#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yi8 n ARG 22 N 0.00 0.00 -2.19 0.00 1.74 -1.26 -4.71 116.66 110.24 1yi8 n ARG 22 Ca 0.00 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.69 1yi8 n ARG 22 Cb 0.00 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.42 1yi8 n ARG 22 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1yi8 s PRO 23 N 0.00 4.15 -0.15 5.56 0.04 -1.26 -4.63 135.00 138.70 1yi8 s PRO 23 Ca 0.00 2.03 -0.25 0.00 0.04 0.00 0.00 61.00 62.82 1yi8 s PRO 23 Cb 0.00 -2.84 -0.02 0.00 0.04 0.00 0.00 34.50 31.68 1yi8 s PRO 23 CO 0.00 -0.30 0.81 0.50 0.04 0.00 0.00 177.00 178.05 1yi8 s ARG 24 N -2.09 4.32 -0.13 4.56 3.52 -1.26 -2.17 118.95 125.69 1yi8 s ARG 24 Ca 0.54 1.00 -0.03 0.00 -0.13 0.00 0.00 55.73 57.10 1yi8 s ARG 24 Cb -0.35 -3.55 -0.03 0.00 -1.56 0.00 0.00 34.95 29.45 1yi8 s ARG 24 CO 0.46 -0.27 -0.02 0.08 -0.81 0.00 0.00 175.30 174.74 1yi8 s VAL 25 N 1.93 4.05 -0.08 7.11 1.01 -0.16 -1.37 120.40 132.90 1yi8 s VAL 25 Ca 0.38 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 62.08 1yi8 s VAL 25 Cb -0.17 -2.75 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 1yi8 s VAL 25 CO 0.14 0.52 -0.17 -0.22 0.00 0.00 0.00 175.10 175.37 1yi8 s LEU 26 N -0.01 2.54 0.29 3.92 2.96 -0.50 -0.99 118.68 126.89 1yi8 s LEU 26 Ca 0.02 -0.33 -0.03 0.00 -0.22 0.00 0.00 54.13 53.58 1yi8 s LEU 26 Cb -0.13 -1.52 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 1yi8 s LEU 26 CO 0.02 0.26 0.37 0.42 -1.32 0.00 0.00 176.35 176.11 1yi8 s THR 27 N -0.23 0.00 0.00 3.68 -4.23 -0.41 -3.99 115.64 110.46 1yi8 s THR 27 Ca 0.00 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 58.80 1yi8 s THR 27 Cb -0.13 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.20 1yi8 s THR 27 CO 0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 1yi8 n GLY 28 N -0.48 -0.11 3.05 3.99 0.00 -1.26 -0.27 105.19 110.12 1yi8 n GLY 28 Ca 0.02 -1.00 -0.13 0.00 0.00 0.00 0.00 46.02 44.91 1yi8 n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yi8 s ASP 29 N 0.00 -0.23 -0.10 1.61 1.01 -0.59 -4.92 116.67 113.45 1yi8 s ASP 29 Ca 0.00 0.47 -0.30 0.00 0.71 0.00 0.00 52.55 53.43 1yi8 s ASP 29 Cb 0.00 0.39 -0.02 0.00 1.01 0.00 0.00 42.92 44.31 1yi8 s ASP 29 CO 0.00 -0.13 1.12 0.00 0.21 0.00 0.00 175.17 176.37 1yi8 s ARG 30 N 0.88 4.35 -0.82 8.23 1.70 -1.26 -2.18 118.95 129.84 1yi8 s ARG 30 Ca -0.06 1.54 -0.25 0.00 -0.47 0.00 0.00 55.73 56.49 1yi8 s ARG 30 Cb -0.08 -3.58 -0.03 0.00 -0.57 0.00 0.00 34.95 30.70 1yi8 s ARG 30 CO -0.05 -0.45 1.84 -2.14 -1.08 0.00 0.00 175.30 173.42 1yi8 s PRO 31 N 2.38 2.71 0.00 3.89 0.02 -1.26 -4.71 135.00 138.03 1yi8 s PRO 31 Ca 0.52 -0.12 0.00 0.00 0.02 0.00 0.00 61.00 61.42 1yi8 s PRO 31 Cb -0.21 -4.86 0.00 0.00 0.02 0.00 0.00 34.50 29.45 1yi8 s PRO 31 CO 0.18 -3.02 0.00 2.41 -0.33 0.00 0.00 177.00 176.24 1yi8 n THR 32 N 7.52 0.00 -3.86 0.99 -1.04 -1.26 -4.38 114.28 112.25 1yi8 n THR 32 Ca 0.32 -0.35 0.01 0.00 -2.04 0.00 0.00 64.05 61.99 1yi8 n THR 32 Cb 0.49 0.97 0.00 0.00 -1.82 0.00 0.00 70.33 69.97 1yi8 n THR 32 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1yi8 n GLY 33 N 0.80 0.58 3.82 3.41 0.00 -1.26 -4.92 105.19 107.62 1yi8 n GLY 33 Ca 0.00 -0.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 1yi8 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yi8 s ALA 34 N -1.23 3.16 0.66 4.61 0.00 -1.26 -4.64 121.76 123.06 1yi8 s ALA 34 Ca 0.07 0.32 -0.13 0.00 0.00 0.00 0.00 51.96 52.22 1yi8 s ALA 34 Cb -0.00 -3.05 -0.00 0.00 0.00 0.00 0.00 23.12 20.07 1yi8 s ALA 34 CO -0.00 0.20 1.06 -0.51 0.00 0.00 0.00 175.76 176.51 1yi8 s LEU 35 N -2.87 3.27 0.00 0.00 1.02 -1.26 -4.96 118.68 113.89 1yi8 s LEU 35 Ca 0.57 1.73 0.06 0.00 0.02 0.00 0.00 54.13 56.51 1yi8 s LEU 35 Cb -0.11 -4.51 -0.02 0.00 0.02 0.00 0.00 46.19 41.56 1yi8 s LEU 35 CO 0.16 -1.41 0.21 0.00 0.02 0.00 0.00 176.35 175.33 1yi8 n HIS 36 N -2.73 -0.31 -0.12 0.29 1.44 -1.26 -2.05 115.22 110.50 1yi8 n HIS 36 Ca 0.08 -2.68 0.26 0.00 -2.01 0.00 0.00 57.72 53.37 1yi8 n HIS 36 Cb 0.53 0.13 0.71 0.00 0.12 0.00 0.00 29.99 31.49 1yi8 n HIS 36 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 1yi8 h LEU 37 N 0.00 0.00 -0.71 2.39 5.85 -1.50 0.61 115.31 121.95 1yi8 h LEU 37 Ca -0.28 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.34 1yi8 h LEU 37 Cb 1.20 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 1yi8 h LEU 37 CO 0.42 0.00 -0.15 1.23 -0.34 0.00 0.00 178.44 179.60 1yi8 h GLY 38 N 0.00 0.90 1.65 3.75 0.00 -1.90 -2.17 103.07 105.30 1yi8 h GLY 38 Ca 0.37 -0.72 -0.13 0.00 0.00 0.00 0.00 47.33 46.84 1yi8 h GLY 38 CO -0.00 0.66 -0.49 0.45 0.00 0.00 0.00 176.54 177.16 1yi8 h HIS 39 N 0.74 0.46 0.50 5.60 3.86 -1.29 0.23 115.15 125.25 1yi8 h HIS 39 Ca 0.11 -0.15 -0.02 0.00 -1.16 0.00 0.00 60.37 59.15 1yi8 h HIS 39 Cb 0.66 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 29.05 1yi8 h HIS 39 CO 0.04 0.79 -0.24 1.25 0.86 0.00 0.00 177.93 180.63 1yi8 h LEU 40 N 0.30 -0.57 -0.48 2.43 5.85 -1.23 0.35 115.31 121.95 1yi8 h LEU 40 Ca 0.01 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.58 1yi8 h LEU 40 Cb 0.97 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 1yi8 h LEU 40 CO 0.08 -0.35 -0.30 0.00 -0.34 0.00 0.00 178.44 177.53 1yi8 h ALA 41 N -0.26 0.67 -0.03 1.25 0.00 -1.41 -1.91 119.26 117.58 1yi8 h ALA 41 Ca -0.07 -0.42 -0.17 0.00 0.00 0.00 0.00 54.91 54.25 1yi8 h ALA 41 Cb 0.55 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1yi8 h ALA 41 CO 0.11 0.67 -0.73 0.78 0.00 0.00 0.00 179.25 180.08 1yi8 h GLY 42 N 0.86 0.21 0.00 0.00 0.00 -0.44 -3.45 103.07 100.25 1yi8 h GLY 42 Ca 0.09 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1yi8 h GLY 42 CO 0.08 0.28 0.00 -1.14 0.00 0.00 0.00 176.54 175.75 1yi8 n SER 43 N -3.76 0.00 0.44 0.19 3.41 0.10 -4.78 113.62 109.22 1yi8 n SER 43 Ca -0.03 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.39 1yi8 n SER 43 Cb 0.71 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.57 1yi8 n SER 43 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1yi8 h LEU 44 N 0.00 -0.93 -0.77 1.04 3.38 -0.78 -0.99 115.31 116.26 1yi8 h LEU 44 Ca 0.00 0.03 0.14 0.00 0.09 0.00 0.00 57.88 58.13 1yi8 h LEU 44 Cb 0.00 0.24 -0.09 0.00 0.09 0.00 0.00 40.66 40.90 1yi8 h LEU 44 CO 0.00 -0.66 0.34 1.56 0.09 0.00 0.00 178.44 179.77 1yi8 h GLN 45 N -1.12 0.49 -0.29 1.13 4.20 -1.61 0.89 115.11 118.80 1yi8 h GLN 45 Ca -0.11 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.51 1yi8 h GLN 45 Cb 0.85 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.50 1yi8 h GLN 45 CO 0.19 0.32 -0.08 -0.97 -0.67 0.00 0.00 178.83 177.61 1yi8 h ASN 46 N 0.50 0.44 0.20 1.46 -0.73 -1.77 -2.48 115.58 113.20 1yi8 h ASN 46 Ca 0.42 -0.10 -0.14 0.00 1.87 0.00 0.00 56.30 58.34 1yi8 h ASN 46 Cb 0.60 -0.12 -0.01 0.00 0.27 0.00 0.00 38.32 39.06 1yi8 h ASN 46 CO -0.37 0.58 -0.53 0.03 -0.37 0.00 0.00 177.43 176.76 1yi8 h ARG 47 N 0.44 0.36 -0.19 6.67 3.08 0.47 -0.97 114.38 124.23 1yi8 h ARG 47 Ca 0.09 -0.22 -0.07 0.00 0.07 0.00 0.00 59.98 59.85 1yi8 h ARG 47 Cb 0.42 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1yi8 h ARG 47 CO 0.02 0.80 -0.20 0.28 -1.07 0.00 0.00 179.97 179.80 1yi8 h VAL 48 N 0.28 1.23 -0.11 2.04 2.07 -0.53 -2.36 116.25 118.87 1yi8 h VAL 48 Ca 0.01 -1.07 -0.12 0.00 0.82 0.00 0.00 66.70 66.33 1yi8 h VAL 48 Cb 1.02 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 1yi8 h VAL 48 CO 0.09 0.34 -0.41 0.03 0.02 0.00 0.00 177.57 177.64 1yi8 h ARG 49 N 0.31 0.47 -0.82 1.57 -0.00 -1.13 -3.28 114.38 111.50 1yi8 h ARG 49 Ca 0.05 -0.36 0.07 0.00 -0.50 0.00 0.00 59.98 59.24 1yi8 h ARG 49 Cb 0.54 0.07 -0.05 0.00 0.00 0.00 0.00 29.97 30.53 1yi8 h ARG 49 CO 0.04 0.98 0.54 -0.07 0.00 0.00 0.00 179.97 181.46 1yi8 h LEU 50 N 0.05 0.79 -2.24 3.04 3.38 -0.84 -2.25 115.31 117.24 1yi8 h LEU 50 Ca -0.02 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.01 1yi8 h LEU 50 Cb 1.04 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 1yi8 h LEU 50 CO 0.09 0.51 0.23 0.06 0.09 0.00 0.00 178.44 179.41 1yi8 h GLN 51 N 0.90 0.00 0.00 1.13 3.07 -1.49 -0.44 115.11 118.27 1yi8 h GLN 51 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.10 1yi8 h GLN 51 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.80 1yi8 h GLN 51 CO -0.13 0.00 -0.76 -0.25 0.09 0.00 0.00 178.83 177.78 1yi8 n ASP 52 N -3.63 0.62 -0.28 0.06 10.43 -0.85 -4.28 116.55 118.62 1yi8 n ASP 52 Ca 0.01 -0.17 0.05 0.00 2.57 0.00 0.00 54.79 57.25 1yi8 n ASP 52 Cb 0.34 0.48 0.08 0.00 1.84 0.00 0.00 41.12 43.86 1yi8 n ASP 52 CO 0.00 0.00 0.00 -1.84 -1.07 0.00 0.00 177.20 174.29 1yi8 n GLU 53 N -1.84 0.69 -3.78 -1.24 0.28 -0.31 -4.46 120.64 109.98 1yi8 n GLU 53 Ca 0.03 -1.87 -0.03 0.00 -0.16 0.00 0.00 57.16 55.14 1yi8 n GLU 53 Cb 0.40 -1.03 -0.00 0.00 1.43 0.00 0.00 31.44 32.24 1yi8 n GLU 53 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1yi8 s ALA 54 N -1.55 -1.63 -0.38 -1.84 0.00 -0.42 -4.26 121.76 111.67 1yi8 s ALA 54 Ca 0.18 -0.00 -0.15 0.00 0.00 0.00 0.00 51.96 51.99 1yi8 s ALA 54 Cb 0.16 0.66 0.01 0.00 0.00 0.00 0.00 23.12 23.94 1yi8 s ALA 54 CO 0.01 -1.05 0.31 -2.00 0.00 0.00 0.00 175.76 173.04 1yi8 s GLU 55 N -2.93 3.21 -0.19 0.00 2.12 -0.92 -3.96 118.70 116.03 1yi8 s GLU 55 Ca 0.15 -0.79 -0.12 0.00 0.36 0.00 0.00 54.97 54.57 1yi8 s GLU 55 Cb -0.02 -3.91 -0.05 0.00 0.26 0.00 0.00 34.13 30.42 1yi8 s GLU 55 CO 0.03 -0.65 0.21 -1.17 -0.54 0.00 0.00 175.26 173.14 1yi8 s LEU 56 N 1.81 4.21 -0.09 2.70 1.98 -1.26 -0.98 118.68 127.04 1yi8 s LEU 56 Ca 0.07 0.34 0.02 0.00 -2.89 0.00 0.00 54.13 51.67 1yi8 s LEU 56 Cb -0.18 -2.22 -0.02 0.00 0.66 0.00 0.00 46.19 44.44 1yi8 s LEU 56 CO 0.11 0.13 -0.16 -0.36 -1.89 0.00 0.00 176.35 174.17 1yi8 s PHE 57 N 0.50 2.70 -0.09 5.38 2.99 -0.16 -1.42 117.98 127.88 1yi8 s PHE 57 Ca 0.12 -0.57 0.03 0.00 0.00 0.00 0.00 56.93 56.51 1yi8 s PHE 57 Cb -0.12 -1.73 0.01 0.00 0.00 0.00 0.00 43.02 41.17 1yi8 s PHE 57 CO 0.01 -0.13 -0.18 0.14 -0.00 0.00 0.00 175.22 175.06 1yi8 s VAL 58 N -0.02 1.65 -0.21 -0.44 -7.23 -0.11 -1.28 120.40 112.75 1yi8 s VAL 58 Ca -0.05 -0.77 -0.09 0.00 -1.81 0.00 0.00 61.98 59.27 1yi8 s VAL 58 Cb -0.14 -1.46 -0.04 0.00 0.56 0.00 0.00 36.38 35.29 1yi8 s VAL 58 CO 0.04 0.47 0.10 -0.22 -0.31 0.00 0.00 175.10 175.19 1yi8 s LEU 59 N 0.60 3.89 -0.89 1.32 2.96 0.63 -0.63 118.68 126.56 1yi8 s LEU 59 Ca -0.14 0.05 -0.17 0.00 -0.22 0.00 0.00 54.13 53.65 1yi8 s LEU 59 Cb -0.17 -2.02 0.16 0.00 0.50 0.00 0.00 46.19 44.67 1yi8 s LEU 59 CO 0.04 0.10 1.00 -0.76 -1.32 0.00 0.00 176.35 175.41 1yi8 s LEU 60 N 0.82 5.67 -1.19 -0.68 1.43 0.11 -1.54 118.68 123.30 1yi8 s LEU 60 Ca 0.05 -2.27 -0.17 0.00 -1.03 0.00 0.00 54.13 50.72 1yi8 s LEU 60 Cb -0.13 -2.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.71 1yi8 s LEU 60 CO 0.02 -0.89 2.15 0.00 0.23 0.00 0.00 176.35 177.86 1yi8 n ALA 61 N 5.62 4.78 0.25 4.21 0.00 -0.93 -2.08 120.51 132.36 1yi8 n ALA 61 Ca 0.20 -3.59 0.13 0.00 0.00 0.00 0.00 53.44 50.19 1yi8 n ALA 61 Cb 0.48 -3.55 0.62 0.00 0.00 0.00 0.00 19.45 17.00 1yi8 n ALA 61 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1yi8 h ASP 62 N 6.67 0.00 -0.02 0.00 2.03 -1.92 0.83 116.42 124.01 1yi8 h ASP 62 Ca 0.53 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.80 1yi8 h ASP 62 Cb 0.62 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.12 1yi8 h ASP 62 CO 1.90 0.13 -0.09 0.58 -1.03 0.00 0.00 179.24 180.73 1yi8 h VAL 63 N 0.00 1.50 -0.77 4.15 2.07 -1.91 -2.60 116.25 118.68 1yi8 h VAL 63 Ca -0.00 -1.62 -0.04 0.00 0.82 0.00 0.00 66.70 65.86 1yi8 h VAL 63 Cb 0.56 2.53 -0.03 0.00 -1.52 0.00 0.00 31.29 32.83 1yi8 h VAL 63 CO 0.02 0.43 0.34 -0.61 0.02 0.00 0.00 177.57 177.78 1yi8 h GLN 64 N -0.52 1.13 -0.34 1.57 4.15 -1.90 -0.29 115.11 118.90 1yi8 h GLN 64 Ca -0.01 -0.18 0.10 0.00 0.77 0.00 0.00 58.65 59.33 1yi8 h GLN 64 Cb 0.76 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.24 1yi8 h GLN 64 CO 0.02 0.90 0.31 0.00 -1.93 0.00 0.00 178.83 178.13 1yi8 h ALA 65 N 1.18 2.09 0.00 3.38 0.00 -0.80 0.27 119.26 125.38 1yi8 h ALA 65 Ca 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1yi8 h ALA 65 Cb 0.16 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1yi8 h ALA 65 CO -0.03 -0.48 -0.01 1.28 0.00 0.00 0.00 179.25 180.01 1yi8 n LEU 66 N -3.97 0.30 0.22 0.00 4.77 -0.13 -1.99 117.00 116.21 1yi8 n LEU 66 Ca 0.05 0.52 0.15 0.00 -0.03 0.00 0.00 56.01 56.71 1yi8 n LEU 66 Cb 0.48 -0.43 0.74 0.00 -2.33 0.00 0.00 43.42 41.88 1yi8 n LEU 66 CO 0.30 -0.06 0.96 0.71 -1.33 0.00 0.00 177.39 177.97 1yi8 h THR 67 N 0.00 0.00 0.00 -5.08 1.35 -0.92 -1.92 112.91 106.34 1yi8 h THR 67 Ca 0.00 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 1yi8 h THR 67 Cb 0.59 0.94 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 1yi8 h THR 67 CO 0.00 0.00 -0.02 -0.90 -0.25 0.00 0.00 175.52 174.35 1yi8 n ASP 68 N -2.63 0.10 -1.24 5.36 3.85 -1.24 -3.97 116.55 116.79 1yi8 n ASP 68 Ca -0.00 -0.10 -0.03 0.00 -0.71 0.00 0.00 54.79 53.94 1yi8 n ASP 68 Cb 0.15 0.22 0.21 0.00 -1.35 0.00 0.00 41.12 40.36 1yi8 n ASP 68 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.20 177.60 1yi8 n HIS 69 N -0.23 1.31 0.21 2.11 8.25 -0.84 -4.63 115.22 121.39 1yi8 n HIS 69 Ca 0.00 -1.45 0.11 0.00 -0.26 0.00 0.00 57.72 56.11 1yi8 n HIS 69 Cb 0.00 -0.51 0.54 0.00 1.12 0.00 0.00 29.99 31.14 1yi8 n HIS 69 CO 0.00 0.00 0.00 1.97 0.64 0.00 0.00 176.34 178.95 1yi8 n PHE 70 N -0.96 0.71 0.58 4.41 -1.74 -0.73 -0.54 117.46 119.19 1yi8 n PHE 70 Ca 0.34 0.35 0.12 0.00 -0.56 0.00 0.00 57.45 57.69 1yi8 n PHE 70 Cb 1.08 -1.06 0.21 0.00 1.52 0.00 0.00 39.48 41.23 1yi8 n PHE 70 CO 0.00 0.00 0.00 -0.40 -0.56 0.00 0.00 176.76 175.80 1yi8 n ASP 71 N -2.22 3.17 -3.04 5.98 3.85 -1.26 -4.45 116.55 118.59 1yi8 n ASP 71 Ca -0.01 -1.96 -0.15 0.00 -0.71 0.00 0.00 54.79 51.96 1yi8 n ASP 71 Cb 0.08 -0.17 -0.01 0.00 -1.35 0.00 0.00 41.12 39.67 1yi8 n ASP 71 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1yi8 n ARG 72 N 1.34 1.02 0.31 0.11 1.74 0.30 -4.95 116.66 116.53 1yi8 n ARG 72 Ca 0.18 -3.28 0.19 0.00 -0.77 0.00 0.00 57.85 54.17 1yi8 n ARG 72 Cb 0.58 -1.55 1.01 0.00 -1.02 0.00 0.00 32.46 31.47 1yi8 n ARG 72 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1yi8 h PRO 73 N 2.99 0.00 -0.14 5.56 0.13 -1.78 -2.35 132.00 136.41 1yi8 h PRO 73 Ca 0.04 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.00 1yi8 h PRO 73 Cb 1.03 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.17 1yi8 h PRO 73 CO 0.48 0.02 -0.59 0.93 -0.23 0.00 0.00 178.00 178.62 1yi8 h GLU 74 N 0.00 0.64 -0.62 0.86 4.39 -1.92 -2.46 114.58 115.47 1yi8 h GLU 74 Ca -0.00 -0.50 0.03 0.00 0.34 0.00 0.00 59.36 59.22 1yi8 h GLU 74 Cb 0.13 0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.84 1yi8 h GLU 74 CO 0.00 1.12 0.38 0.37 -1.16 0.00 0.00 179.01 179.73 1yi8 h GLN 75 N 0.30 0.73 0.14 2.33 4.15 -1.82 -1.88 115.11 119.06 1yi8 h GLN 75 Ca -0.03 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.34 1yi8 h GLN 75 Cb 1.22 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.74 1yi8 h GLN 75 CO 0.12 0.49 -0.07 0.28 -1.93 0.00 0.00 178.83 177.72 1yi8 h VAL 76 N 0.76 0.98 -0.48 2.39 2.07 -1.53 -2.61 116.25 117.83 1yi8 h VAL 76 Ca 0.25 -0.50 0.09 0.00 0.82 0.00 0.00 66.70 67.35 1yi8 h VAL 76 Cb 0.01 1.29 -0.07 0.00 -1.52 0.00 0.00 31.29 31.00 1yi8 h VAL 76 CO -0.10 0.12 0.04 -0.09 0.02 0.00 0.00 177.57 177.56 1yi8 h ARG 77 N -0.42 0.15 0.00 1.57 2.43 -1.31 -1.90 114.38 114.91 1yi8 h ARG 77 Ca -0.02 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 1yi8 h ARG 77 Cb 0.33 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 1yi8 h ARG 77 CO 0.03 0.10 -0.27 0.93 -1.51 0.00 0.00 179.97 179.25 1yi8 h GLU 78 N 0.16 0.00 -0.00 0.20 4.39 -1.34 -2.94 114.58 115.05 1yi8 h GLU 78 Ca 0.24 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.94 1yi8 h GLU 78 Cb 0.34 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1yi8 h GLU 78 CO -0.36 0.27 -0.16 0.09 -1.16 0.00 0.00 179.01 177.69 1yi8 n ASN 79 N -3.89 0.24 0.01 1.42 3.02 -0.73 -3.17 115.26 112.16 1yi8 n ASN 79 Ca -0.02 0.01 -0.12 0.00 -0.03 0.00 0.00 54.58 54.42 1yi8 n ASN 79 Cb 0.35 -0.19 -0.08 0.00 -0.61 0.00 0.00 39.78 39.25 1yi8 n ASN 79 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 1yi8 h VAL 80 N 0.13 1.15 -0.04 2.41 3.04 -1.32 -0.80 116.25 120.83 1yi8 h VAL 80 Ca 0.00 -0.46 -0.15 0.00 -1.01 0.00 0.00 66.70 65.09 1yi8 h VAL 80 Cb 0.45 1.44 -0.01 0.00 -2.01 0.00 0.00 31.29 31.16 1yi8 h VAL 80 CO 0.00 0.12 -0.64 -0.07 -1.01 0.00 0.00 177.57 175.97 1yi8 h LEU 81 N -0.17 0.18 -0.36 3.16 4.07 -1.74 -2.55 115.31 117.89 1yi8 h LEU 81 Ca 0.00 -0.11 -0.06 0.00 0.08 0.00 0.00 57.88 57.79 1yi8 h LEU 81 Cb 0.19 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.87 1yi8 h LEU 81 CO -0.00 0.77 -0.01 0.00 -1.08 0.00 0.00 178.44 178.12 1yi8 h ALA 82 N 1.23 0.49 -0.19 1.53 0.00 -1.47 -1.58 119.26 119.27 1yi8 h ALA 82 Ca -0.01 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 1yi8 h ALA 82 Cb 1.15 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1yi8 h ALA 82 CO 0.09 0.27 -0.41 -0.39 0.00 0.00 0.00 179.25 178.82 1yi8 h VAL 83 N 0.46 1.31 -0.76 0.00 -1.51 -1.17 -1.69 116.25 112.89 1yi8 h VAL 83 Ca 0.10 -1.55 0.03 0.00 -1.23 0.00 0.00 66.70 64.05 1yi8 h VAL 83 Cb 0.48 1.61 -0.05 0.00 -2.13 0.00 0.00 31.29 31.20 1yi8 h VAL 83 CO 0.02 0.48 0.48 0.00 -1.23 0.00 0.00 177.57 177.32 1yi8 h ALA 84 N 1.21 1.00 -0.72 5.19 0.00 -1.21 0.18 119.26 124.91 1yi8 h ALA 84 Ca 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1yi8 h ALA 84 Cb 0.87 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1yi8 h ALA 84 CO 0.07 0.28 0.41 1.25 0.00 0.00 0.00 179.25 181.27 1yi8 h LEU 85 N 0.94 0.88 -0.50 0.00 7.12 -0.98 -2.11 115.31 120.65 1yi8 h LEU 85 Ca 0.30 -0.08 -0.02 0.00 0.13 0.00 0.00 57.88 58.21 1yi8 h LEU 85 Cb 0.01 -0.22 -0.02 0.00 -0.53 0.00 0.00 40.66 39.90 1yi8 h LEU 85 CO -0.11 0.70 0.23 0.44 -0.13 0.00 0.00 178.44 179.57 1yi8 h ASP 86 N 0.98 0.67 -0.24 1.25 3.32 -0.23 0.33 116.42 122.50 1yi8 h ASP 86 Ca 0.26 -0.14 0.05 0.00 0.02 0.00 0.00 57.03 57.21 1yi8 h ASP 86 Cb 0.00 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.34 1yi8 h ASP 86 CO -0.04 0.62 -0.04 1.88 -1.72 0.00 0.00 179.24 179.94 1yi8 h TYR 87 N 0.67 -0.09 -0.44 4.55 0.99 -0.32 0.41 116.97 122.73 1yi8 h TYR 87 Ca 0.17 0.02 -0.05 0.00 2.00 0.00 0.00 58.73 60.87 1yi8 h TYR 87 Cb 0.14 0.07 -0.02 0.00 1.00 0.00 0.00 36.73 37.93 1yi8 h TYR 87 CO -0.00 -0.08 0.08 -0.07 -0.00 0.00 0.00 178.16 178.08 1yi8 h LEU 88 N 0.03 0.70 -1.09 3.88 3.38 -1.12 -1.23 115.31 119.86 1yi8 h LEU 88 Ca 0.12 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 1yi8 h LEU 88 Cb 0.17 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1yi8 h LEU 88 CO -0.23 0.78 0.46 0.00 0.09 0.00 0.00 178.44 179.55 1yi8 h ALA 89 N 0.95 1.31 -0.36 1.53 0.00 0.16 -1.19 119.26 121.65 1yi8 h ALA 89 Ca 0.14 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1yi8 h ALA 89 Cb 0.38 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1yi8 h ALA 89 CO 0.01 0.58 0.13 0.00 0.00 0.00 0.00 179.25 179.96 1yi8 h ALA 90 N 1.41 1.54 0.00 0.00 0.00 0.28 -3.39 119.26 119.09 1yi8 h ALA 90 Ca 0.29 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1yi8 h ALA 90 Cb -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1yi8 h ALA 90 CO -0.05 0.35 0.00 0.41 0.00 0.00 0.00 179.25 179.96 1yi8 n GLY 91 N -1.17 0.44 3.70 0.00 0.00 -0.45 -4.95 105.19 102.76 1yi8 n GLY 91 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1yi8 n GLY 91 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1yi8 s LEU 92 N 0.00 4.34 -0.30 0.99 2.96 -0.53 -4.95 118.68 121.19 1yi8 s LEU 92 Ca 0.00 2.27 -0.24 0.00 -0.22 0.00 0.00 54.13 55.94 1yi8 s LEU 92 Cb 0.00 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.12 1yi8 s LEU 92 CO 0.00 -0.74 0.82 -0.62 -1.32 0.00 0.00 176.35 174.49 1yi8 s ASP 93 N 1.76 6.70 0.66 3.68 -1.08 -1.26 -4.42 116.67 122.71 1yi8 s ASP 93 Ca 0.66 0.73 0.36 0.00 -0.52 0.00 0.00 52.55 53.79 1yi8 s ASP 93 Cb -0.35 -2.42 1.99 0.00 -1.46 0.00 0.00 42.92 40.68 1yi8 s ASP 93 CO 0.29 -0.64 2.14 -0.65 0.52 0.00 0.00 175.17 176.84 1yi8 h PRO 94 N 8.08 0.00 -0.02 4.34 0.11 -1.93 0.67 132.00 143.25 1yi8 h PRO 94 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1yi8 h PRO 94 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1yi8 h PRO 94 CO 0.90 0.00 -0.06 1.04 -0.21 0.00 0.00 178.00 179.66 1yi8 n GLN 95 N -3.09 1.80 -0.03 1.05 1.13 -1.26 -4.34 117.38 112.63 1yi8 n GLN 95 Ca -0.02 -1.28 -0.04 0.00 -1.94 0.00 0.00 57.00 53.71 1yi8 n GLN 95 Cb 0.24 -1.47 -0.02 0.00 0.11 0.00 0.00 30.24 29.09 1yi8 n GLN 95 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1yi8 n LYS 96 N 0.52 0.12 -4.33 -1.09 4.01 0.19 -5.06 118.16 112.52 1yi8 n LYS 96 Ca 0.16 0.04 -0.35 0.00 -0.51 0.00 0.00 58.31 57.64 1yi8 n LYS 96 Cb 0.46 -0.95 -0.09 0.00 -0.51 0.00 0.00 35.03 33.93 1yi8 n LYS 96 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 1yi8 s THR 97 N -2.10 4.41 -0.46 -0.18 -1.32 0.15 -4.37 115.64 111.76 1yi8 s THR 97 Ca -0.07 -0.23 -0.21 0.00 -1.21 0.00 0.00 61.69 59.97 1yi8 s THR 97 Cb 0.02 -2.86 0.03 0.00 -1.51 0.00 0.00 72.50 68.18 1yi8 s THR 97 CO 0.11 0.59 0.68 -0.89 -2.21 0.00 0.00 174.62 172.91 1yi8 s THR 98 N -0.91 4.77 -0.27 5.08 2.01 -0.51 -4.66 115.64 121.15 1yi8 s THR 98 Ca 0.14 0.08 -0.10 0.00 0.31 0.00 0.00 61.69 62.11 1yi8 s THR 98 Cb -0.11 -4.26 -0.04 0.00 0.01 0.00 0.00 72.50 68.09 1yi8 s THR 98 CO 0.03 -0.69 0.16 0.00 -0.69 0.00 0.00 174.62 173.43 1yi8 s VAL 100 N 1.72 1.78 -0.38 0.00 -7.23 0.20 -2.19 120.40 114.31 1yi8 s VAL 100 Ca 0.07 -0.99 -0.19 0.00 -1.81 0.00 0.00 61.98 59.05 1yi8 s VAL 100 Cb -0.16 -1.49 0.01 0.00 0.56 0.00 0.00 36.38 35.30 1yi8 s VAL 100 CO 0.09 0.48 0.58 -0.69 -0.31 0.00 0.00 175.10 175.25 1yi8 s VAL 101 N -0.56 4.94 0.27 1.32 1.01 -1.26 0.10 120.40 126.22 1yi8 s VAL 101 Ca 0.09 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.38 1yi8 s VAL 101 Cb -0.09 -4.06 0.25 0.00 0.00 0.00 0.00 36.38 32.49 1yi8 s VAL 101 CO -0.01 -0.35 1.73 -0.61 0.00 0.00 0.00 175.10 175.87 1yi8 h GLN 102 N 8.58 0.51 -0.89 2.72 4.15 -1.80 -1.24 115.11 127.13 1yi8 h GLN 102 Ca -0.27 -0.03 0.13 0.00 0.77 0.00 0.00 58.65 59.25 1yi8 h GLN 102 Cb 1.11 -0.11 -0.07 0.00 0.21 0.00 0.00 27.48 28.62 1yi8 h GLN 102 CO 0.82 0.33 0.58 0.77 -1.93 0.00 0.00 178.83 179.40 1yi8 h SER 103 N 0.52 0.71 -0.04 -0.69 0.02 -1.93 -2.20 113.55 109.94 1yi8 h SER 103 Ca 0.49 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.48 1yi8 h SER 103 Cb 0.79 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.22 1yi8 h SER 103 CO -0.43 0.38 0.00 0.00 -1.14 0.00 0.00 176.83 175.64 1yi8 n ALA 104 N -2.42 2.58 -3.71 3.77 0.00 -0.47 -4.38 120.51 115.88 1yi8 n ALA 104 Ca 0.17 -0.22 -0.29 0.00 0.00 0.00 0.00 53.44 53.10 1yi8 n ALA 104 Cb 0.42 -1.23 -0.12 0.00 0.00 0.00 0.00 19.45 18.51 1yi8 n ALA 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1yi8 s VAL 105 N -1.94 1.64 -0.19 0.00 0.11 -0.83 -4.94 120.40 114.25 1yi8 s VAL 105 Ca 0.28 -3.05 0.23 0.00 -2.93 0.00 0.00 61.98 56.51 1yi8 s VAL 105 Cb 0.13 -2.12 0.24 0.00 -1.53 0.00 0.00 36.38 33.10 1yi8 s VAL 105 CO 0.22 -0.98 1.71 1.55 -3.33 0.00 0.00 175.10 174.27 1yi8 h PRO 106 N 6.17 0.00 -0.44 1.54 0.13 -1.79 -2.39 132.00 135.22 1yi8 h PRO 106 Ca 0.08 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 65.27 1yi8 h PRO 106 Cb 0.88 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.98 1yi8 h PRO 106 CO 0.53 0.00 0.30 0.93 -0.23 0.00 0.00 178.00 179.53 1yi8 h GLU 107 N 0.00 0.35 0.02 0.86 3.07 -1.93 -1.35 114.58 115.59 1yi8 h GLU 107 Ca 0.00 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1yi8 h GLU 107 Cb 0.06 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 27.89 1yi8 h GLU 107 CO 0.00 0.23 -0.01 -0.07 -1.40 0.00 0.00 179.01 177.76 1yi8 h LEU 108 N 0.36 -0.02 -0.51 1.33 3.38 -1.78 -0.42 115.31 117.64 1yi8 h LEU 108 Ca 0.19 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.07 1yi8 h LEU 108 Cb 0.30 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 1yi8 h LEU 108 CO -0.04 0.14 0.24 0.00 0.09 0.00 0.00 178.44 178.86 1yi8 h ALA 109 N 0.80 0.65 -0.63 1.53 0.00 -1.49 0.91 119.26 121.02 1yi8 h ALA 109 Ca -0.00 0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.98 1yi8 h ALA 109 Cb 0.17 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1yi8 h ALA 109 CO 0.00 -0.13 0.38 1.49 0.00 0.00 0.00 179.25 180.99 1yi8 h GLU 110 N 0.46 0.72 -0.26 0.00 4.81 -1.08 -2.46 114.58 116.76 1yi8 h GLU 110 Ca 0.23 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.28 1yi8 h GLU 110 Cb 0.18 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1yi8 h GLU 110 CO -0.19 0.47 -0.42 1.25 -0.73 0.00 0.00 179.01 179.40 1yi8 h LEU 111 N 0.74 0.67 -1.22 1.64 5.85 -0.25 -3.15 115.31 119.59 1yi8 h LEU 111 Ca 0.26 -0.31 -0.05 0.00 0.84 0.00 0.00 57.88 58.62 1yi8 h LEU 111 Cb 0.06 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 1yi8 h LEU 111 CO -0.12 1.01 -0.02 0.71 -0.34 0.00 0.00 178.44 179.68 1yi8 h THR 112 N 0.52 1.20 -0.69 1.05 1.35 -0.40 -1.55 112.91 114.39 1yi8 h THR 112 Ca 0.04 -0.80 -0.07 0.00 -0.55 0.00 0.00 66.41 65.03 1yi8 h THR 112 Cb 0.94 0.97 -0.03 0.00 -1.73 0.00 0.00 68.15 68.30 1yi8 h THR 112 CO 0.08 0.27 0.16 1.62 -0.25 0.00 0.00 175.52 177.41 1yi8 h VAL 113 N 0.49 1.26 -0.54 6.82 3.04 -1.45 -0.92 116.25 124.96 1yi8 h VAL 113 Ca 0.10 -0.97 -0.08 0.00 -1.01 0.00 0.00 66.70 64.75 1yi8 h VAL 113 Cb 0.35 0.57 -0.02 0.00 -2.01 0.00 0.00 31.29 30.17 1yi8 h VAL 113 CO 0.01 0.37 0.03 1.88 -1.01 0.00 0.00 177.57 178.86 1yi8 h TYR 114 N 1.04 0.95 0.00 3.17 0.99 -1.48 -2.62 116.97 119.02 1yi8 h TYR 114 Ca 0.22 -0.13 -0.06 0.00 2.00 0.00 0.00 58.73 60.76 1yi8 h TYR 114 Cb 0.38 -0.26 -0.01 0.00 1.00 0.00 0.00 36.73 37.84 1yi8 h TYR 114 CO 0.03 0.85 -0.27 0.74 -0.00 0.00 0.00 178.16 179.51 1yi8 h PHE 115 N 0.83 0.00 0.00 4.88 -1.00 -0.70 -2.87 116.94 118.08 1yi8 h PHE 115 Ca 0.16 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.94 1yi8 h PHE 115 Cb 0.45 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.01 1yi8 h PHE 115 CO 0.03 0.27 -0.01 -0.07 -1.61 0.00 0.00 178.31 176.92 1yi8 h LEU 116 N 0.00 0.00 0.00 1.54 3.38 -0.79 -1.35 115.31 118.09 1yi8 h LEU 116 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1yi8 h LEU 116 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1yi8 h LEU 116 CO 0.03 0.01 -0.03 0.78 0.09 0.00 0.00 178.44 179.32 1yi8 h ASN 117 N 0.00 0.00 -0.31 -0.43 -0.26 -1.61 -3.24 115.58 109.74 1yi8 h ASN 117 Ca -0.00 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.73 1yi8 h ASN 117 Cb 0.01 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.27 1yi8 h ASN 117 CO 0.00 0.00 0.00 0.18 -1.06 0.00 0.00 177.43 176.56 1yi8 n LEU 118 N -2.40 2.54 -3.94 1.61 4.77 -0.51 -4.90 117.00 114.17 1yi8 n LEU 118 Ca 0.05 -1.11 -0.11 0.00 -0.03 0.00 0.00 56.01 54.81 1yi8 n LEU 118 Cb 0.45 -0.20 -0.13 0.00 -2.33 0.00 0.00 43.42 41.22 1yi8 n LEU 118 CO 0.31 0.56 -0.37 0.54 -1.33 0.00 0.00 177.39 177.10 1yi8 s VAL 119 N -1.61 0.15 0.28 4.08 0.11 -1.22 -4.89 120.40 117.30 1yi8 s VAL 119 Ca 0.35 -0.50 -0.07 0.00 -2.93 0.00 0.00 61.98 58.83 1yi8 s VAL 119 Cb 0.19 -0.21 -0.06 0.00 -1.53 0.00 0.00 36.38 34.77 1yi8 s VAL 119 CO 0.28 -0.22 0.57 0.28 -3.33 0.00 0.00 175.10 172.68 1yi8 s THR 120 N -0.73 4.97 0.28 5.04 -1.32 -1.26 -4.95 115.64 117.66 1yi8 s THR 120 Ca -0.07 0.27 -0.02 0.00 -1.21 0.00 0.00 61.69 60.65 1yi8 s THR 120 Cb -0.05 -3.69 0.20 0.00 -1.51 0.00 0.00 72.50 67.45 1yi8 s THR 120 CO -0.00 -0.24 1.87 0.58 -2.21 0.00 0.00 174.62 174.62 1yi8 h VAL 121 N 1.58 1.22 0.46 5.08 2.07 -1.98 -0.74 116.25 123.94 1yi8 h VAL 121 Ca -0.47 -0.65 -0.01 0.00 0.82 0.00 0.00 66.70 66.39 1yi8 h VAL 121 Cb 1.18 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 1yi8 h VAL 121 CO 0.67 0.27 -0.51 -1.28 0.02 0.00 0.00 177.57 176.74 1yi8 h SER 122 N 0.97 -1.41 -0.00 0.57 0.87 -1.99 0.19 113.55 112.76 1yi8 h SER 122 Ca 0.24 0.12 -0.04 0.00 -1.23 0.00 0.00 61.79 60.88 1yi8 h SER 122 Cb 0.12 0.47 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 1yi8 h SER 122 CO -0.03 -0.66 -0.08 0.45 -0.53 0.00 0.00 176.83 175.98 1yi8 h HIS 123 N -0.98 0.22 -0.25 2.24 -0.00 -1.91 -1.49 115.15 112.98 1yi8 h HIS 123 Ca -0.06 -0.02 -0.12 0.00 -0.00 0.00 0.00 60.37 60.18 1yi8 h HIS 123 Cb 0.86 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 28.20 1yi8 h HIS 123 CO -0.28 0.31 -0.34 -0.07 -0.00 0.00 0.00 177.93 177.55 1yi8 h LEU 124 N 0.21 0.55 -1.22 2.43 3.38 -0.69 -2.70 115.31 117.27 1yi8 h LEU 124 Ca 0.05 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 1yi8 h LEU 124 Cb 0.29 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 1yi8 h LEU 124 CO 0.01 0.85 -0.13 -0.09 0.09 0.00 0.00 178.44 179.17 1yi8 h ARG 125 N 0.45 0.00 0.00 1.13 2.43 0.41 -3.14 114.38 115.66 1yi8 h ARG 125 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1yi8 h ARG 125 Cb 0.81 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 1yi8 h ARG 125 CO 0.07 0.13 -0.19 1.04 -1.51 0.00 0.00 179.97 179.51 1yi8 n GLN 126 N -3.28 0.19 -1.55 0.20 6.02 -0.94 -4.81 117.38 113.21 1yi8 n GLN 126 Ca 0.00 0.12 -0.49 0.00 -0.01 0.00 0.00 57.00 56.62 1yi8 n GLN 126 Cb 0.38 -1.68 -0.06 0.00 1.02 0.00 0.00 30.24 29.90 1yi8 n GLN 126 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1yi8 n ASN 127 N -1.99 2.68 0.26 1.08 2.85 -1.19 -4.84 115.26 114.11 1yi8 n ASN 127 Ca 0.05 0.53 0.11 0.00 -0.11 0.00 0.00 54.58 55.17 1yi8 n ASN 127 Cb 0.40 -1.34 0.70 0.00 1.24 0.00 0.00 39.78 40.78 1yi8 n ASN 127 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1yi8 h PRO 128 N 11.96 0.00 0.17 1.20 0.13 -1.93 -0.98 132.00 142.55 1yi8 h PRO 128 Ca -0.36 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.46 1yi8 h PRO 128 Cb 1.29 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.43 1yi8 h PRO 128 CO 0.99 0.12 -1.47 0.00 -0.23 0.00 0.00 178.00 177.41 1yi8 h THR 129 N 0.00 1.26 -0.08 1.56 1.03 -1.88 -2.74 112.91 112.06 1yi8 h THR 129 Ca -0.00 -2.81 -0.20 0.00 -0.01 0.00 0.00 66.41 63.39 1yi8 h THR 129 Cb 0.28 2.89 0.00 0.00 -1.07 0.00 0.00 68.15 70.25 1yi8 h THR 129 CO 0.02 0.84 -0.79 -0.37 -0.01 0.00 0.00 175.52 175.21 1yi8 h VAL 130 N 0.10 1.36 -0.97 0.00 -1.51 -1.91 -1.56 116.25 111.74 1yi8 h VAL 130 Ca -0.23 -2.16 0.02 0.00 -1.23 0.00 0.00 66.70 63.10 1yi8 h VAL 130 Cb 2.06 2.14 -0.05 0.00 -2.13 0.00 0.00 31.29 33.31 1yi8 h VAL 130 CO 0.21 0.66 0.64 0.50 -1.23 0.00 0.00 177.57 178.35 1yi8 h LYS 131 N 0.33 1.24 -0.09 5.19 3.64 -1.26 -0.45 116.57 125.17 1yi8 h LYS 131 Ca -0.05 -0.07 -0.18 0.00 -1.27 0.00 0.00 60.65 59.08 1yi8 h LYS 131 Cb 1.39 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 1yi8 h LYS 131 CO 0.14 0.82 -0.69 0.00 -2.27 0.00 0.00 179.45 177.46 1yi8 h ALA 132 N 1.41 0.64 -0.27 5.00 0.00 -1.30 -1.86 119.26 122.88 1yi8 h ALA 132 Ca 0.37 -0.59 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 1yi8 h ALA 132 Cb -0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1yi8 h ALA 132 CO -0.10 0.75 -0.08 0.93 0.00 0.00 0.00 179.25 180.75 1yi8 h GLU 133 N 0.28 0.54 -0.45 0.00 5.08 -0.63 0.23 114.58 119.62 1yi8 h GLU 133 Ca -0.02 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 1yi8 h GLU 133 Cb 1.25 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 1yi8 h GLU 133 CO 0.12 0.76 0.18 0.82 -1.00 0.00 0.00 179.01 179.88 1yi8 h ILE 134 N 0.29 1.17 0.37 3.13 2.04 -1.12 0.54 117.51 123.93 1yi8 h ILE 134 Ca 0.07 -0.53 -0.02 0.00 1.00 0.00 0.00 64.86 65.38 1yi8 h ILE 134 Cb 0.56 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1yi8 h ILE 134 CO 0.03 0.21 -0.18 0.00 0.00 0.00 0.00 178.15 178.21 1yi8 h ALA 135 N 1.56 -0.50 0.00 1.87 0.00 -0.95 -1.04 119.26 120.20 1yi8 h ALA 135 Ca 0.16 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1yi8 h ALA 135 Cb 0.13 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1yi8 h ALA 135 CO -0.02 -0.67 -0.16 -0.56 0.00 0.00 0.00 179.25 177.84 1yi8 h GLN 136 N -0.71 0.00 0.00 0.00 -0.00 -0.44 -1.59 115.11 112.37 1yi8 h GLN 136 Ca -0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.59 1yi8 h GLN 136 Cb 0.50 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.97 1yi8 h GLN 136 CO 0.08 0.16 -0.05 0.87 -0.00 0.00 0.00 178.83 179.89 1yi8 h LYS 137 N 0.00 0.00 -0.34 0.06 6.56 0.30 -3.47 116.57 119.68 1yi8 h LYS 137 Ca -0.00 0.00 -0.15 0.00 -1.06 0.00 0.00 60.65 59.44 1yi8 h LYS 137 Cb 0.40 0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 32.00 1yi8 h LYS 137 CO 0.02 0.05 -0.13 0.41 -2.06 0.00 0.00 179.45 177.74 1yi8 n GLY 138 N 0.81 0.90 0.16 3.86 0.00 -0.41 -4.91 105.19 105.59 1yi8 n GLY 138 Ca 0.03 -0.42 -0.05 0.00 0.00 0.00 0.00 46.02 45.58 1yi8 n GLY 138 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1yi8 h TYR 139 N 0.00 -0.02 0.00 1.61 0.05 -1.79 -3.47 116.97 113.35 1yi8 h TYR 139 Ca -0.15 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.66 1yi8 h TYR 139 Cb 0.60 0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.40 1yi8 h TYR 139 CO 0.28 -0.07 0.00 0.41 -1.05 0.00 0.00 178.16 177.73 1yi8 n GLY 140 N -1.26 1.43 0.00 3.88 0.00 -1.26 -3.02 105.19 104.95 1yi8 n GLY 140 Ca 0.02 -0.75 0.08 0.00 0.00 0.00 0.00 46.02 45.37 1yi8 n GLY 140 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1yi8 n GLU 141 N 3.46 1.29 -0.78 1.61 1.02 -1.26 -4.63 120.64 121.34 1yi8 n GLU 141 Ca 0.00 -0.06 -0.10 0.00 -0.02 0.00 0.00 57.16 56.98 1yi8 n GLU 141 Cb 0.00 -1.29 -0.13 0.00 -0.02 0.00 0.00 31.44 29.99 1yi8 n GLU 141 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1yi8 n ARG 142 N -1.66 1.58 -3.07 3.49 1.74 -1.17 -4.86 116.66 112.71 1yi8 n ARG 142 Ca 0.00 -0.79 -0.40 0.00 -0.77 0.00 0.00 57.85 55.89 1yi8 n ARG 142 Cb 0.32 -1.90 -0.05 0.00 -1.02 0.00 0.00 32.46 29.80 1yi8 n ARG 142 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1yi8 s VAL 143 N 1.45 5.00 0.19 1.55 1.01 -1.26 -4.87 120.40 123.48 1yi8 s VAL 143 Ca 0.52 1.29 -0.32 0.00 0.00 0.00 0.00 61.98 63.48 1yi8 s VAL 143 Cb 0.25 -3.99 -0.11 0.00 0.00 0.00 0.00 36.38 32.53 1yi8 s VAL 143 CO -0.00 0.12 1.64 -2.16 0.00 0.00 0.00 175.10 174.70 1yi8 s PRO 144 N 1.77 4.17 0.23 2.72 0.04 -1.26 -4.87 135.00 137.80 1yi8 s PRO 144 Ca 0.31 2.48 -0.12 0.00 0.04 0.00 0.00 61.00 63.72 1yi8 s PRO 144 Cb -0.16 -3.11 0.30 0.00 0.04 0.00 0.00 34.50 31.57 1yi8 s PRO 144 CO 0.12 -0.67 1.61 0.00 0.04 0.00 0.00 177.00 178.09 1yi8 h ALA 145 N 6.67 0.48 -0.87 8.56 0.00 -1.95 -0.71 119.26 131.44 1yi8 h ALA 145 Ca -0.43 0.29 0.10 0.00 0.00 0.00 0.00 54.91 54.87 1yi8 h ALA 145 Cb 1.20 0.57 -0.06 0.00 0.00 0.00 0.00 17.79 19.50 1yi8 h ALA 145 CO 0.93 -0.42 0.56 0.78 0.00 0.00 0.00 179.25 181.10 1yi8 h GLY 146 N -0.00 1.21 1.24 0.00 0.00 -1.90 -1.92 103.07 101.70 1yi8 h GLY 146 Ca 0.35 -0.34 -0.21 0.00 0.00 0.00 0.00 47.33 47.13 1yi8 h GLY 146 CO -0.76 0.18 -0.72 -2.75 0.00 0.00 0.00 176.54 172.49 1yi8 h PHE 147 N 0.81 1.01 -0.79 5.60 3.04 -1.27 -2.44 116.94 122.91 1yi8 h PHE 147 Ca 0.41 -0.42 0.02 0.00 3.98 0.00 0.00 57.97 61.95 1yi8 h PHE 147 Cb 0.47 -0.16 -0.04 0.00 2.56 0.00 0.00 35.95 38.77 1yi8 h PHE 147 CO -0.00 1.25 0.52 0.35 -2.02 0.00 0.00 178.31 178.40 1yi8 h PHE 148 N 0.54 0.97 -0.65 0.41 3.04 -0.83 -2.50 116.94 117.92 1yi8 h PHE 148 Ca -0.03 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.94 1yi8 h PHE 148 Cb 1.33 -0.33 0.00 0.00 2.56 0.00 0.00 35.95 39.52 1yi8 h PHE 148 CO 0.08 0.59 0.00 1.33 -2.02 0.00 0.00 178.31 178.29 1yi8 n VAL 149 N -4.43 1.96 0.22 1.41 0.24 -0.83 -4.60 118.33 112.30 1yi8 n VAL 149 Ca 0.09 -1.21 0.06 0.00 -2.04 0.00 0.00 64.34 61.24 1yi8 n VAL 149 Cb 0.06 0.07 0.50 0.00 -1.47 0.00 0.00 33.84 33.00 1yi8 n VAL 149 CO 0.00 0.00 0.00 0.10 -2.14 0.00 0.00 176.83 174.79 1yi8 h TYR 150 N 4.13 0.00 -0.28 6.34 -0.00 -0.96 -2.05 116.97 124.15 1yi8 h TYR 150 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 58.73 58.81 1yi8 h TYR 150 Cb 1.53 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 38.25 1yi8 h TYR 150 CO 0.83 0.22 0.20 -1.35 -0.00 0.00 0.00 178.16 178.06 1yi8 h PRO 151 N 0.00 0.02 -0.11 0.10 0.11 -1.82 -1.59 132.00 128.71 1yi8 h PRO 151 Ca -0.00 -0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.87 1yi8 h PRO 151 Cb 0.41 -0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.53 1yi8 h PRO 151 CO 0.03 0.01 -0.85 -0.39 -0.21 0.00 0.00 178.00 176.60 1yi8 h VAL 152 N 0.02 1.28 -0.26 3.15 -1.51 -1.73 -1.59 116.25 115.61 1yi8 h VAL 152 Ca 0.13 -2.05 -0.02 0.00 -1.23 0.00 0.00 66.70 63.53 1yi8 h VAL 152 Cb 0.51 2.09 -0.01 0.00 -2.13 0.00 0.00 31.29 31.74 1yi8 h VAL 152 CO -0.00 0.65 0.09 0.77 -1.23 0.00 0.00 177.57 177.84 1yi8 h SER 153 N 0.49 0.33 -0.29 4.19 4.64 -1.34 0.22 113.55 121.79 1yi8 h SER 153 Ca -0.07 -0.03 -0.16 0.00 -0.47 0.00 0.00 61.79 61.07 1yi8 h SER 153 Cb 1.48 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.48 1yi8 h SER 153 CO 0.17 0.32 -0.40 1.56 -0.87 0.00 0.00 176.83 177.60 1yi8 h GLN 154 N 0.37 0.84 -0.94 4.77 4.20 -1.18 -0.34 115.11 122.83 1yi8 h GLN 154 Ca 0.09 -0.45 0.04 0.00 0.06 0.00 0.00 58.65 58.40 1yi8 h GLN 154 Cb 0.10 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 27.84 1yi8 h GLN 154 CO -0.01 1.08 0.61 0.00 -0.67 0.00 0.00 178.83 179.84 1yi8 h ALA 155 N 0.85 1.25 -0.60 3.87 0.00 0.03 -0.66 119.26 124.01 1yi8 h ALA 155 Ca 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1yi8 h ALA 155 Cb 0.98 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1yi8 h ALA 155 CO 0.09 0.46 0.33 0.00 0.00 0.00 0.00 179.25 180.13 1yi8 h ALA 156 N 1.40 0.76 0.13 0.00 0.00 -0.23 -1.77 119.26 119.55 1yi8 h ALA 156 Ca 0.38 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.21 1yi8 h ALA 156 Cb 0.04 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1yi8 h ALA 156 CO -0.13 0.28 -0.21 -0.44 0.00 0.00 0.00 179.25 178.74 1yi8 h ASP 157 N 0.81 -0.59 0.37 0.00 3.32 0.28 -1.44 116.42 119.17 1yi8 h ASP 157 Ca 0.21 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.32 1yi8 h ASP 157 Cb 0.03 0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1yi8 h ASP 157 CO -0.03 -0.30 -0.35 0.40 -1.72 0.00 0.00 179.24 177.23 1yi8 h ILE 158 N -0.41 0.27 -0.77 0.35 1.08 -0.97 -2.75 117.51 114.32 1yi8 h ILE 158 Ca 0.02 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.49 1yi8 h ILE 158 Cb 0.42 0.27 -0.04 0.00 -3.07 0.00 0.00 36.82 34.41 1yi8 h ILE 158 CO -0.10 0.00 0.48 0.00 -0.69 0.00 0.00 178.15 177.83 1yi8 h ALA 159 N -0.28 0.98 -0.51 1.87 0.00 -1.31 -2.13 119.26 117.87 1yi8 h ALA 159 Ca -0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1yi8 h ALA 159 Cb 0.66 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1yi8 h ALA 159 CO -0.05 0.44 0.25 0.00 0.00 0.00 0.00 179.25 179.89 1yi8 h ALA 160 N 1.26 0.66 0.00 0.00 0.00 -1.22 -1.51 119.26 118.44 1yi8 h ALA 160 Ca 0.28 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1yi8 h ALA 160 Cb -0.06 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1yi8 h ALA 160 CO -0.05 0.22 0.00 1.19 0.00 0.00 0.00 179.25 180.60 1yi8 n PHE 161 N -4.60 0.18 -2.99 0.00 0.99 -1.04 -3.90 117.46 106.09 1yi8 n PHE 161 Ca 0.02 0.05 -0.12 0.00 -0.00 0.00 0.00 57.45 57.41 1yi8 n PHE 161 Cb 0.11 -0.59 0.05 0.00 -1.00 0.00 0.00 39.48 38.05 1yi8 n PHE 161 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1yi8 n GLY 162 N 1.33 0.06 3.78 1.37 0.00 -0.57 -4.92 105.19 106.23 1yi8 n GLY 162 Ca 0.06 -0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 1yi8 n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yi8 s ALA 163 N -3.19 3.32 -0.38 4.61 0.00 -0.94 -4.75 121.76 120.44 1yi8 s ALA 163 Ca 0.20 0.47 0.08 0.00 0.00 0.00 0.00 51.96 52.71 1yi8 s ALA 163 Cb -0.09 -3.10 -0.10 0.00 0.00 0.00 0.00 23.12 19.84 1yi8 s ALA 163 CO 0.41 0.23 0.35 0.25 0.00 0.00 0.00 175.76 177.00 1yi8 n THR 164 N 1.03 0.00 -4.30 0.00 -2.24 -0.47 -4.38 114.28 103.92 1yi8 n THR 164 Ca -0.01 -0.29 -0.21 0.00 -2.27 0.00 0.00 64.05 61.27 1yi8 n THR 164 Cb 0.49 0.95 -0.16 0.00 -2.10 0.00 0.00 70.33 69.51 1yi8 n THR 164 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1yi8 s LEU 165 N -2.49 1.49 -0.20 3.22 0.20 -0.99 -0.37 118.68 119.54 1yi8 s LEU 165 Ca 0.03 -0.18 -0.02 0.00 0.69 0.00 0.00 54.13 54.65 1yi8 s LEU 165 Cb 0.06 -0.55 0.06 0.00 -0.43 0.00 0.00 46.19 45.34 1yi8 s LEU 165 CO 0.35 -0.01 0.01 0.68 -0.29 0.00 0.00 176.35 177.09 1yi8 s VAL 166 N 0.73 0.79 0.24 1.68 -7.23 -0.25 -1.42 120.40 114.93 1yi8 s VAL 166 Ca -0.11 -0.71 -0.32 0.00 -1.81 0.00 0.00 61.98 59.04 1yi8 s VAL 166 Cb -0.14 -1.22 -0.13 0.00 0.56 0.00 0.00 36.38 35.46 1yi8 s VAL 166 CO 0.01 -0.16 1.57 -2.65 -0.31 0.00 0.00 175.10 173.57 1yi8 n PRO 167 N 4.95 2.44 -3.78 4.82 -0.02 -1.26 -2.22 135.00 139.94 1yi8 n PRO 167 Ca -0.10 0.87 -0.13 0.00 -2.02 0.00 0.00 63.50 62.13 1yi8 n PRO 167 Cb 0.46 -2.64 -0.11 0.00 -0.02 0.00 0.00 33.50 31.20 1yi8 n PRO 167 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1yi8 s VAL 168 N 0.42 0.00 0.41 -1.45 0.11 -0.73 -4.86 120.40 114.30 1yi8 s VAL 168 Ca 0.70 -0.03 -0.01 0.00 -2.93 0.00 0.00 61.98 59.71 1yi8 s VAL 168 Cb -0.57 -0.41 -0.03 0.00 -1.53 0.00 0.00 36.38 33.84 1yi8 s VAL 168 CO 0.43 -0.02 0.64 -0.83 -3.33 0.00 0.00 175.10 172.00 1yi8 s GLY 169 N 0.06 1.42 0.33 6.54 0.00 -1.26 0.12 107.32 114.52 1yi8 s GLY 169 Ca -0.01 -0.80 0.22 0.00 0.00 0.00 0.00 44.72 44.14 1yi8 s GLY 169 CO 0.01 -0.68 1.68 2.09 0.00 0.00 0.00 173.10 176.19 1yi8 n ASP 170 N -1.99 0.58 0.18 1.64 5.75 -1.26 -0.99 116.55 120.47 1yi8 n ASP 170 Ca -0.02 0.76 0.13 0.00 -0.01 0.00 0.00 54.79 55.66 1yi8 n ASP 170 Cb 0.56 -0.84 0.40 0.00 -1.03 0.00 0.00 41.12 40.21 1yi8 n ASP 170 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 1yi8 h ASP 171 N 0.00 0.00 -0.01 -1.12 3.32 -2.04 -3.17 116.42 113.40 1yi8 h ASP 171 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1yi8 h ASP 171 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1yi8 h ASP 171 CO 0.00 0.00 -0.27 0.00 -1.72 0.00 0.00 179.24 177.25 1yi8 n GLN 172 N -2.71 1.66 -0.37 3.56 3.00 -0.16 -4.57 117.38 117.80 1yi8 n GLN 172 Ca 0.03 -0.87 0.05 0.00 -0.01 0.00 0.00 57.00 56.19 1yi8 n GLN 172 Cb 0.41 -1.25 0.20 0.00 0.00 0.00 0.00 30.24 29.60 1yi8 n GLN 172 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1yi8 h LEU 173 N 1.89 0.99 -1.60 1.08 3.38 -1.50 0.22 115.31 119.76 1yi8 h LEU 173 Ca 0.00 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1yi8 h LEU 173 Cb 0.53 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 1yi8 h LEU 173 CO 0.00 0.59 -0.11 1.55 0.09 0.00 0.00 178.44 180.56 1yi8 h PRO 174 N 1.10 0.00 -0.10 1.13 0.13 -1.80 0.58 132.00 133.04 1yi8 h PRO 174 Ca 0.46 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.54 1yi8 h PRO 174 Cb 0.31 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.44 1yi8 h PRO 174 CO -0.21 0.11 -0.13 1.98 -0.23 0.00 0.00 178.00 179.51 1yi8 h MET 175 N 0.00 0.26 -0.11 0.86 4.05 -0.94 -2.37 114.93 116.67 1yi8 h MET 175 Ca -0.00 -0.15 -0.01 0.00 -0.28 0.00 0.00 59.70 59.26 1yi8 h MET 175 Cb 0.50 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 31.30 1yi8 h MET 175 CO 0.01 0.71 0.05 1.25 0.23 0.00 0.00 176.91 179.16 1yi8 h LEU 176 N -0.18 0.15 -0.88 3.39 7.12 -0.34 -2.46 115.31 122.12 1yi8 h LEU 176 Ca 0.01 -0.14 0.01 0.00 0.13 0.00 0.00 57.88 57.89 1yi8 h LEU 176 Cb 0.68 -0.04 -0.04 0.00 -0.53 0.00 0.00 40.66 40.73 1yi8 h LEU 176 CO 0.03 0.25 0.58 -0.08 -0.13 0.00 0.00 178.44 179.09 1yi8 h GLU 177 N 0.03 1.15 -0.86 1.25 4.57 0.08 -0.98 114.58 119.82 1yi8 h GLU 177 Ca 0.04 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 1yi8 h GLU 177 Cb 0.15 -0.26 -0.04 0.00 -0.16 0.00 0.00 28.75 28.44 1yi8 h GLU 177 CO -0.00 0.76 0.49 0.37 -1.18 0.00 0.00 179.01 179.44 1yi8 h GLN 178 N 1.18 1.19 -0.44 1.92 4.15 -1.32 -0.53 115.11 121.26 1yi8 h GLN 178 Ca 0.33 -0.13 0.08 0.00 0.77 0.00 0.00 58.65 59.69 1yi8 h GLN 178 Cb -0.12 -0.24 -0.06 0.00 0.21 0.00 0.00 27.48 27.27 1yi8 h GLN 178 CO -0.08 0.86 0.05 1.15 -1.93 0.00 0.00 178.83 178.88 1yi8 h THR 179 N 1.19 0.72 -0.55 2.39 2.02 -0.75 0.89 112.91 118.83 1yi8 h THR 179 Ca 0.30 -0.06 0.06 0.00 0.77 0.00 0.00 66.41 67.48 1yi8 h THR 179 Cb 0.00 0.53 -0.05 0.00 -1.74 0.00 0.00 68.15 66.89 1yi8 h THR 179 CO -0.05 0.03 0.26 0.03 0.37 0.00 0.00 175.52 176.16 1yi8 h ARG 180 N 0.17 0.49 -0.64 6.66 2.47 -0.31 -0.43 114.38 122.79 1yi8 h ARG 180 Ca 0.22 -0.03 -0.07 0.00 -1.26 0.00 0.00 59.98 58.84 1yi8 h ARG 180 Cb 0.29 -0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 28.48 1yi8 h ARG 180 CO -0.32 0.32 0.12 0.93 0.56 0.00 0.00 179.97 181.58 1yi8 h GLU 181 N 0.50 1.03 0.01 0.04 5.08 0.03 -2.09 114.58 119.18 1yi8 h GLU 181 Ca 0.25 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1yi8 h GLU 181 Cb 0.19 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1yi8 h GLU 181 CO -0.19 0.94 -0.01 0.82 -1.00 0.00 0.00 179.01 179.57 1yi8 h ILE 182 N 0.97 1.23 -0.76 3.13 2.04 -0.16 0.14 117.51 124.10 1yi8 h ILE 182 Ca 0.20 -0.72 0.05 0.00 1.00 0.00 0.00 64.86 65.39 1yi8 h ILE 182 Cb 0.40 1.71 -0.05 0.00 -0.74 0.00 0.00 36.82 38.14 1yi8 h ILE 182 CO 0.01 0.18 0.46 0.58 0.00 0.00 0.00 178.15 179.39 1yi8 h VAL 183 N -0.32 1.06 -0.81 1.67 2.07 -1.09 0.34 116.25 119.17 1yi8 h VAL 183 Ca -0.00 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 1yi8 h VAL 183 Cb 0.31 0.10 -0.04 0.00 -1.52 0.00 0.00 31.29 30.15 1yi8 h VAL 183 CO 0.00 0.16 0.45 -0.09 0.02 0.00 0.00 177.57 178.11 1yi8 h ARG 184 N 0.88 1.13 -0.31 1.57 2.43 -1.32 0.49 114.38 119.25 1yi8 h ARG 184 Ca 0.32 -0.13 -0.15 0.00 -0.81 0.00 0.00 59.98 59.21 1yi8 h ARG 184 Cb 0.10 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 1yi8 h ARG 184 CO -0.14 0.83 -0.43 -0.09 -1.51 0.00 0.00 179.97 178.63 1yi8 h ARG 185 N 1.13 0.77 -0.18 0.20 9.65 0.33 -2.65 114.38 123.64 1yi8 h ARG 185 Ca 0.29 -0.42 -0.05 0.00 -1.10 0.00 0.00 59.98 58.70 1yi8 h ARG 185 Cb 0.02 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.62 1yi8 h ARG 185 CO -0.05 1.05 -0.08 0.35 2.80 0.00 0.00 179.97 184.04 1yi8 h PHE 186 N 0.63 0.43 -0.47 2.20 3.04 0.13 -1.81 116.94 121.09 1yi8 h PHE 186 Ca 0.04 -0.10 -0.02 0.00 3.98 0.00 0.00 57.97 61.87 1yi8 h PHE 186 Cb 0.99 -0.10 -0.02 0.00 2.56 0.00 0.00 35.95 39.38 1yi8 h PHE 186 CO 0.05 0.67 0.21 -0.91 -2.02 0.00 0.00 178.31 176.31 1yi8 h ASN 187 N 0.07 0.62 0.04 0.41 2.35 -0.94 -0.30 115.58 117.83 1yi8 h ASN 187 Ca 0.04 -0.15 -0.08 0.00 -0.55 0.00 0.00 56.30 55.56 1yi8 h ASN 187 Cb 0.55 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 1yi8 h ASN 187 CO 0.02 0.60 -0.25 0.00 -1.65 0.00 0.00 177.43 176.15 1yi8 h ALA 188 N 1.05 1.22 0.18 -0.83 0.00 -1.49 -2.82 119.26 116.57 1yi8 h ALA 188 Ca 0.16 -0.32 -0.30 0.00 0.00 0.00 0.00 54.91 54.45 1yi8 h ALA 188 Cb 0.15 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 17.86 1yi8 h ALA 188 CO -0.02 0.51 -1.35 1.25 0.00 0.00 0.00 179.25 179.65 1yi8 h LEU 189 N 0.32 0.60 0.00 0.00 5.85 -1.04 -3.45 115.31 117.59 1yi8 h LEU 189 Ca 0.05 -0.64 0.00 0.00 0.84 0.00 0.00 57.88 58.13 1yi8 h LEU 189 Cb 0.61 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1yi8 h LEU 189 CO 0.04 1.50 0.00 -1.22 -0.34 0.00 0.00 178.44 178.43 1yi8 n TYR 190 N -3.61 0.00 -3.75 1.25 0.53 -0.15 -5.09 117.16 106.35 1yi8 n TYR 190 Ca -0.12 0.00 -0.13 0.00 -1.02 0.00 0.00 57.90 56.63 1yi8 n TYR 190 Cb 1.06 0.00 -0.09 0.00 -1.03 0.00 0.00 39.34 39.27 1yi8 n TYR 190 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1yi8 s ALA 191 N -2.69 -0.88 -0.53 -0.72 0.00 -1.08 -4.99 121.76 110.88 1yi8 s ALA 191 Ca 0.00 0.71 -0.26 0.00 0.00 0.00 0.00 51.96 52.41 1yi8 s ALA 191 Cb 0.00 -0.26 -0.25 0.00 0.00 0.00 0.00 23.12 22.61 1yi8 s ALA 191 CO 0.00 -0.22 1.81 -0.35 0.00 0.00 0.00 175.76 177.00 1yi8 n PRO 192 N 2.05 0.78 0.00 0.00 -0.04 -1.14 -4.25 135.00 132.41 1yi8 n PRO 192 Ca -0.17 -1.55 0.05 0.00 -0.04 0.00 0.00 63.50 61.79 1yi8 n PRO 192 Cb 0.57 -2.92 -0.05 0.00 -0.04 0.00 0.00 33.50 31.06 1yi8 n PRO 192 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1yi8 n VAL 193 N 6.85 0.00 -4.23 0.52 0.31 -1.26 -4.98 118.33 115.54 1yi8 n VAL 193 Ca 0.47 -0.26 -0.35 0.00 -0.01 0.00 0.00 64.34 64.19 1yi8 n VAL 193 Cb 0.42 1.02 -0.08 0.00 -0.91 0.00 0.00 33.84 34.29 1yi8 n VAL 193 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1yi8 s LEU 194 N -2.40 3.78 0.35 7.52 1.43 -1.26 -5.00 118.68 123.11 1yi8 s LEU 194 Ca 0.05 0.20 -0.25 0.00 -1.03 0.00 0.00 54.13 53.10 1yi8 s LEU 194 Cb 0.08 -1.95 -0.10 0.00 0.03 0.00 0.00 46.19 44.26 1yi8 s LEU 194 CO 0.42 0.36 0.97 0.00 0.23 0.00 0.00 176.35 178.33 1yi8 s ALA 195 N -0.97 3.16 -0.23 4.21 0.00 -1.26 -4.98 121.76 121.69 1yi8 s ALA 195 Ca 0.15 0.54 -0.21 0.00 0.00 0.00 0.00 51.96 52.45 1yi8 s ALA 195 Cb -0.12 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 1yi8 s ALA 195 CO 0.05 0.10 0.64 -2.00 0.00 0.00 0.00 175.76 174.54 1yi8 s GLU 196 N -2.31 4.15 0.52 0.00 2.12 -1.26 -4.90 118.70 117.03 1yi8 s GLU 196 Ca 0.53 0.59 -0.17 0.00 0.36 0.00 0.00 54.97 56.28 1yi8 s GLU 196 Cb -0.18 -3.62 -0.07 0.00 0.26 0.00 0.00 34.13 30.52 1yi8 s GLU 196 CO 0.23 -0.35 1.01 -1.25 -0.54 0.00 0.00 175.26 174.36 1yi8 s PRO 197 N 2.27 3.76 0.09 4.30 0.04 -1.26 -4.82 135.00 139.38 1yi8 s PRO 197 Ca 0.27 1.11 0.10 0.00 0.04 0.00 0.00 61.00 62.52 1yi8 s PRO 197 Cb -0.16 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 1yi8 s PRO 197 CO 0.09 -0.43 -0.24 -0.65 0.04 0.00 0.00 177.00 175.81 1yi8 s GLN 198 N -3.84 1.67 0.42 4.56 -0.21 0.50 -4.88 119.66 117.87 1yi8 s GLN 198 Ca 0.62 -1.21 -0.14 0.00 0.02 0.00 0.00 55.36 54.66 1yi8 s GLN 198 Cb -0.13 -2.00 -0.08 0.00 1.00 0.00 0.00 33.01 31.81 1yi8 s GLN 198 CO 0.29 0.48 0.84 0.00 -2.12 0.00 0.00 175.29 174.78 1yi8 s ALA 199 N -0.99 3.24 -0.55 6.09 0.00 -1.26 -1.09 121.76 127.20 1yi8 s ALA 199 Ca 0.14 -0.00 0.04 0.00 0.00 0.00 0.00 51.96 52.14 1yi8 s ALA 199 Cb -0.10 -2.87 0.14 0.00 0.00 0.00 0.00 23.12 20.29 1yi8 s ALA 199 CO 0.05 0.00 0.32 -1.14 0.00 0.00 0.00 175.76 175.00 1yi8 s GLN 200 N -3.70 1.91 0.26 0.00 -0.44 -0.94 -4.81 119.66 111.94 1yi8 s GLN 200 Ca 0.55 -2.67 -0.31 0.00 -2.50 0.00 0.00 55.36 50.44 1yi8 s GLN 200 Cb -0.10 -3.04 -0.13 0.00 -1.64 0.00 0.00 33.01 28.09 1yi8 s GLN 200 CO 0.27 -1.18 1.35 -0.11 0.50 0.00 0.00 175.29 176.12 1yi8 n LEU 201 N 2.88 2.99 0.00 3.68 0.00 -1.26 -1.77 117.00 123.51 1yi8 n LEU 201 Ca 0.11 1.16 0.03 0.00 0.00 0.00 0.00 56.01 57.30 1yi8 n LEU 201 Cb 0.34 -1.41 -0.01 0.00 0.00 0.00 0.00 43.42 42.34 1yi8 n LEU 201 CO 0.29 -0.60 -0.04 -1.54 0.00 0.00 0.00 177.39 175.50 1yi8 n SER 202 N 1.85 -1.41 -0.58 1.96 3.41 0.33 -4.87 113.62 114.32 1yi8 n SER 202 Ca 0.10 0.22 -0.00 0.00 -0.26 0.00 0.00 58.87 58.94 1yi8 n SER 202 Cb 0.32 -0.97 -0.00 0.00 -0.26 0.00 0.00 64.21 63.29 1yi8 n SER 202 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1yi8 n ARG 203 N -1.01 0.00 -1.27 4.33 1.85 -1.26 -4.80 116.66 114.50 1yi8 n ARG 203 Ca 0.00 -0.51 0.02 0.00 -1.00 0.00 0.00 57.85 56.36 1yi8 n ARG 203 Cb 0.09 -0.14 -0.01 0.00 -1.05 0.00 0.00 32.46 31.35 1yi8 n ARG 203 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1yi8 n VAL 204 N 0.02 -2.15 -0.06 8.89 0.31 -1.26 -4.89 118.33 119.20 1yi8 n VAL 204 Ca -0.02 1.13 -0.02 0.00 -0.01 0.00 0.00 64.34 65.43 1yi8 n VAL 204 Cb 0.61 -1.87 0.00 0.00 -0.91 0.00 0.00 33.84 31.68 1yi8 n VAL 204 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1yi8 n PRO 205 N -2.63 0.00 -2.91 5.55 -0.02 -1.26 -4.90 135.00 128.83 1yi8 n PRO 205 Ca -0.01 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.07 1yi8 n PRO 205 Cb 0.42 -0.05 -0.05 0.00 -0.02 0.00 0.00 33.50 33.80 1yi8 n PRO 205 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1yi8 s ARG 206 N -0.06 4.57 0.07 -0.52 3.52 -1.26 -4.93 118.95 120.34 1yi8 s ARG 206 Ca 0.03 1.19 -0.31 0.00 -0.13 0.00 0.00 55.73 56.51 1yi8 s ARG 206 Cb -0.02 -3.35 -0.10 0.00 -1.56 0.00 0.00 34.95 29.92 1yi8 s ARG 206 CO 0.03 0.32 1.89 -0.11 -0.81 0.00 0.00 175.30 176.62 1yi8 n LEU 207 N 2.57 4.02 -4.81 -0.88 7.94 -1.26 -4.98 117.00 119.60 1yi8 n LEU 207 Ca -0.02 0.96 -0.30 0.00 -1.11 0.00 0.00 56.01 55.54 1yi8 n LEU 207 Cb 0.50 -1.52 0.09 0.00 0.53 0.00 0.00 43.42 43.02 1yi8 n LEU 207 CO 0.48 0.16 0.72 -2.16 -1.11 0.00 0.00 177.39 175.48 1yi8 s PRO 208 N 3.47 2.00 0.75 1.96 0.04 -1.26 -3.75 135.00 138.21 1yi8 s PRO 208 Ca 0.85 0.53 -0.10 0.00 0.04 0.00 0.00 61.00 62.33 1yi8 s PRO 208 Cb -0.49 -1.92 0.06 0.00 0.04 0.00 0.00 34.50 32.19 1yi8 s PRO 208 CO 0.40 -1.66 1.11 0.20 0.04 0.00 0.00 177.00 177.09 1yi8 s GLY 209 N -4.01 1.62 0.35 0.56 0.00 0.27 -4.59 107.32 101.52 1yi8 s GLY 209 Ca 0.61 -0.65 0.10 0.00 0.00 0.00 0.00 44.72 44.79 1yi8 s GLY 209 CO 0.54 -0.22 1.80 1.41 0.00 0.00 0.00 173.10 176.63 1yi8 h LEU 210 N -0.81 0.65 -2.64 0.66 -0.00 -1.50 0.07 115.31 111.74 1yi8 h LEU 210 Ca -0.45 0.08 0.00 0.00 -0.00 0.00 0.00 57.88 57.50 1yi8 h LEU 210 Cb 1.31 -0.04 0.00 0.00 -0.00 0.00 0.00 40.66 41.93 1yi8 h LEU 210 CO 0.64 0.23 0.00 -0.67 -0.00 0.00 0.00 178.44 178.64 1yi8 n ASP 211 N -4.67 4.05 0.00 -0.43 -0.08 -1.26 -1.01 116.55 113.15 1yi8 n ASP 211 Ca 0.22 -2.57 0.00 0.00 -1.51 0.00 0.00 54.79 50.93 1yi8 n ASP 211 Cb 0.63 -0.60 0.00 0.00 2.34 0.00 0.00 41.12 43.49 1yi8 n ASP 211 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1yi8 n GLY 212 N 0.50 1.06 3.77 0.27 0.00 0.01 -4.68 105.19 106.12 1yi8 n GLY 212 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 1yi8 n GLY 212 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yi8 s GLN 213 N -0.46 3.17 0.26 1.61 -0.21 -1.26 -4.73 119.66 118.05 1yi8 s GLN 213 Ca 0.00 1.62 -0.02 0.00 0.02 0.00 0.00 55.36 56.98 1yi8 s GLN 213 Cb 0.00 -1.98 0.57 0.00 1.00 0.00 0.00 33.01 32.60 1yi8 s GLN 213 CO 0.00 -1.00 1.66 0.00 -2.12 0.00 0.00 175.29 173.84 1yi8 h ALA 214 N 0.93 1.08 -3.38 6.09 0.00 -1.95 0.80 119.26 122.84 1yi8 h ALA 214 Ca -0.50 0.20 -0.66 0.00 0.00 0.00 0.00 54.91 53.95 1yi8 h ALA 214 Cb 1.27 0.28 -0.18 0.00 0.00 0.00 0.00 17.79 19.16 1yi8 h ALA 214 CO 0.56 -0.40 -0.64 0.21 0.00 0.00 0.00 179.25 178.98 1yi8 s LYS 215 N -6.00 3.22 -0.20 0.00 2.20 -1.26 -4.10 119.74 113.59 1yi8 s LYS 215 Ca -0.12 -0.46 -0.14 0.00 -0.36 0.00 0.00 55.97 54.89 1yi8 s LYS 215 Cb 0.23 -2.82 -0.04 0.00 -1.51 0.00 0.00 37.83 33.69 1yi8 s LYS 215 CO 0.76 0.53 0.29 1.41 -0.36 0.00 0.00 175.35 177.99 1yi8 s MET 216 N -0.42 4.17 -0.20 4.03 -2.45 -1.25 -3.87 119.30 119.32 1yi8 s MET 216 Ca 0.07 0.03 -0.27 0.00 -1.25 0.00 0.00 55.69 54.27 1yi8 s MET 216 Cb -0.12 -3.50 0.08 0.00 1.25 0.00 0.00 34.83 32.53 1yi8 s MET 216 CO 0.02 0.07 0.74 0.45 1.05 0.00 0.00 175.02 177.35 1yi8 s SER 217 N 0.87 -0.69 0.12 1.11 0.15 -1.26 -4.95 113.70 109.06 1yi8 s SER 217 Ca 0.15 1.13 -0.26 0.00 0.70 0.00 0.00 55.95 57.68 1yi8 s SER 217 Cb -0.14 1.08 -0.05 0.00 -1.71 0.00 0.00 66.02 65.20 1yi8 s SER 217 CO 0.05 -0.36 1.64 0.50 1.20 0.00 0.00 173.24 176.27 1yi8 h LYS 218 N 4.21 -0.37 -0.74 5.44 3.64 -1.94 -0.62 116.57 126.19 1yi8 h LYS 218 Ca -0.28 0.03 0.15 0.00 -1.27 0.00 0.00 60.65 59.28 1yi8 h LYS 218 Cb 1.15 0.08 -0.14 0.00 -0.41 0.00 0.00 32.23 32.92 1yi8 h LYS 218 CO 0.17 -0.25 -0.16 1.03 -2.27 0.00 0.00 179.45 177.98 1yi8 h SER 219 N -0.39 -0.64 0.80 4.20 0.87 -2.02 0.90 113.55 117.28 1yi8 h SER 219 Ca 0.06 0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 1yi8 h SER 219 Cb 0.47 0.44 0.00 0.00 -0.44 0.00 0.00 62.40 62.87 1yi8 h SER 219 CO -0.22 -0.23 0.00 0.18 -0.53 0.00 0.00 176.83 176.03 1yi8 n LEU 220 N -5.47 0.23 -0.57 2.23 4.77 -0.82 -4.91 117.00 112.46 1yi8 n LEU 220 Ca 0.10 0.54 -0.07 0.00 -0.03 0.00 0.00 56.01 56.55 1yi8 n LEU 220 Cb 0.39 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 40.96 1yi8 n LEU 220 CO 0.01 -0.23 -0.07 0.61 -1.33 0.00 0.00 177.39 176.37 1yi8 n GLY 221 N 0.56 0.95 1.76 -0.72 0.00 0.31 -4.94 105.19 103.12 1yi8 n GLY 221 Ca 0.04 -0.65 -0.16 0.00 0.00 0.00 0.00 46.02 45.25 1yi8 n GLY 221 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1yi8 n ASN 222 N 0.67 4.05 -4.65 1.61 0.23 -1.12 -5.02 115.26 111.03 1yi8 n ASN 222 Ca -0.07 -3.68 -0.25 0.00 -0.53 0.00 0.00 54.58 50.04 1yi8 n ASN 222 Cb 0.26 -0.39 -0.09 0.00 -2.08 0.00 0.00 39.78 37.48 1yi8 n ASN 222 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1yi8 s ALA 223 N -3.49 3.26 -0.22 -2.53 0.00 -1.26 -1.23 121.76 116.30 1yi8 s ALA 223 Ca 0.47 -2.07 0.01 0.00 0.00 0.00 0.00 51.96 50.37 1yi8 s ALA 223 Cb 0.40 -0.25 0.05 0.00 0.00 0.00 0.00 23.12 23.32 1yi8 s ALA 223 CO 0.01 -0.02 -0.10 0.42 0.00 0.00 0.00 175.76 176.07 1yi8 s ILE 224 N -2.58 1.77 0.53 0.00 1.01 -1.26 -5.01 121.20 115.66 1yi8 s ILE 224 Ca 0.36 -1.20 -0.19 0.00 0.00 0.00 0.00 60.65 59.62 1yi8 s ILE 224 Cb 0.03 -1.88 -0.07 0.00 0.01 0.00 0.00 42.46 40.55 1yi8 s ILE 224 CO 0.20 0.09 1.05 0.00 0.00 0.00 0.00 174.94 176.27 1yi8 s ALA 225 N 1.32 2.82 0.46 9.38 0.00 -1.26 -1.29 121.76 133.18 1yi8 s ALA 225 Ca -0.04 0.54 0.13 0.00 0.00 0.00 0.00 51.96 52.60 1yi8 s ALA 225 Cb -0.17 -3.25 1.03 0.00 0.00 0.00 0.00 23.12 20.73 1yi8 s ALA 225 CO -0.07 -0.50 2.04 -0.07 0.00 0.00 0.00 175.76 177.15 1yi8 h LEU 226 N 1.15 0.09 -0.59 0.00 4.07 -1.72 -0.67 115.31 117.64 1yi8 h LEU 226 Ca -0.49 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.46 1yi8 h LEU 226 Cb 1.22 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.94 1yi8 h LEU 226 CO 0.58 0.18 0.00 0.61 -1.08 0.00 0.00 178.44 178.73 1yi8 n GLY 227 N -1.21 -0.36 3.77 0.83 0.00 -1.26 -4.69 105.19 102.26 1yi8 n GLY 227 Ca -0.02 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.26 1yi8 n GLY 227 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yi8 s ASP 228 N -1.89 6.71 0.80 1.61 1.01 -0.26 -4.97 116.67 119.67 1yi8 s ASP 228 Ca 0.39 2.72 -0.12 0.00 0.71 0.00 0.00 52.55 56.26 1yi8 s ASP 228 Cb 0.20 -2.65 0.07 0.00 1.01 0.00 0.00 42.92 41.56 1yi8 s ASP 228 CO 0.32 -0.60 1.13 -0.94 0.21 0.00 0.00 175.17 175.30 1yi8 s SER 229 N -0.32 4.04 0.45 0.27 1.04 -1.26 -4.71 113.70 113.21 1yi8 s SER 229 Ca 0.51 2.04 0.14 0.00 0.48 0.00 0.00 55.95 59.12 1yi8 s SER 229 Cb -0.41 -2.55 1.05 0.00 0.10 0.00 0.00 66.02 64.22 1yi8 s SER 229 CO 0.53 -2.35 2.02 0.00 0.98 0.00 0.00 173.24 174.41 1yi8 h ALA 230 N -1.08 1.99 0.52 5.32 0.00 -1.99 0.85 119.26 124.87 1yi8 h ALA 230 Ca -0.44 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1yi8 h ALA 230 Cb 1.25 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.97 1yi8 h ALA 230 CO 0.48 -0.09 -0.25 0.22 0.00 0.00 0.00 179.25 179.62 1yi8 h ASP 231 N 0.36 -0.59 -0.35 0.00 3.58 -1.99 -1.69 116.42 115.73 1yi8 h ASP 231 Ca 0.21 -0.06 0.08 0.00 0.42 0.00 0.00 57.03 57.68 1yi8 h ASP 231 Cb 0.39 0.15 -0.08 0.00 1.72 0.00 0.00 39.33 41.51 1yi8 h ASP 231 CO -0.05 -0.26 -0.18 -0.33 -2.88 0.00 0.00 179.24 175.54 1yi8 h GLU 232 N -0.95 -0.12 -0.68 0.28 4.39 -1.75 0.17 114.58 115.91 1yi8 h GLU 232 Ca -0.07 0.01 0.13 0.00 0.34 0.00 0.00 59.36 59.77 1yi8 h GLU 232 Cb 0.62 0.03 -0.09 0.00 -0.10 0.00 0.00 28.75 29.20 1yi8 h GLU 232 CO 0.12 -0.08 0.21 0.28 -1.16 0.00 0.00 179.01 178.38 1yi8 h VAL 233 N -0.13 0.64 0.08 3.13 2.07 -0.83 0.21 116.25 121.42 1yi8 h VAL 233 Ca 0.18 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.59 1yi8 h VAL 233 Cb 0.40 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1yi8 h VAL 233 CO -0.43 0.06 -0.12 0.00 0.02 0.00 0.00 177.57 177.10 1yi8 h ALA 234 N 1.52 -0.20 -0.28 1.67 0.00 0.20 -1.83 119.26 120.34 1yi8 h ALA 234 Ca 0.37 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.30 1yi8 h ALA 234 Cb 0.56 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 1yi8 h ALA 234 CO -0.41 -0.64 0.07 0.00 0.00 0.00 0.00 179.25 178.26 1yi8 h ARG 235 N -0.25 0.17 -0.68 0.00 3.08 0.91 -2.22 114.38 115.39 1yi8 h ARG 235 Ca 0.02 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.11 1yi8 h ARG 235 Cb 0.26 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.22 1yi8 h ARG 235 CO -0.06 0.11 0.39 0.87 -1.07 0.00 0.00 179.97 180.21 1yi8 h LYS 236 N 0.17 0.72 -0.28 0.04 1.57 -0.52 -1.59 116.57 116.68 1yi8 h LYS 236 Ca 0.13 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1yi8 h LYS 236 Cb 0.13 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1yi8 h LYS 236 CO -0.16 0.47 0.01 0.28 -0.57 0.00 0.00 179.45 179.48 1yi8 h VAL 237 N 0.74 1.17 -0.59 0.50 2.07 -0.98 -2.90 116.25 116.25 1yi8 h VAL 237 Ca 0.30 -0.65 -0.08 0.00 0.82 0.00 0.00 66.70 67.09 1yi8 h VAL 237 Cb 0.15 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1yi8 h VAL 237 CO -0.16 0.22 0.04 0.24 0.02 0.00 0.00 177.57 177.93 1yi8 h MET 238 N 0.41 0.98 -0.65 1.57 2.86 -0.69 -2.86 114.93 116.56 1yi8 h MET 238 Ca 0.09 -0.27 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 1yi8 h MET 238 Cb 0.26 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.81 1yi8 h MET 238 CO 0.01 0.94 0.00 0.41 1.06 0.00 0.00 176.91 179.33 1yi8 n GLY 239 N -0.57 1.85 3.77 8.32 0.00 -1.05 -4.96 105.19 112.55 1yi8 n GLY 239 Ca 0.03 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 45.18 1yi8 n GLY 239 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1yi8 s MET 240 N -1.80 3.81 0.59 1.61 -1.94 -1.08 -4.89 119.30 115.60 1yi8 s MET 240 Ca 0.29 1.98 -0.19 0.00 -1.71 0.00 0.00 55.69 56.06 1yi8 s MET 240 Cb 0.20 -2.57 -0.04 0.00 2.01 0.00 0.00 34.83 34.44 1yi8 s MET 240 CO 0.12 -0.56 1.24 -0.47 -0.01 0.00 0.00 175.02 175.34 1yi8 s TYR 241 N -1.39 2.34 0.00 -0.03 5.04 -0.18 -4.96 117.35 118.17 1yi8 s TYR 241 Ca 0.61 1.49 0.00 0.00 -2.44 0.00 0.00 57.07 56.73 1yi8 s TYR 241 Cb -0.34 -3.56 0.00 0.00 0.35 0.00 0.00 41.96 38.41 1yi8 s TYR 241 CO 0.42 -2.41 0.00 0.25 -1.34 0.00 0.00 175.55 172.47 1yi8 n THR 242 N -1.50 0.00 -3.27 4.34 -2.24 -1.26 -4.43 114.28 105.92 1yi8 n THR 242 Ca 0.13 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.85 1yi8 n THR 242 Cb 0.49 -0.21 -0.05 0.00 -2.10 0.00 0.00 70.33 68.46 1yi8 n THR 242 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1yi8 s ASP 243 N 0.47 -0.07 0.29 3.42 2.15 -1.26 -4.09 116.67 117.59 1yi8 s ASP 243 Ca 0.00 -0.43 0.16 0.00 0.43 0.00 0.00 52.55 52.71 1yi8 s ASP 243 Cb 0.00 1.29 1.05 0.00 -0.30 0.00 0.00 42.92 44.97 1yi8 s ASP 243 CO 0.00 -0.32 1.27 -0.81 -0.17 0.00 0.00 175.17 175.14 1yi8 n PRO 244 N 5.18 -0.05 0.00 4.34 -0.04 -1.26 0.12 135.00 143.29 1yi8 n PRO 244 Ca 0.03 1.11 0.14 0.00 -0.04 0.00 0.00 63.50 64.74 1yi8 n PRO 244 Cb 0.50 -1.99 0.54 0.00 -0.04 0.00 0.00 33.50 32.51 1yi8 n PRO 244 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1yi8 n GLY 245 N -1.22 -1.33 3.62 0.55 0.00 -1.26 -4.67 105.19 100.88 1yi8 n GLY 245 Ca 0.30 -0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1yi8 n GLY 245 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1yi8 s HIS 246 N -2.88 3.28 -0.05 1.61 5.04 0.31 -4.91 115.29 117.70 1yi8 s HIS 246 Ca 0.17 0.79 0.06 0.00 -1.54 0.00 0.00 55.06 54.54 1yi8 s HIS 246 Cb 0.19 -2.82 -0.09 0.00 0.04 0.00 0.00 32.58 29.90 1yi8 s HIS 246 CO 0.56 -0.32 0.06 1.28 -2.34 0.00 0.00 174.74 173.98 1yi8 n LEU 247 N 5.68 0.00 -3.78 8.88 4.32 -1.26 -4.78 117.00 126.06 1yi8 n LEU 247 Ca -0.01 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.89 1yi8 n LEU 247 Cb 0.49 0.11 -0.06 0.00 -1.62 0.00 0.00 43.42 42.34 1yi8 n LEU 247 CO 0.42 0.11 -0.01 0.00 -1.22 0.00 0.00 177.39 176.69 1yi8 s ARG 248 N -2.25 0.91 0.19 3.23 3.03 -1.26 -5.09 118.95 117.72 1yi8 s ARG 248 Ca -0.03 -0.87 -0.13 0.00 2.03 0.00 0.00 55.73 56.73 1yi8 s ARG 248 Cb 0.03 0.38 0.20 0.00 -1.03 0.00 0.00 34.95 34.53 1yi8 s ARG 248 CO 0.27 -0.31 1.67 0.00 -1.13 0.00 0.00 175.30 175.80 1yi8 h ALA 249 N 2.64 0.47 -0.96 7.88 0.00 -1.90 -2.18 119.26 125.21 1yi8 h ALA 249 Ca -0.34 0.17 0.19 0.00 0.00 0.00 0.00 54.91 54.92 1yi8 h ALA 249 Cb 1.22 0.30 -0.11 0.00 0.00 0.00 0.00 17.79 19.20 1yi8 h ALA 249 CO 0.53 -0.40 0.55 0.66 0.00 0.00 0.00 179.25 180.59 1yi8 h SER 250 N 0.09 0.68 -3.66 0.00 4.64 -1.91 0.81 113.55 114.20 1yi8 h SER 250 Ca 0.26 0.10 -0.56 0.00 -0.47 0.00 0.00 61.79 61.13 1yi8 h SER 250 Cb 0.40 -0.01 0.17 0.00 -0.31 0.00 0.00 62.40 62.66 1yi8 h SER 250 CO -0.46 0.23 0.07 0.47 -0.87 0.00 0.00 176.83 176.27 1yi8 n ASP 251 N -4.82 0.44 -4.86 4.97 9.92 -0.82 -2.04 116.55 119.34 1yi8 n ASP 251 Ca 0.22 0.71 -0.32 0.00 -0.53 0.00 0.00 54.79 54.87 1yi8 n ASP 251 Cb 0.56 -1.38 -0.05 0.00 -0.64 0.00 0.00 41.12 39.61 1yi8 n ASP 251 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 1yi8 s PRO 252 N -3.08 3.91 0.19 -0.24 0.04 -1.26 -3.82 135.00 130.74 1yi8 s PRO 252 Ca 0.74 0.59 0.04 0.00 0.04 0.00 0.00 61.00 62.42 1yi8 s PRO 252 Cb -0.37 -2.41 -0.05 0.00 0.04 0.00 0.00 34.50 31.71 1yi8 s PRO 252 CO 0.49 0.07 -0.06 0.20 0.04 0.00 0.00 177.00 177.75 1yi8 s GLY 253 N -2.64 1.33 -0.01 0.56 0.00 -0.81 -4.62 107.32 101.13 1yi8 s GLY 253 Ca 0.53 -1.64 -0.10 0.00 0.00 0.00 0.00 44.72 43.52 1yi8 s GLY 253 CO 0.23 -1.64 0.30 -1.60 0.00 0.00 0.00 173.10 170.40 1yi8 s ARG 254 N -3.80 3.69 -0.15 2.90 3.52 -1.26 -3.98 118.95 119.87 1yi8 s ARG 254 Ca 0.23 0.12 -0.15 0.00 -0.13 0.00 0.00 55.73 55.79 1yi8 s ARG 254 Cb 0.04 -3.14 -0.12 0.00 -1.56 0.00 0.00 34.95 30.17 1yi8 s ARG 254 CO 0.05 0.68 0.16 0.28 -0.81 0.00 0.00 175.30 175.66 1yi8 h VAL 255 N 3.47 0.62 -2.58 7.11 2.07 -1.94 -3.41 116.25 121.59 1yi8 h VAL 255 Ca -0.52 -1.61 -0.60 0.00 0.82 0.00 0.00 66.70 64.79 1yi8 h VAL 255 Cb 1.21 1.32 0.09 0.00 -1.52 0.00 0.00 31.29 32.40 1yi8 h VAL 255 CO 0.63 0.21 0.41 -1.84 0.02 0.00 0.00 177.57 177.00 1yi8 n GLU 256 N -4.59 1.71 0.00 1.57 0.00 -1.26 -0.80 120.64 117.27 1yi8 n GLU 256 Ca -0.14 0.61 0.00 0.00 0.00 0.00 0.00 57.16 57.63 1yi8 n GLU 256 Cb 0.38 -2.15 0.00 0.00 0.00 0.00 0.00 31.44 29.67 1yi8 n GLU 256 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1yi8 n GLY 257 N 1.68 3.04 3.52 -1.84 0.00 -1.26 -4.96 105.19 105.37 1yi8 n GLY 257 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1yi8 n GLY 257 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1yi8 s ASN 258 N -0.98 6.26 0.44 1.61 3.04 0.02 -4.90 114.94 120.44 1yi8 s ASN 258 Ca 0.00 -0.47 0.20 0.00 0.04 0.00 0.00 52.86 52.63 1yi8 s ASN 258 Cb 0.00 -2.48 1.16 0.00 -1.54 0.00 0.00 41.25 38.39 1yi8 s ASN 258 CO 0.00 -1.49 1.87 1.55 -3.04 0.00 0.00 177.10 175.99 1yi8 h PRO 259 N 9.61 0.31 -0.90 0.43 0.13 -1.81 -0.88 132.00 138.88 1yi8 h PRO 259 Ca -0.27 -0.02 0.15 0.00 -0.87 0.00 0.00 66.00 64.99 1yi8 h PRO 259 Cb 1.06 -0.07 -0.07 0.00 0.13 0.00 0.00 31.00 32.05 1yi8 h PRO 259 CO 1.18 0.21 0.58 0.28 -0.23 0.00 0.00 178.00 180.02 1yi8 h VAL 260 N 0.32 0.81 0.00 1.56 2.07 -1.92 0.77 116.25 119.86 1yi8 h VAL 260 Ca 0.45 -0.23 -0.10 0.00 0.82 0.00 0.00 66.70 67.64 1yi8 h VAL 260 Cb 1.23 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1yi8 h VAL 260 CO -0.14 0.12 -0.81 -0.26 0.02 0.00 0.00 177.57 176.51 1yi8 h PHE 261 N 0.67 0.00 -0.03 1.57 -1.00 -1.47 -2.84 116.94 113.84 1yi8 h PHE 261 Ca 0.46 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 61.05 1yi8 h PHE 261 Cb 0.77 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.32 1yi8 h PHE 261 CO -0.00 0.40 -0.79 1.15 -1.61 0.00 0.00 178.31 177.46 1yi8 h THR 262 N 0.00 1.43 -0.28 -1.55 2.02 -0.68 -2.57 112.91 111.27 1yi8 h THR 262 Ca -0.05 -2.33 -0.13 0.00 0.77 0.00 0.00 66.41 64.67 1yi8 h THR 262 Cb 1.35 2.27 -0.01 0.00 -1.74 0.00 0.00 68.15 70.02 1yi8 h THR 262 CO 0.04 0.69 -0.34 -0.26 0.37 0.00 0.00 175.52 176.02 1yi8 h PHE 263 N 0.19 0.73 -0.42 3.16 0.05 0.39 -3.08 116.94 117.96 1yi8 h PHE 263 Ca -0.04 -0.19 -0.09 0.00 3.82 0.00 0.00 57.97 61.47 1yi8 h PHE 263 Cb 1.38 -0.16 -0.02 0.00 2.00 0.00 0.00 35.95 39.15 1yi8 h PHE 263 CO 0.04 0.88 -0.11 -0.07 -0.18 0.00 0.00 178.31 178.87 1yi8 h LEU 264 N 0.53 0.74 -1.35 1.54 3.38 -1.33 -2.53 115.31 116.28 1yi8 h LEU 264 Ca 0.06 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 1yi8 h LEU 264 Cb 0.84 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1yi8 h LEU 264 CO 0.07 0.88 -0.18 0.44 0.09 0.00 0.00 178.44 179.74 1yi8 h ASP 265 N 0.68 0.00 0.59 -0.43 3.32 -1.38 0.15 116.42 119.35 1yi8 h ASP 265 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1yi8 h ASP 265 Cb 0.58 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1yi8 h ASP 265 CO 0.04 0.18 -0.86 0.00 -1.72 0.00 0.00 179.24 176.88 1yi8 n ALA 266 N -2.23 3.23 0.00 3.45 0.00 -1.07 -4.62 120.51 119.27 1yi8 n ALA 266 Ca -0.00 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1yi8 n ALA 266 Cb 0.37 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.77 1yi8 n ALA 266 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1yi8 n PHE 267 N -2.00 0.00 -1.97 0.00 3.72 -0.98 -4.99 117.46 111.25 1yi8 n PHE 267 Ca 0.03 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.00 1yi8 n PHE 267 Cb 0.43 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.95 1yi8 n PHE 267 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1yi8 s ASP 268 N -0.80 6.30 0.38 4.37 3.68 0.03 -4.87 116.67 125.76 1yi8 s ASP 268 Ca 0.00 1.89 0.07 0.00 2.13 0.00 0.00 52.55 56.64 1yi8 s ASP 268 Cb 0.00 -2.53 0.79 0.00 -1.45 0.00 0.00 42.92 39.73 1yi8 s ASP 268 CO 0.00 -1.28 1.97 1.55 0.13 0.00 0.00 175.17 177.54 1yi8 h PRO 269 N 11.15 0.67 -4.75 4.34 0.13 -1.95 -3.39 132.00 138.20 1yi8 h PRO 269 Ca -0.38 -0.04 -0.67 0.00 -0.87 0.00 0.00 66.00 64.04 1yi8 h PRO 269 Cb 1.18 -0.15 -0.37 0.00 0.13 0.00 0.00 31.00 31.79 1yi8 h PRO 269 CO 0.98 0.44 -0.72 0.16 -0.23 0.00 0.00 178.00 178.63 1yi8 s ASP 270 N -6.24 4.74 0.50 1.44 3.84 -1.26 -4.96 116.67 114.74 1yi8 s ASP 270 Ca -0.09 -1.66 0.33 0.00 -0.00 0.00 0.00 52.55 51.12 1yi8 s ASP 270 Cb 0.19 -1.64 1.79 0.00 -1.38 0.00 0.00 42.92 41.88 1yi8 s ASP 270 CO 0.77 -0.30 2.01 1.55 -0.00 0.00 0.00 175.17 179.19 1yi8 h PRO 271 N 7.81 0.00 -0.29 2.11 0.13 -1.96 -1.83 132.00 137.97 1yi8 h PRO 271 Ca -0.14 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.93 1yi8 h PRO 271 Cb 1.04 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 1yi8 h PRO 271 CO 0.52 0.00 -0.03 0.00 -0.23 0.00 0.00 178.00 178.27 1yi8 h ALA 272 N 1.95 0.40 0.20 -0.56 0.00 -1.96 0.38 119.26 119.66 1yi8 h ALA 272 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1yi8 h ALA 272 Cb 0.05 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1yi8 h ALA 272 CO 0.00 0.17 -0.10 -0.09 0.00 0.00 0.00 179.25 179.23 1yi8 h ARG 273 N 0.31 -0.26 -0.42 0.00 2.43 -1.77 -1.57 114.38 113.10 1yi8 h ARG 273 Ca 0.08 0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.35 1yi8 h ARG 273 Cb 0.48 0.06 -0.09 0.00 -0.42 0.00 0.00 29.97 29.99 1yi8 h ARG 273 CO 0.02 0.02 -0.35 0.28 -1.51 0.00 0.00 179.97 178.43 1yi8 h VAL 274 N -0.53 0.19 -0.28 0.20 2.07 -1.33 0.43 116.25 117.01 1yi8 h VAL 274 Ca -0.03 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 1yi8 h VAL 274 Cb 0.40 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 1yi8 h VAL 274 CO 0.04 0.00 -0.06 -0.61 0.02 0.00 0.00 177.57 176.97 1yi8 h GLN 275 N -0.26 0.44 -0.12 1.57 5.75 -0.26 -1.19 115.11 121.04 1yi8 h GLN 275 Ca 0.17 -0.10 -0.02 0.00 -0.15 0.00 0.00 58.65 58.55 1yi8 h GLN 275 Cb 0.55 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 29.04 1yi8 h GLN 275 CO -0.56 0.52 0.00 0.00 -2.65 0.00 0.00 178.83 176.13 1yi8 h ALA 276 N 1.52 0.16 -0.55 3.38 0.00 0.05 -1.60 119.26 122.24 1yi8 h ALA 276 Ca 0.09 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.84 1yi8 h ALA 276 Cb 0.37 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1yi8 h ALA 276 CO 0.02 -0.14 0.33 -0.07 0.00 0.00 0.00 179.25 179.38 1yi8 h LEU 277 N -0.05 0.53 -0.73 0.00 -0.00 0.08 -1.92 115.31 113.22 1yi8 h LEU 277 Ca 0.03 0.01 0.06 0.00 -0.00 0.00 0.00 57.88 57.98 1yi8 h LEU 277 Cb 0.36 -0.11 -0.06 0.00 -0.00 0.00 0.00 40.66 40.86 1yi8 h LEU 277 CO 0.01 0.37 0.42 0.11 -0.00 0.00 0.00 178.44 179.34 1yi8 h LYS 278 N 0.65 0.74 0.00 1.13 1.57 -1.11 -1.15 116.57 118.40 1yi8 h LYS 278 Ca 0.22 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1yi8 h LYS 278 Cb 0.03 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.18 1yi8 h LYS 278 CO -0.10 0.49 0.00 -0.25 -0.57 0.00 0.00 179.45 179.02 1yi8 n ASP 279 N -4.74 0.00 0.29 0.86 10.43 -0.61 -2.30 116.55 120.48 1yi8 n ASP 279 Ca 0.10 0.89 0.11 0.00 2.57 0.00 0.00 54.79 58.46 1yi8 n ASP 279 Cb 0.18 -0.39 0.60 0.00 1.84 0.00 0.00 41.12 43.36 1yi8 n ASP 279 CO 0.00 0.00 0.00 1.56 -1.07 0.00 0.00 177.20 177.69 1yi8 h GLN 280 N 0.00 0.00 0.20 -1.24 4.20 -1.29 -0.93 115.11 116.05 1yi8 h GLN 280 Ca 0.00 0.00 -0.30 0.00 0.06 0.00 0.00 58.65 58.41 1yi8 h GLN 280 Cb 0.00 0.00 0.03 0.00 0.30 0.00 0.00 27.48 27.81 1yi8 h GLN 280 CO 0.00 0.00 -1.38 -0.92 -0.67 0.00 0.00 178.83 175.86 1yi8 h TYR 281 N 0.00 0.78 -0.02 2.96 3.20 -0.92 -2.63 116.97 120.34 1yi8 h TYR 281 Ca 0.00 -0.57 -0.11 0.00 3.14 0.00 0.00 58.73 61.19 1yi8 h TYR 281 Cb 0.83 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 39.05 1yi8 h TYR 281 CO 0.00 1.53 -0.52 0.00 -1.64 0.00 0.00 178.16 177.53 1yi8 h ARG 282 N -0.03 0.05 0.00 1.82 3.08 -0.78 -2.15 114.38 116.37 1yi8 h ARG 282 Ca -0.25 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.77 1yi8 h ARG 282 Cb 2.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.05 1yi8 h ARG 282 CO 0.21 0.56 0.00 0.00 -1.07 0.00 0.00 179.97 179.67 1yi8 n ALA 283 N -2.45 -0.05 0.00 0.04 0.00 -0.69 -4.29 120.51 113.07 1yi8 n ALA 283 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1yi8 n ALA 283 Cb 0.54 0.02 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1yi8 n ALA 283 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yi8 n GLY 284 N -0.58 4.04 0.58 0.00 0.00 -0.99 -4.33 105.19 103.91 1yi8 n GLY 284 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1yi8 n GLY 284 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yi8 n GLY 285 N -1.50 1.89 3.34 -0.02 0.00 0.28 -4.90 105.19 104.28 1yi8 n GLY 285 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 1yi8 n GLY 285 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1yi8 s LEU 286 N 0.00 5.96 1.04 0.99 1.98 -1.18 -4.60 118.68 122.86 1yi8 s LEU 286 Ca 0.00 -1.81 -0.14 0.00 -2.89 0.00 0.00 54.13 49.29 1yi8 s LEU 286 Cb 0.00 -2.25 0.21 0.00 0.66 0.00 0.00 46.19 44.81 1yi8 s LEU 286 CO 0.00 -0.91 1.11 -0.83 -1.89 0.00 0.00 176.35 173.82 1yi8 s GLY 287 N 3.41 1.57 0.41 7.98 0.00 -1.26 -4.81 107.32 114.62 1yi8 s GLY 287 Ca 0.09 -0.55 0.16 0.00 0.00 0.00 0.00 44.72 44.43 1yi8 s GLY 287 CO 0.02 0.13 1.89 -0.55 0.00 0.00 0.00 173.10 174.59 1yi8 h ASP 288 N -2.01 0.00 -0.09 1.64 3.32 -1.94 -3.08 116.42 114.26 1yi8 h ASP 288 Ca -0.52 0.00 0.02 0.00 0.02 0.00 0.00 57.03 56.55 1yi8 h ASP 288 Cb 1.32 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.85 1yi8 h ASP 288 CO 0.53 0.29 -0.03 0.58 -1.72 0.00 0.00 179.24 178.89 1yi8 h VAL 289 N 0.00 0.89 -0.14 -1.35 2.07 -1.98 0.38 116.25 116.13 1yi8 h VAL 289 Ca -0.00 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.42 1yi8 h VAL 289 Cb 0.57 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1yi8 h VAL 289 CO 0.04 0.00 -0.36 0.11 0.02 0.00 0.00 177.57 177.38 1yi8 h LYS 290 N -0.02 0.29 -0.02 1.57 1.79 -1.91 0.61 116.57 118.88 1yi8 h LYS 290 Ca 0.05 -0.12 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 1yi8 h LYS 290 Cb 0.09 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 1yi8 h LYS 290 CO -0.10 0.61 -0.06 0.28 -1.08 0.00 0.00 179.45 179.10 1yi8 h VAL 291 N 0.25 1.49 -0.92 0.50 2.07 -1.43 -2.80 116.25 115.41 1yi8 h VAL 291 Ca 0.03 -1.52 -0.01 0.00 0.82 0.00 0.00 66.70 66.03 1yi8 h VAL 291 Cb 0.75 2.46 -0.04 0.00 -1.52 0.00 0.00 31.29 32.94 1yi8 h VAL 291 CO 0.06 0.40 0.55 0.11 0.02 0.00 0.00 177.57 178.71 1yi8 h LYS 292 N -0.53 1.25 -0.72 1.57 1.57 -0.18 -0.20 116.57 119.32 1yi8 h LYS 292 Ca -0.00 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1yi8 h LYS 292 Cb 0.69 -0.26 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 1yi8 h LYS 292 CO 0.01 0.87 0.41 -0.22 -0.57 0.00 0.00 179.45 179.95 1yi8 h LYS 293 N 1.27 0.99 0.00 3.15 1.63 -0.90 0.19 116.57 122.90 1yi8 h LYS 293 Ca 0.33 -0.10 -0.07 0.00 -0.85 0.00 0.00 60.65 59.96 1yi8 h LYS 293 Cb -0.05 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 31.37 1yi8 h LYS 293 CO -0.06 0.72 -0.35 1.25 -3.45 0.00 0.00 179.45 177.56 1yi8 h HIS 294 N 1.00 0.00 -0.21 1.91 2.76 -0.93 -2.29 115.15 117.39 1yi8 h HIS 294 Ca 0.26 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.35 1yi8 h HIS 294 Cb 0.00 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 28.96 1yi8 h HIS 294 CO 0.01 0.35 -0.19 1.25 -1.30 0.00 0.00 177.93 178.05 1yi8 h LEU 295 N 0.00 0.53 -0.97 0.26 6.46 0.38 -2.39 115.31 119.58 1yi8 h LEU 295 Ca -0.00 -0.47 0.12 0.00 -0.12 0.00 0.00 57.88 57.41 1yi8 h LEU 295 Cb 0.89 -0.15 -0.09 0.00 -0.73 0.00 0.00 40.66 40.59 1yi8 h LEU 295 CO 0.05 0.89 0.60 0.40 -0.62 0.00 0.00 178.44 179.75 1yi8 h ILE 296 N 0.18 0.89 -0.38 4.05 2.04 -0.66 0.23 117.51 123.85 1yi8 h ILE 296 Ca 0.04 -0.32 -0.12 0.00 1.00 0.00 0.00 64.86 65.45 1yi8 h ILE 296 Cb 0.73 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 1yi8 h ILE 296 CO 0.05 0.17 -0.24 0.44 0.00 0.00 0.00 178.15 178.57 1yi8 h ASP 297 N 0.93 0.87 -0.37 1.72 3.45 -1.29 -0.97 116.42 120.76 1yi8 h ASP 297 Ca 0.49 -0.42 -0.14 0.00 0.43 0.00 0.00 57.03 57.38 1yi8 h ASP 297 Cb 0.51 -0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 39.03 1yi8 h ASP 297 CO -0.28 1.11 -0.31 1.62 -1.57 0.00 0.00 179.24 179.81 1yi8 h VAL 298 N 0.64 1.28 -0.51 -1.35 3.04 -0.74 -2.74 116.25 115.87 1yi8 h VAL 298 Ca 0.08 -1.48 -0.11 0.00 -1.01 0.00 0.00 66.70 64.18 1yi8 h VAL 298 Cb 0.80 1.39 -0.02 0.00 -2.01 0.00 0.00 31.29 31.46 1yi8 h VAL 298 CO 0.07 0.49 -0.12 -0.07 -1.01 0.00 0.00 177.57 176.93 1yi8 h LEU 299 N 0.67 0.96 -2.03 3.16 3.38 -0.59 -2.18 115.31 118.69 1yi8 h LEU 299 Ca 0.07 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1yi8 h LEU 299 Cb 0.89 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 1yi8 h LEU 299 CO 0.08 1.08 -0.04 0.78 0.09 0.00 0.00 178.44 180.43 1yi8 h ASN 300 N 0.85 0.00 0.67 -0.43 4.21 -1.13 0.15 115.58 119.90 1yi8 h ASN 300 Ca 0.13 0.00 -0.27 0.00 1.21 0.00 0.00 56.30 57.38 1yi8 h ASN 300 Cb 0.66 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.86 1yi8 h ASN 300 CO 0.05 0.04 -1.25 1.23 -1.29 0.00 0.00 177.43 176.20 1yi8 h GLY 301 N 1.14 0.24 1.12 2.83 0.00 -1.10 -1.35 103.07 105.95 1yi8 h GLY 301 Ca -0.00 -0.61 -0.29 0.00 0.00 0.00 0.00 47.33 46.44 1yi8 h GLY 301 CO 0.00 0.53 -1.22 -2.08 0.00 0.00 0.00 176.54 173.78 1yi8 h VAL 302 N 0.06 1.33 0.11 4.60 2.07 -0.91 -3.38 116.25 120.12 1yi8 h VAL 302 Ca -0.13 -2.53 -0.27 0.00 0.82 0.00 0.00 66.70 64.59 1yi8 h VAL 302 Cb 1.94 2.90 -0.00 0.00 -1.52 0.00 0.00 31.29 34.60 1yi8 h VAL 302 CO 0.18 0.75 -1.26 -0.07 0.02 0.00 0.00 177.57 177.20 1yi8 h LEU 303 N 0.10 0.36 -0.52 2.57 4.07 -0.83 -3.39 115.31 117.67 1yi8 h LEU 303 Ca -0.20 -0.40 0.10 0.00 0.08 0.00 0.00 57.88 57.47 1yi8 h LEU 303 Cb 1.92 -0.12 -0.11 0.00 1.08 0.00 0.00 40.66 43.44 1yi8 h LEU 303 CO 0.23 1.31 -0.25 0.00 -1.08 0.00 0.00 178.44 178.65 1yi8 h ALA 304 N 0.63 0.10 -0.16 1.53 0.00 -1.42 0.23 119.26 120.17 1yi8 h ALA 304 Ca -0.13 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1yi8 h ALA 304 Cb 1.95 0.61 -0.01 0.00 0.00 0.00 0.00 17.79 20.34 1yi8 h ALA 304 CO 0.19 -0.58 -0.03 -1.00 0.00 0.00 0.00 179.25 177.83 1yi8 h PRO 305 N -0.13 0.23 -0.10 0.00 0.13 -1.80 -1.17 132.00 129.16 1yi8 h PRO 305 Ca 0.24 -0.04 -0.12 0.00 -0.87 0.00 0.00 66.00 65.21 1yi8 h PRO 305 Cb 0.50 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.58 1yi8 h PRO 305 CO -0.60 0.28 -0.49 0.82 -0.23 0.00 0.00 178.00 177.78 1yi8 h ILE 306 N 0.23 1.34 -0.22 -3.56 2.04 -0.88 -2.46 117.51 114.00 1yi8 h ILE 306 Ca 0.05 -1.71 -0.12 0.00 1.00 0.00 0.00 64.86 64.07 1yi8 h ILE 306 Cb 0.20 1.81 -0.00 0.00 -0.74 0.00 0.00 36.82 38.09 1yi8 h ILE 306 CO 0.01 0.51 -0.35 0.03 0.00 0.00 0.00 178.15 178.35 1yi8 h ARG 307 N 0.20 0.63 0.43 2.37 3.08 0.27 -2.16 114.38 119.19 1yi8 h ARG 307 Ca 0.01 -0.38 -0.02 0.00 0.07 0.00 0.00 59.98 59.66 1yi8 h ARG 307 Cb 0.94 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.03 1yi8 h ARG 307 CO 0.08 0.99 -0.20 1.79 -1.07 0.00 0.00 179.97 181.55 1yi8 h THR 308 N 0.32 0.58 -0.43 2.04 1.35 -1.20 -0.76 112.91 114.81 1yi8 h THR 308 Ca 0.02 -0.10 0.06 0.00 -0.55 0.00 0.00 66.41 65.85 1yi8 h THR 308 Cb 0.94 0.63 -0.05 0.00 -1.73 0.00 0.00 68.15 67.93 1yi8 h THR 308 CO 0.08 0.02 0.12 0.03 -0.25 0.00 0.00 175.52 175.52 1yi8 h ARG 309 N -0.63 0.26 -0.53 4.72 3.08 -1.52 -0.13 114.38 119.62 1yi8 h ARG 309 Ca -0.06 -0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.05 1yi8 h ARG 309 Cb 0.47 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.40 1yi8 h ARG 309 CO 0.10 0.17 0.21 -0.09 -1.07 0.00 0.00 179.97 179.28 1yi8 h ARG 310 N 0.26 0.38 -0.67 0.04 2.43 -1.22 0.48 114.38 116.09 1yi8 h ARG 310 Ca 0.21 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.30 1yi8 h ARG 310 Cb 0.24 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 1yi8 h ARG 310 CO -0.25 0.25 0.21 0.00 -1.51 0.00 0.00 179.97 178.67 1yi8 h ALA 311 N 1.35 0.88 -0.02 2.80 0.00 -0.44 -1.87 119.26 121.96 1yi8 h ALA 311 Ca 0.26 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1yi8 h ALA 311 Cb 0.27 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1yi8 h ALA 311 CO -0.25 0.56 -0.10 0.93 0.00 0.00 0.00 179.25 180.39 1yi8 h GLU 312 N 0.98 -0.15 0.00 0.00 5.08 -0.32 -2.03 114.58 118.13 1yi8 h GLU 312 Ca 0.22 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.56 1yi8 h GLU 312 Cb 0.30 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1yi8 h GLU 312 CO -0.01 -0.10 -0.13 1.88 -1.00 0.00 0.00 179.01 179.65 1yi8 h TYR 313 N -0.16 0.00 -0.35 4.33 0.05 -0.75 -1.51 116.97 118.58 1yi8 h TYR 313 Ca 0.05 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.77 1yi8 h TYR 313 Cb 0.22 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.94 1yi8 h TYR 313 CO -0.17 0.13 -0.01 0.93 -1.05 0.00 0.00 178.16 177.99 1yi8 h GLU 314 N 0.00 0.55 0.00 4.88 5.08 -0.59 -1.42 114.58 123.08 1yi8 h GLU 314 Ca -0.00 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.17 1yi8 h GLU 314 Cb 0.34 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1yi8 h GLU 314 CO 0.02 0.59 -0.28 0.00 -1.00 0.00 0.00 179.01 178.33 1yi8 h ARG 315 N 0.52 0.00 -2.24 2.33 2.47 -1.09 -3.32 114.38 113.05 1yi8 h ARG 315 Ca 0.11 0.00 -0.66 0.00 -1.26 0.00 0.00 59.98 58.17 1yi8 h ARG 315 Cb 0.36 0.00 -0.37 0.00 -1.65 0.00 0.00 29.97 28.31 1yi8 h ARG 315 CO 0.01 0.28 -0.14 -3.47 0.56 0.00 0.00 179.97 177.22 1yi8 n ASP 316 N -3.38 5.38 -0.17 7.04 -0.08 -0.54 -4.87 116.55 119.92 1yi8 n ASP 316 Ca 0.00 -3.69 0.22 0.00 -1.51 0.00 0.00 54.79 49.82 1yi8 n ASP 316 Cb 0.49 -0.74 0.62 0.00 2.34 0.00 0.00 41.12 43.83 1yi8 n ASP 316 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1yi8 h PRO 317 N 3.31 0.19 -0.29 -0.67 0.13 -1.65 0.22 132.00 133.24 1yi8 h PRO 317 Ca 0.26 -0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 65.31 1yi8 h PRO 317 Cb 0.46 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.53 1yi8 h PRO 317 CO 0.93 0.12 -0.13 -0.44 -0.23 0.00 0.00 178.00 178.26 1yi8 h ASP 318 N 0.19 0.47 -0.22 1.44 3.32 -1.89 -2.58 116.42 117.16 1yi8 h ASP 318 Ca 0.41 -0.12 -0.07 0.00 0.02 0.00 0.00 57.03 57.27 1yi8 h ASP 318 Cb 1.32 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.73 1yi8 h ASP 318 CO -0.08 0.63 -0.09 0.00 -1.72 0.00 0.00 179.24 177.98 1yi8 h ALA 319 N 1.42 1.20 -0.27 3.45 0.00 -0.90 -0.68 119.26 123.48 1yi8 h ALA 319 Ca 0.08 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 1yi8 h ALA 319 Cb 0.49 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1yi8 h ALA 319 CO 0.03 0.52 -0.29 0.28 0.00 0.00 0.00 179.25 179.79 1yi8 h VAL 320 N 0.54 1.31 -0.82 0.00 2.07 -1.39 -2.33 116.25 115.63 1yi8 h VAL 320 Ca 0.10 -1.46 -0.02 0.00 0.82 0.00 0.00 66.70 66.14 1yi8 h VAL 320 Cb 0.48 1.63 -0.04 0.00 -1.52 0.00 0.00 31.29 31.84 1yi8 h VAL 320 CO 0.03 0.46 0.42 0.25 0.02 0.00 0.00 177.57 178.75 1yi8 h LEU 321 N 0.40 1.05 -0.82 2.57 6.46 -1.26 -1.93 115.31 121.78 1yi8 h LEU 321 Ca 0.04 -0.12 -0.02 0.00 -0.12 0.00 0.00 57.88 57.66 1yi8 h LEU 321 Cb 0.86 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 40.48 1yi8 h LEU 321 CO 0.07 0.87 0.43 -0.09 -0.62 0.00 0.00 178.44 179.10 1yi8 h ARG 322 N 1.15 1.15 -0.48 1.25 2.43 -1.05 0.11 114.38 118.94 1yi8 h ARG 322 Ca 0.28 -0.15 0.09 0.00 -0.81 0.00 0.00 59.98 59.40 1yi8 h ARG 322 Cb 0.08 -0.22 -0.08 0.00 -0.42 0.00 0.00 29.97 29.34 1yi8 h ARG 322 CO -0.04 0.86 0.01 0.35 -1.51 0.00 0.00 179.97 179.64 1yi8 h PHE 323 N 1.14 -0.02 0.18 2.20 -0.00 -0.79 -1.88 116.94 117.77 1yi8 h PHE 323 Ca 0.28 0.03 -0.33 0.00 -0.00 0.00 0.00 57.97 57.96 1yi8 h PHE 323 Cb 0.06 0.08 0.01 0.00 -0.00 0.00 0.00 35.95 36.10 1yi8 h PHE 323 CO 0.01 -0.10 -1.56 -0.39 -0.00 0.00 0.00 178.31 176.27 1yi8 h VAL 324 N 0.12 1.16 0.00 1.41 -1.51 -1.16 -2.94 116.25 113.33 1yi8 h VAL 324 Ca 0.24 -2.71 -0.03 0.00 -1.23 0.00 0.00 66.70 62.96 1yi8 h VAL 324 Cb 0.35 2.86 -0.00 0.00 -2.13 0.00 0.00 31.29 32.37 1yi8 h VAL 324 CO -0.39 0.84 -0.14 0.71 -1.23 0.00 0.00 177.57 177.35 1yi8 h THR 325 N 0.10 0.41 0.08 7.19 1.35 -0.96 -0.17 112.91 120.93 1yi8 h THR 325 Ca -0.27 -0.82 -0.33 0.00 -0.55 0.00 0.00 66.41 64.44 1yi8 h THR 325 Cb 2.08 1.59 -0.03 0.00 -1.73 0.00 0.00 68.15 70.07 1yi8 h THR 325 CO 0.20 0.14 -1.83 -0.08 -0.25 0.00 0.00 175.52 173.71 1yi8 h GLU 326 N 0.00 0.18 -0.40 4.72 4.81 -1.45 -2.73 114.58 119.71 1yi8 h GLU 326 Ca -0.00 -0.31 -0.03 0.00 -0.13 0.00 0.00 59.36 58.89 1yi8 h GLU 326 Cb 0.58 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.06 1yi8 h GLU 326 CO 0.02 0.97 0.13 0.78 -0.73 0.00 0.00 179.01 180.17 1yi8 h GLY 327 N 1.97 0.67 0.33 1.92 0.00 -1.42 -2.73 103.07 103.81 1yi8 h GLY 327 Ca -0.35 -0.39 0.08 0.00 0.00 0.00 0.00 47.33 46.67 1yi8 h GLY 327 CO 0.10 0.37 0.06 -0.84 0.00 0.00 0.00 176.54 176.23 1yi8 h THR 328 N 0.50 0.70 -0.55 4.70 2.02 -0.53 0.23 112.91 119.99 1yi8 h THR 328 Ca 0.13 -0.06 0.08 0.00 0.77 0.00 0.00 66.41 67.32 1yi8 h THR 328 Cb 0.25 0.50 -0.06 0.00 -1.74 0.00 0.00 68.15 67.10 1yi8 h THR 328 CO -0.00 0.03 0.22 0.00 0.37 0.00 0.00 175.52 176.14 1yi8 h ALA 329 N 1.39 0.70 0.07 6.16 0.00 -1.27 0.56 119.26 126.87 1yi8 h ALA 329 Ca 0.24 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 1yi8 h ALA 329 Cb 0.33 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1yi8 h ALA 329 CO -0.34 -0.18 -0.03 -0.09 0.00 0.00 0.00 179.25 178.61 1yi8 h ARG 330 N 0.41 -0.09 -0.98 0.00 9.65 -1.01 -1.78 114.38 120.58 1yi8 h ARG 330 Ca 0.27 0.01 0.01 0.00 -1.10 0.00 0.00 59.98 59.16 1yi8 h ARG 330 Cb 0.29 0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 28.84 1yi8 h ARG 330 CO -0.26 0.02 0.64 0.78 2.80 0.00 0.00 179.97 183.95 1yi8 h GLY 331 N -0.18 1.39 0.97 2.80 0.00 0.22 -0.74 103.07 107.52 1yi8 h GLY 331 Ca -0.01 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 46.79 1yi8 h GLY 331 CO 0.02 0.52 0.01 -0.09 0.00 0.00 0.00 176.54 177.00 1yi8 h ARG 332 N 1.34 0.02 -0.90 4.80 1.12 0.30 -1.31 114.38 119.74 1yi8 h ARG 332 Ca 0.36 -0.00 0.02 0.00 -1.11 0.00 0.00 59.98 59.25 1yi8 h ARG 332 Cb -0.13 -0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 29.78 1yi8 h ARG 332 CO -0.07 0.05 0.59 1.49 -3.11 0.00 0.00 179.97 178.91 1yi8 h GLU 333 N -0.01 1.14 0.15 0.20 4.81 -0.73 0.14 114.58 120.27 1yi8 h GLU 333 Ca 0.01 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1yi8 h GLU 333 Cb 0.03 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.16 1yi8 h GLU 333 CO -0.00 0.75 -0.07 0.28 -0.73 0.00 0.00 179.01 179.24 1yi8 h VAL 334 N 1.17 0.95 -0.98 0.32 2.07 -0.92 -2.15 116.25 116.71 1yi8 h VAL 334 Ca 0.35 -0.50 0.03 0.00 0.82 0.00 0.00 66.70 67.40 1yi8 h VAL 334 Cb -0.06 1.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 1yi8 h VAL 334 CO -0.10 0.12 0.64 0.00 0.02 0.00 0.00 177.57 178.25 1yi8 h ALA 335 N 0.36 1.28 -0.66 1.67 0.00 -1.05 -1.87 119.26 118.99 1yi8 h ALA 335 Ca -0.02 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.88 1yi8 h ALA 335 Cb 0.35 -0.36 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1yi8 h ALA 335 CO 0.03 0.56 0.38 0.00 0.00 0.00 0.00 179.25 180.23 1yi8 h ALA 336 N 1.39 0.88 0.23 0.00 0.00 -0.58 -1.34 119.26 119.83 1yi8 h ALA 336 Ca 0.38 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.28 1yi8 h ALA 336 Cb -0.05 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1yi8 h ALA 336 CO -0.11 0.09 -0.11 1.96 0.00 0.00 0.00 179.25 181.08 1yi8 h GLN 337 N 0.72 -0.30 -0.41 0.00 4.20 -0.68 -2.14 115.11 116.50 1yi8 h GLN 337 Ca 0.29 0.02 0.06 0.00 0.06 0.00 0.00 58.65 59.08 1yi8 h GLN 337 Cb 0.13 0.07 -0.06 0.00 0.30 0.00 0.00 27.48 27.92 1yi8 h GLN 337 CO -0.15 -0.20 0.08 1.15 -0.67 0.00 0.00 178.83 179.04 1yi8 h THR 338 N -0.31 0.79 -0.61 -0.54 2.02 -1.20 0.21 112.91 113.27 1yi8 h THR 338 Ca -0.03 -0.07 0.04 0.00 0.77 0.00 0.00 66.41 67.12 1yi8 h THR 338 Cb 0.24 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.17 1yi8 h THR 338 CO 0.05 0.04 0.40 -0.07 0.37 0.00 0.00 175.52 176.31 1yi8 h LEU 339 N 0.21 0.59 -0.24 2.58 -0.00 -1.17 0.25 115.31 117.53 1yi8 h LEU 339 Ca 0.20 -0.00 0.03 0.00 -0.00 0.00 0.00 57.88 58.11 1yi8 h LEU 339 Cb 0.24 -0.13 -0.03 0.00 -0.00 0.00 0.00 40.66 40.74 1yi8 h LEU 339 CO -0.26 0.40 0.03 1.23 -0.00 0.00 0.00 178.44 179.84 1yi8 h GLY 340 N 0.68 0.25 1.65 0.83 0.00 -0.28 0.42 103.07 106.63 1yi8 h GLY 340 Ca 0.25 -0.01 -0.14 0.00 0.00 0.00 0.00 47.33 47.43 1yi8 h GLY 340 CO -0.07 -0.02 -0.53 1.46 0.00 0.00 0.00 176.54 177.39 1yi8 h GLN 341 N 0.12 0.37 0.05 4.80 1.08 -0.67 -2.47 115.11 118.39 1yi8 h GLN 341 Ca 0.11 -0.22 -0.00 0.00 -1.45 0.00 0.00 58.65 57.08 1yi8 h GLN 341 Cb 0.12 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1yi8 h GLN 341 CO -0.15 0.81 -0.03 0.28 -0.95 0.00 0.00 178.83 178.79 1yi8 h VAL 342 N 0.29 1.02 -0.33 -0.54 2.07 0.10 0.73 116.25 119.59 1yi8 h VAL 342 Ca 0.01 -0.22 0.05 0.00 0.82 0.00 0.00 66.70 67.36 1yi8 h VAL 342 Cb 1.02 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 1yi8 h VAL 342 CO 0.09 0.06 0.06 0.03 0.02 0.00 0.00 177.57 177.82 1yi8 h ARG 343 N -0.17 0.16 -0.22 1.57 3.08 -0.15 0.49 114.38 119.14 1yi8 h ARG 343 Ca -0.01 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1yi8 h ARG 343 Cb 0.15 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1yi8 h ARG 343 CO 0.01 0.11 0.11 -0.09 -1.07 0.00 0.00 179.97 179.04 1yi8 h ARG 344 N 0.17 0.32 -0.22 0.04 2.43 -1.31 -2.60 114.38 113.21 1yi8 h ARG 344 Ca 0.16 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 1yi8 h ARG 344 Cb 0.18 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1yi8 h ARG 344 CO -0.21 0.34 0.09 0.00 -1.51 0.00 0.00 179.97 178.68 1yi8 h ALA 345 N 0.97 1.75 0.00 2.80 0.00 -0.38 -1.30 119.26 123.10 1yi8 h ALA 345 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1yi8 h ALA 345 Cb 0.13 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1yi8 h ALA 345 CO -0.01 0.21 0.00 -1.33 0.00 0.00 0.00 179.25 178.12 1yi8 n MET 346 N -4.45 0.41 -2.23 0.00 2.81 0.12 -4.36 117.12 109.43 1yi8 n MET 346 Ca 0.00 0.00 -0.14 0.00 -1.81 0.00 0.00 57.70 55.75 1yi8 n MET 346 Cb 0.12 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.12 1yi8 n MET 346 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1yi8 n ARG 347 N -1.29 -1.13 -1.87 0.03 5.12 -0.49 -4.95 116.66 112.08 1yi8 n ARG 347 Ca 0.14 0.71 -0.42 0.00 -1.93 0.00 0.00 57.85 56.35 1yi8 n ARG 347 Cb 0.24 -4.99 -0.02 0.00 -1.16 0.00 0.00 32.46 26.53 1yi8 n ARG 347 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1yi8 s LEU 348 N -4.07 4.36 -0.19 0.55 1.43 -1.01 -4.84 118.68 114.92 1yi8 s LEU 348 Ca 0.00 2.80 -0.42 0.00 -1.03 0.00 0.00 54.13 55.48 1yi8 s LEU 348 Cb 0.00 -3.62 -0.19 0.00 0.03 0.00 0.00 46.19 42.41 1yi8 s LEU 348 CO 0.00 -0.84 1.36 0.33 0.23 0.00 0.00 176.35 177.43 1yi8 n PHE 349 N 2.74 1.30 -0.48 0.29 -0.00 -1.26 -1.04 117.46 119.01 1yi8 n PHE 349 Ca 0.10 0.98 0.00 0.00 -0.00 0.00 0.00 57.45 58.52 1yi8 n PHE 349 Cb 0.38 -2.21 0.00 0.00 -0.00 0.00 0.00 39.48 37.65 1yi8 n PHE 349 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1yi8 n GLY 350 N 2.80 0.76 0.00 7.13 0.00 -1.26 -5.15 105.19 109.47 1yi8 n GLY 350 Ca 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1yi8 n GLY 350 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74