213 Ca 0.25 -0.10 -0.39 0.00 0.34 0.00 0.00 59.36 59.46 1iy8 h GLU 213 Cb 0.69 0.02 -0.28 0.00 -0.10 0.00 0.00 28.75 29.08 1iy8 h GLU 213 CO -0.05 0.75 -0.77 -1.71 -1.16 0.00 0.00 179.01 176.07 1iy8 n ASN 214 N -3.79 -1.69 0.24 1.42 2.85 -0.78 -5.00 115.26 108.50 1iy8 n ASN 214 Ca -0.02 -2.72 0.07 0.00 -0.11 0.00 0.00 54.58 51.80 1iy8 n ASN 214 Cb 0.66 0.51 0.57 0.00 1.24 0.00 0.00 39.78 42.76 1iy8 n ASN 214 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1iy8 h PRO 215 N 4.97 0.00 -0.11 1.20 0.13 -1.61 -2.42 132.00 134.16 1iy8 h PRO 215 Ca 0.12 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.05 1iy8 h PRO 215 Cb 0.99 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.12 1iy8 h PRO 215 CO 0.26 0.16 -0.73 -0.09 -0.23 0.00 0.00 178.00 177.37 1iy8 h ARG 216 N 0.00 0.52 -0.58 0.86 2.43 -1.90 -1.79 114.38 113.92 1iy8 h ARG 216 Ca -0.00 -0.42 -0.05 0.00 -0.81 0.00 0.00 59.98 58.70 1iy8 h ARG 216 Cb 0.30 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 1iy8 h ARG 216 CO 0.02 1.05 0.16 -0.22 -1.51 0.00 0.00 179.97 179.46 1iy8 h LYS 217 N 0.36 0.92 -0.31 0.20 3.64 -1.88 -1.39 116.57 118.11 1iy8 h LYS 217 Ca -0.03 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.14 1iy8 h LYS 217 Cb 1.31 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 1iy8 h LYS 217 CO 0.13 0.84 0.19 0.00 -2.27 0.00 0.00 179.45 178.35 1iy8 h ALA 218 N 1.04 0.39 -0.70 5.00 0.00 -1.31 -0.72 119.26 122.95 1iy8 h ALA 218 Ca 0.18 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1iy8 h ALA 218 Cb 0.32 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1iy8 h ALA 218 CO -0.00 -0.13 0.44 0.00 0.00 0.00 0.00 179.25 179.56 1iy8 h ALA 219 N 1.09 0.89 -0.46 0.00 0.00 -1.14 -1.21 119.26 118.44 1iy8 h ALA 219 Ca 0.11 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1iy8 h ALA 219 Cb -0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1iy8 h ALA 219 CO -0.02 0.35 0.06 0.93 0.00 0.00 0.00 179.25 180.57 1iy8 h GLU 220 N 0.96 0.77 -0.51 0.00 4.39 -0.96 -2.96 114.58 116.26 1iy8 h GLU 220 Ca 0.25 -0.22 -0.10 0.00 0.34 0.00 0.00 59.36 59.63 1iy8 h GLU 220 Cb -0.06 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 1iy8 h GLU 220 CO -0.05 0.80 -0.09 1.49 -1.16 0.00 0.00 179.01 179.99 1iy8 h GLU 221 N 0.63 0.94 -0.78 2.33 4.81 -0.94 -2.98 114.58 118.59 1iy8 h GLU 221 Ca 0.14 -0.33 -0.02 0.00 -0.13 0.00 0.00 59.36 59.02 1iy8 h GLU 221 Cb 0.41 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.69 1iy8 h GLU 221 CO 0.01 0.99 0.40 0.35 -0.73 0.00 0.00 179.01 180.03 1iy8 h PHE 222 N 0.85 1.10 0.00 0.92 3.57 -1.16 -3.03 116.94 119.18 1iy8 h PHE 222 Ca 0.14 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1iy8 h PHE 222 Cb 0.63 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.02 1iy8 h PHE 222 CO 0.04 0.78 -0.32 1.51 -2.23 0.00 0.00 178.31 178.08 1iy8 n ILE 223 N -4.33 0.05 -0.20 1.41 0.13 -1.13 -4.25 119.36 111.03 1iy8 n ILE 223 Ca 0.08 -0.03 0.12 0.00 -1.10 0.00 0.00 62.75 61.82 1iy8 n ILE 223 Cb 0.12 -0.06 0.42 0.00 -0.84 0.00 0.00 39.64 39.28 1iy8 n ILE 223 CO 0.00 0.00 0.00 1.56 2.80 0.00 0.00 176.55 180.91 1iy8 h GLN 224 N 0.00 0.59 0.00 9.51 1.08 -1.39 -1.94 115.11 122.95 1iy8 h GLN 224 Ca 0.00 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1iy8 h GLN 224 Cb 0.53 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 1iy8 h GLN 224 CO 0.00 0.39 -0.18 1.55 -0.95 0.00 0.00 178.83 179.64 1iy8 n VAL 225 N -4.51 0.11 -1.99 -0.54 3.14 -1.26 -4.90 118.33 108.38 1iy8 n VAL 225 Ca 0.14 -0.06 -0.41 0.00 -2.96 0.00 0.00 64.34 61.04 1iy8 n VAL 225 Cb 0.42 -0.30 -0.02 0.00 -1.06 0.00 0.00 33.84 32.88 1iy8 n VAL 225 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 1iy8 s ASN 226 N -3.32 6.63 0.46 6.55 3.84 -0.73 -4.91 114.94 123.45 1iy8 s ASN 226 Ca 0.12 2.67 0.14 0.00 0.21 0.00 0.00 52.86 56.00 1iy8 s ASN 226 Cb 0.17 -2.62 1.09 0.00 -0.55 0.00 0.00 41.25 39.34 1iy8 s ASN 226 CO 0.60 -0.73 2.03 -0.65 -2.79 0.00 0.00 177.10 175.55 1iy8 h PRO 227 N 5.37 0.30 -0.00 0.43 0.11 -1.89 -0.99 132.00 135.33 1iy8 h PRO 227 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1iy8 h PRO 227 Cb 1.22 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1iy8 h PRO 227 CO 0.80 0.20 -0.17 0.43 -0.21 0.00 0.00 178.00 179.06 1iy8 n SER 228 N -4.47 0.19 -1.46 -2.05 7.64 -1.22 -4.93 113.62 107.31 1iy8 n SER 228 Ca 0.06 0.19 -0.19 0.00 1.01 0.00 0.00 58.87 59.94 1iy8 n SER 228 Cb 0.28 -0.23 -0.08 0.00 -1.01 0.00 0.00 64.21 63.17 1iy8 n SER 228 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1iy8 n LYS 229 N -1.47 -1.50 -3.71 1.43 4.76 -0.38 -4.94 118.16 112.36 1iy8 n LYS 229 Ca 0.07 1.17 -0.10 0.00 -2.87 0.00 0.00 58.31 56.58 1iy8 n LYS 229 Cb 0.33 -5.56 -0.05 0.00 -1.84 0.00 0.00 35.03 27.91 1iy8 n LYS 229 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 1iy8 s ARG 230 N -3.61 1.16 0.54 1.97 1.70 -1.26 -4.98 118.95 114.47 1iy8 s ARG 230 Ca 0.00 -0.81 -0.16 0.00 -0.47 0.00 0.00 55.73 54.29 1iy8 s ARG 230 Cb 0.00 0.47 -0.07 0.00 -0.57 0.00 0.00 34.95 34.78 1iy8 s ARG 230 CO 0.00 -0.46 1.00 0.71 -1.08 0.00 0.00 175.30 175.47 1iy8 s TYR 231 N -3.84 3.37 0.50 5.89 2.02 -1.26 -4.97 117.35 119.05 1iy8 s TYR 231 Ca 0.06 1.46 -0.02 0.00 -0.37 0.00 0.00 57.07 58.21 1iy8 s TYR 231 Cb 0.01 -2.83 0.00 0.00 -0.40 0.00 0.00 41.96 38.74 1iy8 s TYR 231 CO -0.08 -0.56 0.75 0.20 -1.57 0.00 0.00 175.55 174.29 1iy8 s GLY 232 N -3.11 1.59 0.20 0.71 0.00 0.72 -4.91 107.32 102.52 1iy8 s GLY 232 Ca 0.60 -0.94 0.09 0.00 0.00 0.00 0.00 44.72 44.47 1iy8 s GLY 232 CO 0.35 -0.73 -0.10 -0.54 0.00 0.00 0.00 173.10 172.08 1iy8 s GLU 233 N -4.71 2.03 0.25 2.90 0.41 -1.26 -1.19 118.70 117.13 1iy8 s GLU 233 Ca 0.50 -1.34 -0.03 0.00 -0.41 0.00 0.00 54.97 53.69 1iy8 s GLU 233 Cb -0.10 -2.11 0.49 0.00 -1.78 0.00 0.00 34.13 30.63 1iy8 s GLU 233 CO 0.40 0.42 1.72 0.00 -0.49 0.00 0.00 175.26 177.31 1iy8 h ALA 234 N 2.74 1.09 0.00 5.21 0.00 -1.95 -0.74 119.26 125.61 1iy8 h ALA 234 Ca -0.46 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 1iy8 h ALA 234 Cb 1.21 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1iy8 h ALA 234 CO 0.55 -0.24 -0.00 -1.35 0.00 0.00 0.00 179.25 178.21 1iy8 h PRO 235 N 0.42 0.00 0.00 0.00 0.11 -1.95 -0.38 132.00 130.20 1iy8 h PRO 235 Ca 0.43 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.49 1iy8 h PRO 235 Cb 0.69 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.79 1iy8 h PRO 235 CO -0.43 0.00 -0.25 0.93 -0.21 0.00 0.00 178.00 178.04 1iy8 h GLU 236 N 0.00 0.00 0.13 1.05 5.08 -1.54 -1.75 114.58 117.55 1iy8 h GLU 236 Ca -0.00 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.12 1iy8 h GLU 236 Cb 0.02 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.28 1iy8 h GLU 236 CO 0.00 0.25 -1.17 0.82 -1.00 0.00 0.00 179.01 177.91 1iy8 h ILE 237 N 0.00 1.24 -0.75 3.13 1.08 -1.12 -3.31 117.51 117.79 1iy8 h ILE 237 Ca -0.00 -2.47 0.10 0.00 -0.39 0.00 0.00 64.86 62.10 1iy8 h ILE 237 Cb 0.91 2.93 -0.05 0.00 -3.07 0.00 0.00 36.82 37.55 1iy8 h ILE 237 CO 0.03 0.71 0.49 0.00 -0.69 0.00 0.00 178.15 178.70 1iy8 h ALA 238 N 0.01 1.85 -0.47 1.87 0.00 -1.20 -0.74 119.26 120.58 1iy8 h ALA 238 Ca -0.23 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 1iy8 h ALA 238 Cb 1.73 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1iy8 h ALA 238 CO 0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 179.25 179.35 1iy8 h ALA 239 N 1.62 1.11 -0.07 0.00 0.00 -1.43 -0.13 119.26 120.37 1iy8 h ALA 239 Ca 0.35 -0.26 -0.23 0.00 0.00 0.00 0.00 54.91 54.76 1iy8 h ALA 239 Cb 0.50 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.11 1iy8 h ALA 239 CO -0.13 0.57 -0.88 0.28 0.00 0.00 0.00 179.25 179.09 1iy8 h VAL 240 N 0.73 1.31 -0.49 0.00 2.07 -1.27 -2.73 116.25 115.87 1iy8 h VAL 240 Ca 0.14 -2.15 -0.09 0.00 0.82 0.00 0.00 66.70 65.42 1iy8 h VAL 240 Cb 0.45 2.19 -0.02 0.00 -1.52 0.00 0.00 31.29 32.39 1iy8 h VAL 240 CO 0.02 0.67 -0.04 0.58 0.02 0.00 0.00 177.57 178.81 1iy8 h VAL 241 N 0.41 1.25 -0.77 2.57 2.07 -1.02 -1.24 116.25 119.52 1iy8 h VAL 241 Ca -0.08 -1.10 -0.04 0.00 0.82 0.00 0.00 66.70 66.30 1iy8 h VAL 241 Cb 1.51 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 32.18 1iy8 h VAL 241 CO 0.17 0.39 0.32 0.00 0.02 0.00 0.00 177.57 178.46 1iy8 h ALA 242 N 1.17 1.11 0.09 1.67 0.00 -0.99 -1.18 119.26 121.13 1iy8 h ALA 242 Ca 0.14 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1iy8 h ALA 242 Cb 0.53 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1iy8 h ALA 242 CO 0.03 0.64 -0.04 0.35 0.00 0.00 0.00 179.25 180.22 1iy8 h PHE 243 N 1.11 -0.11 0.00 0.00 3.57 -1.12 -2.59 116.94 117.79 1iy8 h PHE 243 Ca 0.26 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.75 1iy8 h PHE 243 Cb 0.19 0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.97 1iy8 h PHE 243 CO 0.02 0.06 0.00 -0.07 -2.23 0.00 0.00 178.31 176.09 1iy8 h LEU 244 N -0.27 0.00 -1.33 0.59 3.38 -0.93 -2.39 115.31 114.37 1iy8 h LEU 244 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1iy8 h LEU 244 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1iy8 h LEU 244 CO 0.02 0.00 -0.25 0.18 0.09 0.00 0.00 178.44 178.48 1iy8 n LEU 245 N -2.42 2.28 -5.03 1.67 4.77 -0.47 -4.69 117.00 113.12 1iy8 n LEU 245 Ca 0.01 -0.86 -0.19 0.00 -0.03 0.00 0.00 56.01 54.94 1iy8 n LEU 245 Cb 0.18 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.32 1iy8 n LEU 245 CO 0.18 0.41 0.31 -0.94 -1.33 0.00 0.00 177.39 176.01 1iy8 s SER 246 N -2.10 5.22 0.39 -1.43 1.04 -0.90 -4.81 113.70 111.12 1iy8 s SER 246 Ca 0.20 -0.75 0.28 0.00 0.48 0.00 0.00 55.95 56.17 1iy8 s SER 246 Cb 0.17 0.08 1.26 0.00 0.10 0.00 0.00 66.02 67.63 1iy8 s SER 246 CO 0.42 -1.22 1.84 0.44 0.98 0.00 0.00 173.24 175.70 1iy8 h ASP 247 N 0.27 0.00 0.53 7.02 3.45 -1.86 -2.52 116.42 123.31 1iy8 h ASP 247 Ca -0.32 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.14 1iy8 h ASP 247 Cb 1.29 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.06 1iy8 h ASP 247 CO 0.42 0.00 0.00 0.44 -1.57 0.00 0.00 179.24 178.53 1iy8 h ASP 248 N 0.00 0.00 -0.62 6.45 3.32 -1.94 -1.89 116.42 121.73 1iy8 h ASP 248 Ca 0.00 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.87 1iy8 h ASP 248 Cb 0.31 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.75 1iy8 h ASP 248 CO 0.00 0.00 0.20 0.00 -1.72 0.00 0.00 179.24 177.72 1iy8 n ALA 249 N -2.06 4.33 0.28 3.45 0.00 -0.95 -4.71 120.51 120.86 1iy8 n ALA 249 Ca -0.01 -2.45 0.17 0.00 0.00 0.00 0.00 53.44 51.15 1iy8 n ALA 249 Cb 0.19 -1.11 0.92 0.00 0.00 0.00 0.00 19.45 19.45 1iy8 n ALA 249 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1iy8 h SER 250 N 2.31 0.00 0.00 0.00 4.64 -1.51 -1.77 113.55 117.22 1iy8 h SER 250 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1iy8 h SER 250 Cb 2.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.22 1iy8 h SER 250 CO 0.63 0.00 -0.03 0.00 -0.87 0.00 0.00 176.83 176.56 1iy8 n TYR 251 N -2.76 0.00 -3.54 4.77 9.36 -1.26 -4.99 117.16 118.74 1iy8 n TYR 251 Ca -0.02 -0.58 -0.38 0.00 3.32 0.00 0.00 57.90 60.24 1iy8 n TYR 251 Cb 0.15 -0.08 -0.10 0.00 -0.63 0.00 0.00 39.34 38.68 1iy8 n TYR 251 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1iy8 s VAL 252 N -1.44 5.28 -0.07 2.97 1.01 -0.67 -5.07 120.40 122.41 1iy8 s VAL 252 Ca 0.10 0.29 -0.15 0.00 0.00 0.00 0.00 61.98 62.23 1iy8 s VAL 252 Cb 0.09 -3.57 0.03 0.00 0.00 0.00 0.00 36.38 32.93 1iy8 s VAL 252 CO 0.01 0.24 0.35 0.21 0.00 0.00 0.00 175.10 175.91 1iy8 s ASN 253 N 1.58 -0.29 -2.10 3.32 2.47 -1.26 -4.64 114.94 114.02 1iy8 s ASN 253 Ca 0.10 0.39 0.00 0.00 0.42 0.00 0.00 52.86 53.77 1iy8 s ASN 253 Cb -0.15 0.51 0.00 0.00 -1.45 0.00 0.00 41.25 40.16 1iy8 s ASN 253 CO 0.10 -0.32 0.00 0.00 -3.72 0.00 0.00 177.10 173.16 1iy8 n ALA 254 N 1.95 -0.38 -2.70 1.71 0.00 0.01 -4.98 120.51 116.12 1iy8 n ALA 254 Ca -0.18 0.30 -0.21 0.00 0.00 0.00 0.00 53.44 53.35 1iy8 n ALA 254 Cb 0.57 -2.07 -0.01 0.00 0.00 0.00 0.00 19.45 17.94 1iy8 n ALA 254 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1iy8 s THR 255 N -2.81 4.79 -0.16 0.00 -4.23 -1.26 -4.71 115.64 107.25 1iy8 s THR 255 Ca 0.00 -0.81 0.01 0.00 -1.18 0.00 0.00 61.69 59.71 1iy8 s THR 255 Cb 0.00 -3.71 0.02 0.00 1.34 0.00 0.00 72.50 70.15 1iy8 s THR 255 CO 0.00 -0.34 -0.18 -0.69 -0.54 0.00 0.00 174.62 172.86 1iy8 s VAL 256 N -2.18 1.88 -0.37 2.29 1.01 -1.26 -1.02 120.40 120.75 1iy8 s VAL 256 Ca 0.40 -0.84 -0.07 0.00 0.00 0.00 0.00 61.98 61.47 1iy8 s VAL 256 Cb -0.09 -1.71 0.06 0.00 0.00 0.00 0.00 36.38 34.63 1iy8 s VAL 256 CO 0.32 0.51 0.16 -0.69 0.00 0.00 0.00 175.10 175.41 1iy8 s VAL 257 N 1.24 3.90 0.31 2.92 1.01 -0.09 -4.94 120.40 124.75 1iy8 s VAL 257 Ca 0.02 -1.28 -0.28 0.00 0.00 0.00 0.00 61.98 60.44 1iy8 s VAL 257 Cb -0.14 -3.30 -0.09 0.00 0.00 0.00 0.00 36.38 32.85 1iy8 s VAL 257 CO -0.10 -0.32 1.13 -2.84 0.00 0.00 0.00 175.10 172.97 1iy8 s PRO 258 N 1.39 4.49 -0.54 2.72 0.02 -1.26 -0.69 135.00 141.13 1iy8 s PRO 258 Ca 0.01 1.83 0.05 0.00 0.02 0.00 0.00 61.00 62.91 1iy8 s PRO 258 Cb -0.21 -3.05 0.18 0.00 0.02 0.00 0.00 34.50 31.44 1iy8 s PRO 258 CO 0.02 0.06 0.44 -0.89 -0.33 0.00 0.00 177.00 176.31 1iy8 n ILE 259 N 0.89 0.20 -2.01 2.83 5.41 -0.69 -4.86 119.36 121.14 1iy8 n ILE 259 Ca 0.00 -4.17 0.01 0.00 1.00 0.00 0.00 62.75 59.59 1iy8 n ILE 259 Cb 0.45 -1.92 0.01 0.00 -0.71 0.00 0.00 39.64 37.47 1iy8 n ILE 259 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1iy8 n ASP 260 N 2.24 0.22 0.00 4.38 3.85 -1.26 -1.36 116.55 124.61 1iy8 n ASP 260 Ca 0.25 -2.06 0.00 0.00 -0.71 0.00 0.00 54.79 52.27 1iy8 n ASP 260 Cb 0.43 -0.22 0.00 0.00 -1.35 0.00 0.00 41.12 39.97 1iy8 n ASP 260 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1iy8 n GLY 261 N -0.02 0.50 0.00 6.12 0.00 -1.26 -3.01 105.19 107.52 1iy8 n GLY 261 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1iy8 n GLY 261 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iy8 n GLY 262 N -1.88 0.64 0.28 -0.02 0.00 -1.26 -3.37 105.19 99.57 1iy8 n GLY 262 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1iy8 n GLY 262 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1iy8 h GLN 263 N 3.72 0.61 0.00 1.61 4.15 -1.93 -2.82 115.11 120.44 1iy8 h GLN 263 Ca 0.00 -0.14 -0.03 0.00 0.77 0.00 0.00 58.65 59.26 1iy8 h GLN 263 Cb 0.00 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 27.60 1iy8 h GLN 263 CO 0.00 0.63 -0.13 0.66 -1.93 0.00 0.00 178.83 178.06 1iy8 h SER 264 N 0.58 0.00 0.74 -0.69 4.64 -1.96 -2.54 113.55 114.32 1iy8 h SER 264 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1iy8 h SER 264 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1iy8 h SER 264 CO 0.01 0.13 -0.71 0.00 -0.87 0.00 0.00 176.83 175.39 1iy8 n ALA 265 N -2.21 3.07 -1.92 5.18 0.00 -1.08 -4.91 120.51 118.64 1iy8 n ALA 265 Ca -0.01 -0.29 -0.37 0.00 0.00 0.00 0.00 53.44 52.77 1iy8 n ALA 265 Cb 0.31 -1.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.57 1iy8 n ALA 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iy8 s ALA 266 N -3.16 3.32 -2.00 0.00 0.00 -0.96 -5.18 121.76 113.78 1iy8 s ALA 266 Ca 0.06 0.38 0.31 0.00 0.00 0.00 0.00 51.96 52.71 1iy8 s ALA 266 Cb 0.14 -3.02 1.86 0.00 0.00 0.00 0.00 23.12 22.10 1iy8 s ALA 266 CO 0.74 0.25 2.19 0.98 0.00 0.00 0.00 175.76 179.91