#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yj9 s ARG 2 N 0.00 0.33 -0.13 -0.52 3.52 -1.26 -2.33 118.95 118.57 1yj9 s ARG 2 Ca 0.00 0.67 -0.05 0.00 -0.13 0.00 0.00 55.73 56.22 1yj9 s ARG 2 Cb 0.00 0.38 -0.04 0.00 -1.56 0.00 0.00 34.95 33.74 1yj9 s ARG 2 CO 0.00 -0.29 0.05 0.14 -0.81 0.00 0.00 175.30 174.39 1yj9 s VAL 3 N 2.80 4.70 -0.16 7.11 -7.23 0.34 -4.96 120.40 122.99 1yj9 s VAL 3 Ca 0.04 -0.09 -0.02 0.00 -1.81 0.00 0.00 61.98 60.10 1yj9 s VAL 3 Cb -0.11 -3.04 -0.01 0.00 0.56 0.00 0.00 36.38 33.78 1yj9 s VAL 3 CO -0.16 0.56 -0.09 -1.61 -0.31 0.00 0.00 175.10 173.49 1yj9 s GLU 4 N -0.45 3.44 -0.28 4.82 2.02 -1.26 -1.72 118.70 125.27 1yj9 s GLU 4 Ca 0.09 -0.63 0.01 0.00 0.02 0.00 0.00 54.97 54.46 1yj9 s GLU 4 Cb -0.12 -2.80 0.06 0.00 0.10 0.00 0.00 34.13 31.36 1yj9 s GLU 4 CO 0.02 0.09 -0.05 -0.51 0.02 0.00 0.00 175.26 174.83 1yj9 s LEU 5 N 0.70 3.69 0.02 1.80 1.43 -0.27 -4.95 118.68 121.11 1yj9 s LEU 5 Ca -0.04 -1.36 -0.30 0.00 -1.03 0.00 0.00 54.13 51.40 1yj9 s LEU 5 Cb -0.15 -1.63 -0.06 0.00 0.03 0.00 0.00 46.19 44.38 1yj9 s LEU 5 CO 0.02 -0.23 1.41 -1.61 0.23 0.00 0.00 176.35 176.17 1yj9 s GLU 6 N 1.17 4.29 0.08 1.70 2.02 -1.26 -0.74 118.70 125.95 1yj9 s GLU 6 Ca -0.07 2.00 -0.26 0.00 0.02 0.00 0.00 54.97 56.66 1yj9 s GLU 6 Cb -0.20 -3.52 -0.06 0.00 0.10 0.00 0.00 34.13 30.45 1yj9 s GLU 6 CO -0.03 -0.56 0.82 -1.50 0.02 0.00 0.00 175.26 174.01 1yj9 s ILE 7 N 2.20 4.61 0.40 -1.63 2.07 0.60 -4.95 121.20 124.49 1yj9 s ILE 7 Ca 0.64 1.76 -0.25 0.00 -1.41 0.00 0.00 60.65 61.39 1yj9 s ILE 7 Cb -0.33 -4.17 -0.11 0.00 0.13 0.00 0.00 42.46 37.98 1yj9 s ILE 7 CO 0.27 0.38 0.95 -2.65 -1.91 0.00 0.00 174.94 171.98 1yj9 n PRO 8 N 2.59 1.24 -0.16 3.50 -0.02 -1.26 -4.87 135.00 136.01 1yj9 n PRO 8 Ca -0.02 0.44 0.11 0.00 -2.02 0.00 0.00 63.50 62.02 1yj9 n PRO 8 Cb 0.50 -1.93 0.44 0.00 -0.02 0.00 0.00 33.50 32.48 1yj9 n PRO 8 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1yj9 h GLU 9 N 1.50 0.54 -0.61 -0.52 4.11 -1.98 0.31 114.58 117.93 1yj9 h GLU 9 Ca -0.43 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1yj9 h GLU 9 Cb 1.35 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.44 1yj9 h GLU 9 CO 0.57 0.36 0.39 0.22 0.07 0.00 0.00 179.01 180.62 1yj9 h ASP 10 N 0.56 0.71 -2.06 3.06 1.82 -2.00 -3.45 116.42 115.06 1yj9 h ASP 10 Ca 0.33 -0.02 -0.45 0.00 -0.39 0.00 0.00 57.03 56.50 1yj9 h ASP 10 Cb 0.55 -0.18 -0.00 0.00 0.68 0.00 0.00 39.33 40.38 1yj9 h ASP 10 CO -0.11 0.52 -0.38 -0.69 -1.61 0.00 0.00 179.24 176.97 1yj9 s VAL 11 N -5.68 4.77 -0.02 2.25 1.01 0.10 -4.62 120.40 118.20 1yj9 s VAL 11 Ca -0.10 -0.97 -0.02 0.00 0.00 0.00 0.00 61.98 60.89 1yj9 s VAL 11 Cb 0.18 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.88 1yj9 s VAL 11 CO 0.76 -0.27 0.06 -0.62 0.00 0.00 0.00 175.10 175.03 1yj9 s ASP 12 N -4.06 -0.04 -0.12 3.32 -1.08 -1.14 -4.72 116.67 108.83 1yj9 s ASP 12 Ca 0.39 0.08 -0.04 0.00 -0.52 0.00 0.00 52.55 52.45 1yj9 s ASP 12 Cb -0.09 0.13 0.06 0.00 -1.46 0.00 0.00 42.92 41.55 1yj9 s ASP 12 CO 0.30 -0.05 0.22 0.00 0.52 0.00 0.00 175.17 176.16 1yj9 s ALA 13 N -0.10 -0.37 0.32 3.66 0.00 -1.26 -1.35 121.76 122.67 1yj9 s ALA 13 Ca -0.01 0.72 0.06 0.00 0.00 0.00 0.00 51.96 52.73 1yj9 s ALA 13 Cb -0.01 -0.96 -0.01 0.00 0.00 0.00 0.00 23.12 22.13 1yj9 s ALA 13 CO 0.00 -0.66 0.45 -2.00 0.00 0.00 0.00 175.76 173.55 1yj9 s GLU 14 N 2.36 3.16 -0.17 0.00 2.12 -0.62 -4.94 118.70 120.61 1yj9 s GLU 14 Ca 0.03 -0.98 -0.08 0.00 0.36 0.00 0.00 54.97 54.30 1yj9 s GLU 14 Cb -0.12 -2.83 0.07 0.00 0.26 0.00 0.00 34.13 31.51 1yj9 s GLU 14 CO -0.08 0.11 0.38 -1.14 -0.54 0.00 0.00 175.26 174.00 1yj9 s GLN 15 N -4.15 0.33 -0.18 4.30 -0.44 -1.26 -1.34 119.66 116.92 1yj9 s GLN 15 Ca 0.43 0.83 0.00 0.00 -2.50 0.00 0.00 55.36 54.13 1yj9 s GLN 15 Cb -0.09 0.07 0.04 0.00 -1.64 0.00 0.00 33.01 31.39 1yj9 s GLN 15 CO 0.31 -0.20 -0.08 0.16 0.50 0.00 0.00 175.29 175.98 1yj9 s ASP 16 N 1.86 3.05 1.36 6.67 -4.77 -0.85 -4.99 116.67 119.01 1yj9 s ASP 16 Ca -0.06 -0.74 0.00 0.00 -3.30 0.00 0.00 52.55 48.45 1yj9 s ASP 16 Cb -0.10 -1.06 0.00 0.00 -1.09 0.00 0.00 42.92 40.67 1yj9 s ASP 16 CO -0.12 -0.16 0.00 1.41 0.70 0.00 0.00 175.17 177.00 1yj9 n HIS 17 N 4.79 0.00 -0.86 2.11 8.25 -1.26 -2.32 115.22 125.94 1yj9 n HIS 17 Ca -0.13 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.40 1yj9 n HIS 17 Cb 0.47 0.00 0.36 0.00 1.12 0.00 0.00 29.99 31.95 1yj9 n HIS 17 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1yj9 n LEU 18 N 0.00 5.14 -4.53 2.41 4.77 -1.26 -4.92 117.00 118.61 1yj9 n LEU 18 Ca 0.00 -2.84 -0.34 0.00 -0.03 0.00 0.00 56.01 52.80 1yj9 n LEU 18 Cb 0.00 -0.63 -0.11 0.00 -2.33 0.00 0.00 43.42 40.35 1yj9 n LEU 18 CO 0.00 0.68 -0.33 -1.81 -1.33 0.00 0.00 177.39 174.60 1yj9 s ASP 19 N -1.05 5.01 -0.11 -1.43 1.01 -0.98 -0.60 116.67 118.52 1yj9 s ASP 19 Ca 0.51 -0.08 0.03 0.00 0.71 0.00 0.00 52.55 53.72 1yj9 s ASP 19 Cb 0.38 -1.83 0.00 0.00 1.01 0.00 0.00 42.92 42.48 1yj9 s ASP 19 CO 0.16 0.17 -0.22 -0.63 0.21 0.00 0.00 175.17 174.86 1yj9 s ILE 20 N 0.38 2.18 -0.05 0.77 1.01 0.75 -2.00 121.20 124.24 1yj9 s ILE 20 Ca -0.02 -0.97 0.05 0.00 0.00 0.00 0.00 60.65 59.71 1yj9 s ILE 20 Cb -0.14 -1.85 -0.02 0.00 0.01 0.00 0.00 42.46 40.47 1yj9 s ILE 20 CO 0.02 0.55 -0.21 -0.89 0.00 0.00 0.00 174.94 174.42 1yj9 s THR 21 N 0.44 2.45 -0.15 2.92 2.01 -0.45 -0.07 115.64 122.79 1yj9 s THR 21 Ca -0.16 -0.94 -0.02 0.00 0.31 0.00 0.00 61.69 60.88 1yj9 s THR 21 Cb -0.17 -1.92 0.05 0.00 0.01 0.00 0.00 72.50 70.47 1yj9 s THR 21 CO 0.07 0.58 0.03 -0.69 -0.69 0.00 0.00 174.62 173.91 1yj9 s VAL 22 N -0.42 0.42 -0.10 3.82 1.01 0.15 -1.59 120.40 123.69 1yj9 s VAL 22 Ca 0.04 -0.27 -0.03 0.00 0.00 0.00 0.00 61.98 61.72 1yj9 s VAL 22 Cb -0.12 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 35.42 1yj9 s VAL 22 CO 0.01 -0.04 0.03 -1.61 0.00 0.00 0.00 175.10 173.50 1yj9 s GLU 23 N 1.92 3.14 0.25 2.72 2.02 -0.45 -0.69 118.70 127.61 1yj9 s GLU 23 Ca 0.02 -0.35 -0.03 0.00 0.02 0.00 0.00 54.97 54.63 1yj9 s GLU 23 Cb -0.15 -2.90 -0.02 0.00 0.10 0.00 0.00 34.13 31.16 1yj9 s GLU 23 CO -0.07 0.68 0.29 0.20 0.02 0.00 0.00 175.26 176.38 1yj9 s GLY 24 N -0.81 1.38 0.00 -1.39 0.00 0.13 -2.86 107.32 103.76 1yj9 s GLY 24 Ca 0.13 -1.54 0.02 0.00 0.00 0.00 0.00 44.72 43.32 1yj9 s GLY 24 CO 0.03 -1.17 1.05 1.22 0.00 0.00 0.00 173.10 174.22 1yj9 n ASP 25 N -0.67 0.01 -0.78 1.64 8.00 -0.98 -0.46 116.55 123.31 1yj9 n ASP 25 Ca 0.02 0.50 0.07 0.00 0.71 0.00 0.00 54.79 56.09 1yj9 n ASP 25 Cb 0.64 -0.50 0.17 0.00 -0.02 0.00 0.00 41.12 41.41 1yj9 n ASP 25 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1yj9 n ASN 26 N -1.51 3.02 0.00 -2.24 5.15 0.14 -5.01 115.26 114.81 1yj9 n ASN 26 Ca 0.00 -1.93 0.00 0.00 -0.60 0.00 0.00 54.58 52.06 1yj9 n ASN 26 Cb 0.02 -0.24 0.00 0.00 -0.53 0.00 0.00 39.78 39.02 1yj9 n ASN 26 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1yj9 n GLY 27 N 0.81 0.96 3.55 8.20 0.00 0.39 -4.60 105.19 114.50 1yj9 n GLY 27 Ca 0.14 -2.25 -0.27 0.00 0.00 0.00 0.00 46.02 43.63 1yj9 n GLY 27 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1yj9 s SER 28 N 0.00 4.16 -0.08 1.61 1.04 -1.26 0.18 113.70 119.35 1yj9 s SER 28 Ca 0.00 -0.59 -0.04 0.00 0.48 0.00 0.00 55.95 55.80 1yj9 s SER 28 Cb 0.00 -0.67 0.04 0.00 0.10 0.00 0.00 66.02 65.49 1yj9 s SER 28 CO 0.00 0.12 0.19 -0.69 0.98 0.00 0.00 173.24 173.84 1yj9 s VAL 29 N -1.62 -0.04 0.02 5.02 1.01 0.13 -4.78 120.40 120.14 1yj9 s VAL 29 Ca 0.24 0.13 0.07 0.00 0.00 0.00 0.00 61.98 62.41 1yj9 s VAL 29 Cb -0.09 -0.30 -0.02 0.00 0.00 0.00 0.00 36.38 35.97 1yj9 s VAL 29 CO 0.14 0.05 -0.20 -0.89 0.00 0.00 0.00 175.10 174.21 1yj9 s THR 30 N 0.97 1.58 0.06 3.92 2.01 -1.26 0.32 115.64 123.25 1yj9 s THR 30 Ca -0.07 -1.04 -0.09 0.00 0.31 0.00 0.00 61.69 60.80 1yj9 s THR 30 Cb -0.09 -1.35 0.00 0.00 0.01 0.00 0.00 72.50 71.07 1yj9 s THR 30 CO -0.06 0.29 0.20 -0.13 -0.69 0.00 0.00 174.62 174.23 1yj9 s ARG 31 N -0.88 0.77 -0.22 4.92 0.52 0.90 -4.97 118.95 119.98 1yj9 s ARG 31 Ca 0.07 -0.76 -0.09 0.00 -0.52 0.00 0.00 55.73 54.42 1yj9 s ARG 31 Cb -0.08 0.32 -0.05 0.00 0.52 0.00 0.00 34.95 35.66 1yj9 s ARG 31 CO 0.01 -0.23 0.13 0.50 0.02 0.00 0.00 175.30 175.72 1yj9 s ARG 32 N -3.12 4.03 -0.60 3.54 3.52 -1.26 -0.18 118.95 124.89 1yj9 s ARG 32 Ca -0.01 -0.30 0.03 0.00 -0.13 0.00 0.00 55.73 55.33 1yj9 s ARG 32 Cb 0.01 -3.43 0.15 0.00 -1.56 0.00 0.00 34.95 30.12 1yj9 s ARG 32 CO -0.07 0.13 0.36 -0.51 -0.81 0.00 0.00 175.30 174.40 1yj9 s LEU 33 N 0.84 4.59 -0.29 -0.88 1.43 0.23 -5.00 118.68 119.60 1yj9 s LEU 33 Ca 0.06 -3.28 -0.01 0.00 -1.03 0.00 0.00 54.13 49.88 1yj9 s LEU 33 Cb -0.13 -1.67 0.05 0.00 0.03 0.00 0.00 46.19 44.47 1yj9 s LEU 33 CO 0.02 -0.20 -0.03 0.86 0.23 0.00 0.00 176.35 177.23 1yj9 s TRP 34 N -0.66 3.25 -0.03 0.29 -0.00 -1.26 -4.87 118.94 115.66 1yj9 s TRP 34 Ca 0.20 -1.95 -0.08 0.00 -0.00 0.00 0.00 56.10 54.27 1yj9 s TRP 34 Cb -0.19 -2.06 0.01 0.00 -0.00 0.00 0.00 33.47 31.23 1yj9 s TRP 34 CO -0.06 -0.82 0.18 -0.47 -0.00 0.00 0.00 176.95 175.79 1yj9 s TYR 35 N 1.22 -0.08 0.04 5.86 5.04 -1.26 -5.12 117.35 123.05 1yj9 s TYR 35 Ca -0.06 0.17 -0.34 0.00 -2.44 0.00 0.00 57.07 54.40 1yj9 s TYR 35 Cb -0.20 0.01 -0.13 0.00 0.35 0.00 0.00 41.96 42.00 1yj9 s TYR 35 CO -0.02 -0.22 1.72 -2.30 -1.34 0.00 0.00 175.55 173.38 1yj9 n PRO 36 N 2.04 2.13 -0.95 4.97 -0.02 -1.26 -2.48 135.00 139.43 1yj9 n PRO 36 Ca -0.19 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1yj9 n PRO 36 Cb 0.57 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1yj9 n PRO 36 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1yj9 n ASP 37 N 4.92 -4.48 -4.48 2.55 8.00 -1.26 -4.98 116.55 116.83 1yj9 n ASP 37 Ca 0.20 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.31 1yj9 n ASP 37 Cb 0.29 -2.61 -0.11 0.00 -0.02 0.00 0.00 41.12 38.66 1yj9 n ASP 37 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1yj9 s ILE 38 N -1.33 4.89 -0.24 0.53 1.01 -1.03 -4.21 121.20 120.82 1yj9 s ILE 38 Ca 0.00 -0.32 -0.10 0.00 0.00 0.00 0.00 60.65 60.24 1yj9 s ILE 38 Cb 0.00 -3.49 -0.05 0.00 0.01 0.00 0.00 42.46 38.93 1yj9 s ILE 38 CO 0.00 0.05 0.14 -1.81 0.00 0.00 0.00 174.94 173.31 1yj9 s ASP 39 N 1.66 5.89 -0.21 3.58 1.01 0.11 -4.63 116.67 124.08 1yj9 s ASP 39 Ca 0.05 0.05 -0.06 0.00 0.71 0.00 0.00 52.55 53.30 1yj9 s ASP 39 Cb -0.17 -2.06 -0.03 0.00 1.01 0.00 0.00 42.92 41.67 1yj9 s ASP 39 CO 0.08 0.06 0.03 -0.69 0.21 0.00 0.00 175.17 174.86 1yj9 s VAL 40 N 1.10 4.21 0.25 -1.27 1.01 -1.26 -2.26 120.40 122.17 1yj9 s VAL 40 Ca 0.07 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 61.84 1yj9 s VAL 40 Cb -0.14 -2.92 -0.05 0.00 0.00 0.00 0.00 36.38 33.27 1yj9 s VAL 40 CO 0.04 0.41 0.07 -0.94 0.00 0.00 0.00 175.10 174.69 1yj9 s SER 41 N 1.05 1.35 -0.07 3.32 1.04 0.02 -4.96 113.70 115.44 1yj9 s SER 41 Ca 0.03 -1.34 0.03 0.00 0.48 0.00 0.00 55.95 55.14 1yj9 s SER 41 Cb -0.14 0.12 -0.02 0.00 0.10 0.00 0.00 66.02 66.08 1yj9 s SER 41 CO 0.02 -0.68 -0.15 -0.69 0.98 0.00 0.00 173.24 172.72 1yj9 s VAL 42 N -3.68 2.93 -0.28 5.02 1.01 -1.26 -0.10 120.40 124.04 1yj9 s VAL 42 Ca 0.35 -0.75 0.09 0.00 0.00 0.00 0.00 61.98 61.67 1yj9 s VAL 42 Cb 0.08 -2.16 0.47 0.00 0.00 0.00 0.00 36.38 34.77 1yj9 s VAL 42 CO 0.12 0.57 1.38 -0.67 0.00 0.00 0.00 175.10 176.50 1yj9 n ASP 43 N 2.70 2.57 0.00 3.32 -0.08 0.35 -4.95 116.55 120.46 1yj9 n ASP 43 Ca -0.17 -3.83 0.00 0.00 -1.51 0.00 0.00 54.79 49.27 1yj9 n ASP 43 Cb 0.52 -0.58 0.00 0.00 2.34 0.00 0.00 41.12 43.40 1yj9 n ASP 43 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1yj9 n GLY 44 N -1.08 0.75 0.00 0.27 0.00 -1.26 -3.90 105.19 99.96 1yj9 n GLY 44 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1yj9 n GLY 44 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1yj9 n ASP 45 N 1.37 2.17 -3.92 1.61 5.75 -1.26 -4.97 116.55 117.30 1yj9 n ASP 45 Ca 0.00 -0.17 -0.10 0.00 -0.01 0.00 0.00 54.79 54.51 1yj9 n ASP 45 Cb 0.00 0.78 -0.11 0.00 -1.03 0.00 0.00 41.12 40.76 1yj9 n ASP 45 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1yj9 s THR 46 N -1.21 0.08 -0.13 2.12 -4.23 -1.25 -0.30 115.64 110.72 1yj9 s THR 46 Ca 0.00 -0.67 -0.07 0.00 -1.18 0.00 0.00 61.69 59.77 1yj9 s THR 46 Cb 0.00 -0.28 -0.04 0.00 1.34 0.00 0.00 72.50 73.52 1yj9 s THR 46 CO 0.00 -0.37 0.13 -0.69 -0.54 0.00 0.00 174.62 173.16 1yj9 s VAL 47 N -1.15 5.46 -0.21 2.29 1.01 0.08 0.13 120.40 128.01 1yj9 s VAL 47 Ca -0.13 0.19 -0.02 0.00 0.00 0.00 0.00 61.98 62.03 1yj9 s VAL 47 Cb -0.07 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 32.92 1yj9 s VAL 47 CO -0.00 0.60 -0.11 -0.69 0.00 0.00 0.00 175.10 174.89 1yj9 s VAL 48 N -0.85 2.75 -0.18 2.92 1.01 0.85 -1.11 120.40 125.79 1yj9 s VAL 48 Ca 0.14 -0.74 -0.05 0.00 0.00 0.00 0.00 61.98 61.33 1yj9 s VAL 48 Cb -0.12 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.00 1yj9 s VAL 48 CO 0.03 0.45 0.01 -0.63 0.00 0.00 0.00 175.10 174.96 1yj9 s ILE 49 N 1.38 4.17 0.10 2.22 1.01 -0.70 -0.80 121.20 128.58 1yj9 s ILE 49 Ca 0.05 -0.25 -0.25 0.00 0.00 0.00 0.00 60.65 60.20 1yj9 s ILE 49 Cb -0.14 -2.87 0.08 0.00 0.01 0.00 0.00 42.46 39.54 1yj9 s ILE 49 CO -0.08 0.45 0.69 -1.83 0.00 0.00 0.00 174.94 174.17 1yj9 s GLU 50 N 0.68 1.13 -0.03 2.79 -1.05 -0.96 -0.51 118.70 120.75 1yj9 s GLU 50 Ca 0.00 -0.37 -0.29 0.00 -0.15 0.00 0.00 54.97 54.16 1yj9 s GLU 50 Cb -0.14 0.52 0.09 0.00 -0.44 0.00 0.00 34.13 34.16 1yj9 s GLU 50 CO 0.02 -0.48 0.75 0.45 0.95 0.00 0.00 175.26 176.95 1yj9 s SER 51 N -2.56 -0.55 0.29 0.83 0.15 -0.98 -0.71 113.70 110.16 1yj9 s SER 51 Ca 0.01 0.45 0.25 0.00 0.70 0.00 0.00 55.95 57.36 1yj9 s SER 51 Cb -0.01 0.48 0.67 0.00 -1.71 0.00 0.00 66.02 65.46 1yj9 s SER 51 CO -0.10 -0.62 1.73 0.44 1.20 0.00 0.00 173.24 175.88 1yj9 h ASP 52 N 2.62 0.00 -4.09 5.45 3.32 -1.87 -1.49 116.42 120.36 1yj9 h ASP 52 Ca -0.26 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.30 1yj9 h ASP 52 Cb 1.19 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.77 1yj9 h ASP 52 CO 0.36 0.00 0.31 -1.61 -1.72 0.00 0.00 179.24 176.59 1yj9 s GLU 53 N -3.15 3.75 0.00 3.56 0.41 -1.26 -4.78 118.70 117.23 1yj9 s GLU 53 Ca 0.09 0.71 0.10 0.00 -0.41 0.00 0.00 54.97 55.45 1yj9 s GLU 53 Cb 0.10 -2.19 0.16 0.00 -1.78 0.00 0.00 34.13 30.42 1yj9 s GLU 53 CO 0.61 -0.32 0.99 -0.40 -0.49 0.00 0.00 175.26 175.65 1yj9 n ASP 54 N -2.02 0.22 -4.88 -0.19 5.75 -1.26 -3.97 116.55 110.20 1yj9 n ASP 54 Ca 0.05 -1.86 -0.31 0.00 -0.01 0.00 0.00 54.79 52.66 1yj9 n ASP 54 Cb 0.54 -0.13 -0.04 0.00 -1.03 0.00 0.00 41.12 40.45 1yj9 n ASP 54 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1yj9 s ASN 55 N -1.23 6.58 0.09 -1.12 2.20 -1.26 -4.75 114.94 115.45 1yj9 s ASN 55 Ca 0.12 0.98 -0.15 0.00 -0.94 0.00 0.00 52.86 52.88 1yj9 s ASN 55 Cb 0.14 -2.25 -0.01 0.00 -2.00 0.00 0.00 41.25 37.13 1yj9 s ASN 55 CO -0.06 -0.20 0.82 0.00 -2.94 0.00 0.00 177.10 174.72 1yj9 n ALA 56 N -0.63 -0.30 -0.26 3.54 0.00 -1.26 0.10 120.51 121.70 1yj9 n ALA 56 Ca 0.01 0.47 0.08 0.00 0.00 0.00 0.00 53.44 53.99 1yj9 n ALA 56 Cb 0.53 -0.10 0.32 0.00 0.00 0.00 0.00 19.45 20.20 1yj9 n ALA 56 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1yj9 h LYS 57 N 0.00 0.81 0.07 0.00 1.57 -1.99 0.46 116.57 117.49 1yj9 h LYS 57 Ca 0.10 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1yj9 h LYS 57 Cb 0.24 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1yj9 h LYS 57 CO -0.51 0.54 -0.03 1.15 -0.57 0.00 0.00 179.45 180.03 1yj9 h THR 58 N 0.83 1.21 -0.50 -0.16 2.02 0.30 -3.05 112.91 113.56 1yj9 h THR 58 Ca 0.40 -1.15 0.07 0.00 0.77 0.00 0.00 66.41 66.49 1yj9 h THR 58 Cb 0.42 1.94 -0.03 0.00 -1.74 0.00 0.00 68.15 68.74 1yj9 h THR 58 CO -0.16 0.28 0.34 0.24 0.37 0.00 0.00 175.52 176.58 1yj9 h MET 59 N -0.64 0.39 -0.15 6.66 2.86 -0.38 -1.37 114.93 122.30 1yj9 h MET 59 Ca -0.01 -0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1yj9 h MET 59 Cb 0.53 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.09 1yj9 h MET 59 CO 0.02 0.26 0.07 0.77 1.06 0.00 0.00 176.91 179.08 1yj9 h SER 60 N 0.40 0.09 -0.20 1.22 0.02 -0.03 -2.74 113.55 112.32 1yj9 h SER 60 Ca 0.22 0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 61.08 1yj9 h SER 60 Cb 0.36 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.89 1yj9 h SER 60 CO -0.06 0.08 -0.28 0.74 -1.14 0.00 0.00 176.83 176.18 1yj9 h THR 61 N 0.15 1.33 -0.29 -2.27 2.02 -1.22 -2.38 112.91 110.25 1yj9 h THR 61 Ca 0.06 -1.48 0.06 0.00 0.77 0.00 0.00 66.41 65.82 1yj9 h THR 61 Cb 0.02 1.82 -0.08 0.00 -1.74 0.00 0.00 68.15 68.17 1yj9 h THR 61 CO -0.05 0.45 -0.39 0.40 0.37 0.00 0.00 175.52 176.31 1yj9 h ILE 62 N 0.21 0.17 -0.03 3.11 2.04 -1.25 0.93 117.51 122.69 1yj9 h ILE 62 Ca 0.02 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.89 1yj9 h ILE 62 Cb 0.85 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 1yj9 h ILE 62 CO 0.06 0.00 0.02 1.23 0.00 0.00 0.00 178.15 179.47 1yj9 h GLY 63 N -0.36 0.00 0.97 5.37 0.00 -1.50 -0.72 103.07 106.83 1yj9 h GLY 63 Ca 0.12 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.30 1yj9 h GLY 63 CO -0.49 0.00 -0.52 -0.84 0.00 0.00 0.00 176.54 174.70 1yj9 h THR 64 N 0.00 1.33 -0.01 4.70 2.02 0.40 -2.79 112.91 118.56 1yj9 h THR 64 Ca 0.01 -1.77 -0.00 0.00 0.77 0.00 0.00 66.41 65.42 1yj9 h THR 64 Cb 0.06 1.99 -0.00 0.00 -1.74 0.00 0.00 68.15 68.46 1yj9 h THR 64 CO -0.00 0.55 0.00 -0.26 0.37 0.00 0.00 175.52 176.18 1yj9 h PHE 65 N 0.31 0.02 -0.21 3.16 0.05 0.16 -2.15 116.94 118.28 1yj9 h PHE 65 Ca -0.02 -0.00 0.03 0.00 3.82 0.00 0.00 57.97 61.80 1yj9 h PHE 65 Cb 1.14 -0.01 -0.04 0.00 2.00 0.00 0.00 35.95 39.04 1yj9 h PHE 65 CO 0.10 0.19 -0.30 0.37 -0.18 0.00 0.00 178.31 178.49 1yj9 h GLN 66 N -0.16 -0.22 0.00 1.51 4.15 -1.20 0.41 115.11 119.60 1yj9 h GLN 66 Ca 0.00 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.44 1yj9 h GLN 66 Cb 0.18 0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.92 1yj9 h GLN 66 CO -0.00 -0.15 0.28 0.77 -1.93 0.00 0.00 178.83 177.80 1yj9 h SER 67 N -0.23 0.00 0.57 -0.69 0.02 -1.45 0.21 113.55 111.99 1yj9 h SER 67 Ca 0.04 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.70 1yj9 h SER 67 Cb 0.33 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1yj9 h SER 67 CO -0.32 0.00 -1.40 0.45 -1.14 0.00 0.00 176.83 174.42 1yj9 h HIS 68 N 0.00 0.37 0.05 3.45 3.86 0.43 -3.04 115.15 120.27 1yj9 h HIS 68 Ca 0.00 -0.27 -0.00 0.00 -1.16 0.00 0.00 60.37 58.94 1yj9 h HIS 68 Cb 0.55 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.01 1yj9 h HIS 68 CO 0.00 1.28 -0.02 0.82 0.86 0.00 0.00 177.93 180.87 1yj9 h ILE 69 N 0.06 1.09 -1.02 2.45 2.04 1.00 -2.73 117.51 120.39 1yj9 h ILE 69 Ca -0.19 -1.62 0.27 0.00 1.00 0.00 0.00 64.86 64.32 1yj9 h ILE 69 Cb 1.97 1.98 -0.12 0.00 -0.74 0.00 0.00 36.82 39.91 1yj9 h ILE 69 CO 0.16 0.34 0.62 -0.33 0.00 0.00 0.00 178.15 178.94 1yj9 h GLU 70 N -0.93 0.48 -0.37 2.37 5.08 -1.24 0.65 114.58 120.61 1yj9 h GLU 70 Ca -0.01 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 1yj9 h GLU 70 Cb 0.61 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1yj9 h GLU 70 CO 0.01 0.31 -0.04 -0.91 -1.00 0.00 0.00 179.01 177.39 1yj9 h ASN 71 N 0.49 0.57 -0.03 1.42 4.21 -1.55 -2.57 115.58 118.12 1yj9 h ASN 71 Ca 0.65 -0.13 -0.16 0.00 1.21 0.00 0.00 56.30 57.87 1yj9 h ASN 71 Cb 1.39 -0.15 -0.00 0.00 -1.12 0.00 0.00 38.32 38.44 1yj9 h ASN 71 CO -0.45 0.67 -0.54 0.24 -1.29 0.00 0.00 177.43 176.05 1yj9 h MET 72 N 0.57 0.62 0.57 0.81 2.86 0.57 -2.25 114.93 118.68 1yj9 h MET 72 Ca 0.11 -0.39 -0.02 0.00 -2.06 0.00 0.00 59.70 57.34 1yj9 h MET 72 Cb 0.42 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 1yj9 h MET 72 CO 0.02 1.00 -0.40 0.74 1.06 0.00 0.00 176.91 179.33 1yj9 h PHE 73 N 0.47 -1.07 -0.77 -0.22 0.05 -0.85 -2.14 116.94 112.42 1yj9 h PHE 73 Ca 0.01 -0.01 0.20 0.00 3.82 0.00 0.00 57.97 61.99 1yj9 h PHE 73 Cb 1.10 0.39 -0.04 0.00 2.00 0.00 0.00 35.95 39.40 1yj9 h PHE 73 CO 0.05 -0.57 0.54 1.25 -0.18 0.00 0.00 178.31 179.40 1yj9 h HIS 74 N -0.92 0.20 -0.14 -0.55 2.76 -1.49 -2.01 115.15 113.01 1yj9 h HIS 74 Ca -0.08 0.01 -0.19 0.00 -2.20 0.00 0.00 60.37 57.91 1yj9 h HIS 74 Cb 0.75 -0.06 -0.00 0.00 1.55 0.00 0.00 27.41 29.65 1yj9 h HIS 74 CO -0.10 0.06 -0.68 0.78 -1.30 0.00 0.00 177.93 176.68 1yj9 h GLY 75 N 0.16 0.64 1.62 5.26 0.00 -1.00 0.24 103.07 109.99 1yj9 h GLY 75 Ca 0.38 -0.85 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1yj9 h GLY 75 CO -0.06 0.75 -0.10 3.33 0.00 0.00 0.00 176.54 180.46 1yj9 n VAL 76 N -3.91 0.00 0.00 4.60 0.24 -0.79 -2.33 118.33 116.14 1yj9 n VAL 76 Ca -0.05 -0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 1yj9 n VAL 76 Cb 0.69 -0.32 0.00 0.00 -1.47 0.00 0.00 33.84 32.74 1yj9 n VAL 76 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1yj9 n THR 77 N -1.40 0.00 0.03 3.34 -2.24 -1.01 0.26 114.28 113.26 1yj9 n THR 77 Ca 0.09 0.19 -0.05 0.00 -2.27 0.00 0.00 64.05 62.00 1yj9 n THR 77 Cb 0.32 -1.12 -0.11 0.00 -2.10 0.00 0.00 70.33 67.32 1yj9 n THR 77 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1yj9 h GLU 78 N 0.00 0.00 0.00 -0.78 5.08 -1.43 -3.40 114.58 114.06 1yj9 h GLU 78 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1yj9 h GLU 78 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1yj9 h GLU 78 CO 0.00 0.60 0.00 0.41 -1.00 0.00 0.00 179.01 179.02 1yj9 n GLY 79 N 1.43 -1.40 3.41 -3.84 0.00 0.73 -4.97 105.19 100.56 1yj9 n GLY 79 Ca -0.08 -1.58 -0.32 0.00 0.00 0.00 0.00 46.02 44.04 1yj9 n GLY 79 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1yj9 s TRP 80 N -1.68 2.55 -0.04 1.61 0.52 0.09 -4.72 118.94 117.26 1yj9 s TRP 80 Ca 0.00 -0.27 0.00 0.00 0.02 0.00 0.00 56.10 55.85 1yj9 s TRP 80 Cb 0.00 -1.56 0.03 0.00 -1.15 0.00 0.00 33.47 30.78 1yj9 s TRP 80 CO 0.00 0.11 -0.01 -1.21 0.02 0.00 0.00 176.95 175.86 1yj9 s GLU 81 N -0.75 0.46 -0.13 4.98 2.02 -1.26 -1.78 118.70 122.25 1yj9 s GLU 81 Ca 0.11 0.06 -0.01 0.00 0.02 0.00 0.00 54.97 55.15 1yj9 s GLU 81 Cb -0.10 -0.66 -0.02 0.00 0.10 0.00 0.00 34.13 33.45 1yj9 s GLU 81 CO 0.00 -0.16 -0.10 0.71 0.02 0.00 0.00 175.26 175.73 1yj9 s TYR 82 N 1.24 2.88 -0.07 1.61 1.51 0.11 -3.70 117.35 120.93 1yj9 s TYR 82 Ca -0.07 -0.44 -0.02 0.00 -1.01 0.00 0.00 57.07 55.54 1yj9 s TYR 82 Cb -0.13 -1.85 -0.03 0.00 -0.11 0.00 0.00 41.96 39.83 1yj9 s TYR 82 CO -0.02 -0.07 0.03 0.20 -1.11 0.00 0.00 175.55 174.58 1yj9 s GLY 83 N 0.16 1.92 0.08 0.71 0.00 -0.85 -0.29 107.32 109.04 1yj9 s GLY 83 Ca -0.05 -0.80 0.02 0.00 0.00 0.00 0.00 44.72 43.89 1yj9 s GLY 83 CO 0.04 -0.58 -0.07 1.06 0.00 0.00 0.00 173.10 173.55 1yj9 s MET 84 N -1.05 0.75 -0.03 2.90 -1.94 -0.37 0.19 119.30 119.74 1yj9 s MET 84 Ca 0.15 -1.14 0.03 0.00 -1.71 0.00 0.00 55.69 53.02 1yj9 s MET 84 Cb -0.11 -0.28 -0.00 0.00 2.01 0.00 0.00 34.83 36.45 1yj9 s MET 84 CO 0.04 0.02 -0.13 -1.21 -0.01 0.00 0.00 175.02 173.73 1yj9 s GLU 85 N -3.04 1.30 -0.30 2.03 2.02 0.28 -0.89 118.70 120.10 1yj9 s GLU 85 Ca 0.05 -0.44 -0.15 0.00 0.02 0.00 0.00 54.97 54.45 1yj9 s GLU 85 Cb -0.00 -1.17 -0.03 0.00 0.10 0.00 0.00 34.13 33.03 1yj9 s GLU 85 CO -0.03 0.18 0.38 0.54 0.02 0.00 0.00 175.26 176.35 1yj9 s VAL 86 N 0.10 5.16 -0.00 2.63 0.11 -0.69 -0.80 120.40 126.90 1yj9 s VAL 86 Ca -0.03 0.36 0.06 0.00 -2.93 0.00 0.00 61.98 59.43 1yj9 s VAL 86 Cb -0.10 -3.77 -0.03 0.00 -1.53 0.00 0.00 36.38 30.96 1yj9 s VAL 86 CO 0.01 0.03 -0.17 0.12 -3.33 0.00 0.00 175.10 171.77 1yj9 s PHE 87 N 2.08 2.61 0.14 1.54 5.36 -0.27 -4.94 117.98 124.51 1yj9 s PHE 87 Ca 0.14 -0.22 -0.16 0.00 -0.96 0.00 0.00 56.93 55.73 1yj9 s PHE 87 Cb -0.16 -1.54 0.03 0.00 -0.34 0.00 0.00 43.02 41.01 1yj9 s PHE 87 CO 0.11 0.20 0.42 1.52 -1.46 0.00 0.00 175.22 176.02 1yj9 s TYR 88 N -0.82 -0.16 0.00 10.12 -0.85 -1.26 0.09 117.35 124.47 1yj9 s TYR 88 Ca 0.13 -0.17 0.00 0.00 -0.52 0.00 0.00 57.07 56.51 1yj9 s TYR 88 Cb -0.11 0.28 0.00 0.00 0.38 0.00 0.00 41.96 42.51 1yj9 s TYR 88 CO 0.03 -0.75 0.00 -1.13 -1.52 0.00 0.00 175.55 172.18 1yj9 n SER 89 N -0.25 0.00 -0.06 -0.18 3.41 -1.26 -4.95 113.62 110.32 1yj9 n SER 89 Ca -0.14 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.29 1yj9 n SER 89 Cb 0.63 -0.22 -0.13 0.00 -0.26 0.00 0.00 64.21 64.23 1yj9 n SER 89 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1yj9 n HIS 90 N -2.38 0.59 -3.66 7.33 -0.00 -1.26 -4.89 115.22 110.94 1yj9 n HIS 90 Ca 0.00 0.14 -0.37 0.00 -0.00 0.00 0.00 57.72 57.49 1yj9 n HIS 90 Cb 0.00 -1.08 -0.11 0.00 -0.00 0.00 0.00 29.99 28.80 1yj9 n HIS 90 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1yj9 s PHE 91 N -2.54 3.19 -0.23 1.57 0.40 -1.26 -5.03 117.98 114.08 1yj9 s PHE 91 Ca -0.25 -0.02 -0.29 0.00 -0.60 0.00 0.00 56.93 55.77 1yj9 s PHE 91 Cb 0.08 -2.31 -0.03 0.00 0.51 0.00 0.00 43.02 41.26 1yj9 s PHE 91 CO 0.71 -0.18 1.81 -2.14 0.70 0.00 0.00 175.22 176.13 1yj9 s PRO 92 N 1.58 3.57 0.43 0.24 0.02 -1.26 -4.71 135.00 134.88 1yj9 s PRO 92 Ca 0.07 1.74 -0.07 0.00 0.02 0.00 0.00 61.00 62.76 1yj9 s PRO 92 Cb -0.15 -4.16 0.11 0.00 0.02 0.00 0.00 34.50 30.32 1yj9 s PRO 92 CO 0.08 -1.58 0.40 -0.12 -0.33 0.00 0.00 177.00 175.45 1yj9 n MET 93 N 8.08 -1.66 -3.08 5.54 1.56 -1.26 -4.84 117.12 121.45 1yj9 n MET 93 Ca 0.22 -0.64 0.01 0.00 -0.27 0.00 0.00 57.70 57.02 1yj9 n MET 93 Cb 0.45 -0.58 -0.01 0.00 2.15 0.00 0.00 33.22 35.24 1yj9 n MET 93 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 1yj9 s GLN 94 N -3.91 0.66 0.18 2.12 -0.21 -1.06 -4.95 119.66 112.50 1yj9 s GLN 94 Ca 0.26 -0.24 -0.23 0.00 0.02 0.00 0.00 55.36 55.17 1yj9 s GLN 94 Cb -0.02 0.07 -0.08 0.00 1.00 0.00 0.00 33.01 33.98 1yj9 s GLN 94 CO 0.20 -0.96 0.74 0.08 -2.12 0.00 0.00 175.29 173.23 1yj9 s VAL 95 N 1.84 4.48 0.14 1.09 1.01 -1.26 -1.42 120.40 126.27 1yj9 s VAL 95 Ca 0.16 1.51 -0.22 0.00 0.00 0.00 0.00 61.98 63.43 1yj9 s VAL 95 Cb -0.02 -4.01 0.06 0.00 0.00 0.00 0.00 36.38 32.41 1yj9 s VAL 95 CO -0.09 0.41 0.56 0.20 0.00 0.00 0.00 175.10 176.19 1yj9 s ASN 96 N -1.32 -0.51 -0.92 3.32 -0.87 0.29 -5.00 114.94 109.93 1yj9 s ASN 96 Ca 0.38 -0.02 0.00 0.00 -1.57 0.00 0.00 52.86 51.65 1yj9 s ASN 96 Cb -0.20 0.57 0.32 0.00 -0.02 0.00 0.00 41.25 41.91 1yj9 s ASN 96 CO 0.23 -0.92 1.51 0.52 -2.57 0.00 0.00 177.10 175.87 1yj9 n VAL 97 N -0.27 5.11 -1.13 1.60 0.31 -1.26 0.17 118.33 122.87 1yj9 n VAL 97 Ca -0.17 -5.85 -0.37 0.00 -0.01 0.00 0.00 64.34 57.94 1yj9 n VAL 97 Cb 0.64 -1.65 -0.09 0.00 -0.91 0.00 0.00 33.84 31.83 1yj9 n VAL 97 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1yj9 n GLU 98 N 0.21 0.73 0.00 5.55 1.02 -1.23 -4.59 120.64 122.33 1yj9 n GLU 98 Ca 0.39 -1.61 0.00 0.00 -0.02 0.00 0.00 57.16 55.92 1yj9 n GLU 98 Cb 0.31 -3.06 0.00 0.00 -0.02 0.00 0.00 31.44 28.67 1yj9 n GLU 98 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yj9 n GLY 99 N 5.16 0.48 0.20 0.62 0.00 -1.26 -4.42 105.19 105.97 1yj9 n GLY 99 Ca 0.46 -1.19 0.09 0.00 0.00 0.00 0.00 46.02 45.38 1yj9 n GLY 99 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1yj9 n ASP 100 N 0.00 2.15 -3.56 1.61 5.75 -1.26 -4.95 116.55 116.29 1yj9 n ASP 100 Ca 0.00 -3.22 -0.13 0.00 -0.01 0.00 0.00 54.79 51.43 1yj9 n ASP 100 Cb 0.00 -0.44 -0.12 0.00 -1.03 0.00 0.00 41.12 39.53 1yj9 n ASP 100 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 1yj9 s GLU 101 N -2.86 0.22 0.15 0.11 -1.05 -1.26 -1.81 118.70 112.20 1yj9 s GLU 101 Ca 0.32 0.60 -0.31 0.00 -0.15 0.00 0.00 54.97 55.43 1yj9 s GLU 101 Cb 0.29 -0.37 -0.11 0.00 -0.44 0.00 0.00 34.13 33.50 1yj9 s GLU 101 CO 0.01 -0.45 1.81 1.55 0.95 0.00 0.00 175.26 179.13 1yj9 n VAL 102 N 5.35 0.26 -4.33 1.83 3.14 -0.94 -3.52 118.33 120.13 1yj9 n VAL 102 Ca -0.06 -0.05 -0.31 0.00 -2.96 0.00 0.00 64.34 60.96 1yj9 n VAL 102 Cb 0.50 -2.09 -0.10 0.00 -1.06 0.00 0.00 33.84 31.09 1yj9 n VAL 102 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1yj9 s VAL 103 N 2.30 3.66 -0.09 1.55 1.01 0.46 -2.34 120.40 126.95 1yj9 s VAL 103 Ca 0.80 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.87 1yj9 s VAL 103 Cb -0.49 -2.66 0.00 0.00 0.00 0.00 0.00 36.38 33.24 1yj9 s VAL 103 CO 0.36 0.26 -0.21 -0.63 0.00 0.00 0.00 175.10 174.88 1yj9 s ILE 104 N -1.12 1.81 0.12 2.22 1.01 0.24 -0.55 121.20 124.92 1yj9 s ILE 104 Ca 0.20 -0.87 0.09 0.00 0.00 0.00 0.00 60.65 60.07 1yj9 s ILE 104 Cb -0.11 -1.58 -0.04 0.00 0.01 0.00 0.00 42.46 40.74 1yj9 s ILE 104 CO 0.11 0.50 -0.18 -1.61 0.00 0.00 0.00 174.94 173.77 1yj9 s GLU 105 N 0.43 1.78 -1.15 2.79 2.02 -0.51 -0.71 118.70 123.35 1yj9 s GLU 105 Ca -0.18 -1.18 0.00 0.00 0.02 0.00 0.00 54.97 53.64 1yj9 s GLU 105 Cb -0.17 -2.11 0.00 0.00 0.10 0.00 0.00 34.13 31.94 1yj9 s GLU 105 CO 0.08 0.48 0.00 -1.71 0.02 0.00 0.00 175.26 174.13 1yj9 n ASN 106 N 0.82 -5.56 -4.55 -0.19 2.85 -1.25 -2.55 115.26 104.83 1yj9 n ASN 106 Ca -0.16 0.27 -0.50 0.00 -0.11 0.00 0.00 54.58 54.08 1yj9 n ASN 106 Cb 0.53 -4.11 -0.05 0.00 1.24 0.00 0.00 39.78 37.39 1yj9 n ASN 106 CO 0.00 0.00 0.00 0.33 -2.11 0.00 0.00 177.26 175.48 1yj9 n PHE 107 N -2.15 1.01 -3.88 1.20 7.35 -1.26 -0.68 117.46 119.05 1yj9 n PHE 107 Ca -0.11 0.77 -0.30 0.00 -0.76 0.00 0.00 57.45 57.05 1yj9 n PHE 107 Cb 0.58 -2.22 -0.07 0.00 0.35 0.00 0.00 39.48 38.12 1yj9 n PHE 107 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1yj9 n LEU 108 N 1.96 -0.68 0.00 -2.13 7.94 -1.26 -0.94 117.00 121.89 1yj9 n LEU 108 Ca 0.16 -0.98 0.00 0.00 -1.11 0.00 0.00 56.01 54.08 1yj9 n LEU 108 Cb 0.22 -1.24 0.00 0.00 0.53 0.00 0.00 43.42 42.93 1yj9 n LEU 108 CO 0.60 0.18 0.00 0.61 -1.11 0.00 0.00 177.39 177.68 1yj9 n GLY 109 N -1.40 1.99 1.64 -3.96 0.00 0.14 -5.01 105.19 98.59 1yj9 n GLY 109 Ca -0.03 -0.37 -0.21 0.00 0.00 0.00 0.00 46.02 45.41 1yj9 n GLY 109 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1yj9 n GLU 110 N 0.00 0.00 0.06 1.61 1.02 -0.11 -4.83 120.64 118.39 1yj9 n GLU 110 Ca 0.00 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.91 1yj9 n GLU 110 Cb 0.00 -0.50 -0.15 0.00 -0.02 0.00 0.00 31.44 30.77 1yj9 n GLU 110 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1yj9 h LYS 111 N 0.17 0.37 -6.35 3.49 1.57 -1.93 -3.33 116.57 110.56 1yj9 h LYS 111 Ca -0.18 -0.64 -0.55 0.00 -1.87 0.00 0.00 60.65 57.41 1yj9 h LYS 111 Cb 0.72 0.24 -0.03 0.00 0.08 0.00 0.00 32.23 33.24 1yj9 h LYS 111 CO 0.23 1.30 0.49 0.00 -0.57 0.00 0.00 179.45 180.90 1yj9 s ALA 112 N -2.58 3.30 -0.12 3.86 0.00 -1.26 -4.76 121.76 120.22 1yj9 s ALA 112 Ca -0.17 0.50 -0.29 0.00 0.00 0.00 0.00 51.96 52.00 1yj9 s ALA 112 Cb 0.06 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 1yj9 s ALA 112 CO 0.84 -0.44 1.41 -2.14 0.00 0.00 0.00 175.76 175.43 1yj9 s PRO 113 N 1.52 4.22 0.28 0.00 0.02 -1.26 -4.69 135.00 135.08 1yj9 s PRO 113 Ca 0.51 1.87 -0.29 0.00 0.02 0.00 0.00 61.00 63.12 1yj9 s PRO 113 Cb -0.21 -3.83 -0.09 0.00 0.02 0.00 0.00 34.50 30.38 1yj9 s PRO 113 CO 0.24 -0.75 0.97 1.03 -0.33 0.00 0.00 177.00 178.16 1yj9 s ARG 114 N 3.63 4.72 0.06 5.54 0.52 0.11 -4.86 118.95 128.67 1yj9 s ARG 114 Ca 0.62 1.49 -0.13 0.00 -0.52 0.00 0.00 55.73 57.19 1yj9 s ARG 114 Cb -0.26 -3.10 0.02 0.00 0.52 0.00 0.00 34.95 32.13 1yj9 s ARG 114 CO 0.21 0.38 0.29 -0.98 0.02 0.00 0.00 175.30 175.22 1yj9 s ARG 115 N -1.52 0.85 -0.11 3.54 1.70 -1.26 0.80 118.95 122.95 1yj9 s ARG 115 Ca 0.45 -0.62 -0.10 0.00 -0.47 0.00 0.00 55.73 54.99 1yj9 s ARG 115 Cb -0.25 0.36 0.03 0.00 -0.57 0.00 0.00 34.95 34.53 1yj9 s ARG 115 CO 0.31 -0.28 0.29 -0.08 -1.08 0.00 0.00 175.30 174.46 1yj9 s THR 116 N -2.96 -0.00 0.31 4.99 -1.32 -0.99 -5.03 115.64 110.64 1yj9 s THR 116 Ca -0.02 0.00 -0.27 0.00 -1.21 0.00 0.00 61.69 60.19 1yj9 s THR 116 Cb 0.01 -0.41 -0.09 0.00 -1.51 0.00 0.00 72.50 70.49 1yj9 s THR 116 CO -0.06 0.00 0.98 -0.89 -2.21 0.00 0.00 174.62 172.44 1yj9 s THR 117 N 0.19 4.01 0.25 5.08 2.01 -1.26 -2.21 115.64 123.69 1yj9 s THR 117 Ca -0.00 1.76 -0.23 0.00 0.31 0.00 0.00 61.69 63.53 1yj9 s THR 117 Cb -0.02 -4.02 -0.09 0.00 0.01 0.00 0.00 72.50 68.38 1yj9 s THR 117 CO 0.00 0.23 0.81 -0.63 -0.69 0.00 0.00 174.62 174.34 1yj9 s ILE 118 N -1.46 4.40 -0.46 1.82 1.01 -0.75 -4.92 121.20 120.84 1yj9 s ILE 118 Ca 0.48 1.56 -0.21 0.00 0.00 0.00 0.00 60.65 62.48 1yj9 s ILE 118 Cb -0.23 -3.97 0.03 0.00 0.01 0.00 0.00 42.46 38.30 1yj9 s ILE 118 CO 0.29 0.25 0.67 -1.00 0.00 0.00 0.00 174.94 175.14 1yj9 s HIS 119 N -1.48 3.04 0.00 3.97 3.76 -1.26 -4.98 115.29 118.34 1yj9 s HIS 119 Ca 0.44 -0.13 0.00 0.00 -0.15 0.00 0.00 55.06 55.22 1yj9 s HIS 119 Cb -0.19 -3.45 0.00 0.00 1.11 0.00 0.00 32.58 30.05 1yj9 s HIS 119 CO 0.23 -0.94 0.00 0.41 -0.85 0.00 0.00 174.74 173.59 1yj9 n GLY 120 N 5.06 0.49 0.00 -2.22 0.00 -1.26 -3.36 105.19 103.90 1yj9 n GLY 120 Ca -0.02 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1yj9 n GLY 120 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yj9 n ASP 121 N -2.19 0.00 -4.75 1.61 8.00 -1.26 -4.78 116.55 113.18 1yj9 n ASP 121 Ca 0.00 -0.04 -0.41 0.00 0.71 0.00 0.00 54.79 55.05 1yj9 n ASP 121 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1yj9 n ASP 121 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1yj9 n THR 122 N -0.65 2.13 -3.99 -3.53 -1.04 -1.21 -4.76 114.28 101.23 1yj9 n THR 122 Ca 0.00 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.05 61.17 1yj9 n THR 122 Cb 0.00 -1.82 -0.14 0.00 -1.82 0.00 0.00 70.33 66.55 1yj9 n THR 122 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1yj9 s ASP 123 N -0.25 4.49 -0.44 8.00 1.01 0.13 -4.92 116.67 124.68 1yj9 s ASP 123 Ca 0.55 -1.18 -0.18 0.00 0.71 0.00 0.00 52.55 52.45 1yj9 s ASP 123 Cb -0.50 -1.63 0.03 0.00 1.01 0.00 0.00 42.92 41.83 1yj9 s ASP 123 CO 0.62 -0.19 0.49 -0.69 0.21 0.00 0.00 175.17 175.61 1yj9 s VAL 124 N 1.22 5.03 -0.25 -1.27 1.01 -1.26 -1.84 120.40 123.04 1yj9 s VAL 124 Ca -0.05 -0.39 -0.07 0.00 0.00 0.00 0.00 61.98 61.47 1yj9 s VAL 124 Cb -0.19 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 1yj9 s VAL 124 CO -0.04 -0.53 0.07 -1.61 0.00 0.00 0.00 175.10 173.00 1yj9 s GLU 125 N 2.25 3.68 -0.16 2.72 2.02 -0.71 -4.94 118.70 123.56 1yj9 s GLU 125 Ca 0.13 -0.47 -0.03 0.00 0.02 0.00 0.00 54.97 54.62 1yj9 s GLU 125 Cb -0.18 -3.32 -0.02 0.00 0.10 0.00 0.00 34.13 30.71 1yj9 s GLU 125 CO 0.13 -0.16 -0.05 -1.50 0.02 0.00 0.00 175.26 173.70 1yj9 s ILE 126 N 1.55 3.69 -0.25 -1.63 2.07 -1.26 -1.06 121.20 124.31 1yj9 s ILE 126 Ca 0.06 -0.43 -0.03 0.00 -1.41 0.00 0.00 60.65 58.85 1yj9 s ILE 126 Cb -0.15 -2.61 0.08 0.00 0.13 0.00 0.00 42.46 39.91 1yj9 s ILE 126 CO 0.04 0.49 0.09 -0.62 -1.91 0.00 0.00 174.94 173.02 1yj9 s ASP 127 N 0.50 3.37 1.73 4.50 -1.08 0.03 -5.02 116.67 120.70 1yj9 s ASP 127 Ca -0.04 -1.18 0.00 0.00 -0.52 0.00 0.00 52.55 50.81 1yj9 s ASP 127 Cb -0.15 -0.58 0.00 0.00 -1.46 0.00 0.00 42.92 40.74 1yj9 s ASP 127 CO 0.03 -0.38 0.00 0.61 0.52 0.00 0.00 175.17 175.95 1yj9 n GLY 128 N 5.06 3.70 1.46 2.66 0.00 -1.26 -1.28 105.19 115.54 1yj9 n GLY 128 Ca -0.06 0.01 0.04 0.00 0.00 0.00 0.00 46.02 46.01 1yj9 n GLY 128 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1yj9 n GLU 129 N 12.71 3.66 -4.46 1.61 -0.58 -1.26 -4.91 120.64 127.41 1yj9 n GLU 129 Ca 0.00 -3.03 -0.29 0.00 -0.42 0.00 0.00 57.16 53.43 1yj9 n GLU 129 Cb 0.00 -2.06 -0.17 0.00 -0.57 0.00 0.00 31.44 28.64 1yj9 n GLU 129 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1yj9 s GLU 130 N -2.88 2.26 0.25 3.49 2.02 -0.40 -1.71 118.70 121.73 1yj9 s GLU 130 Ca 0.49 -0.58 0.07 0.00 0.02 0.00 0.00 54.97 54.98 1yj9 s GLU 130 Cb 0.39 -1.92 -0.04 0.00 0.10 0.00 0.00 34.13 32.66 1yj9 s GLU 130 CO 0.11 -0.07 0.18 -0.51 0.02 0.00 0.00 175.26 175.00 1yj9 s LEU 131 N 0.99 3.77 -0.24 1.80 1.43 -0.06 -0.79 118.68 125.59 1yj9 s LEU 131 Ca -0.06 -0.27 -0.03 0.00 -1.03 0.00 0.00 54.13 52.74 1yj9 s LEU 131 Cb -0.15 -2.31 0.12 0.00 0.03 0.00 0.00 46.19 43.89 1yj9 s LEU 131 CO -0.02 -0.03 0.33 0.28 0.23 0.00 0.00 176.35 177.14 1yj9 s THR 132 N -2.12 -0.52 -0.08 5.49 -1.32 -0.22 -1.24 115.64 115.62 1yj9 s THR 132 Ca 0.33 -0.11 -0.18 0.00 -1.21 0.00 0.00 61.69 60.51 1yj9 s THR 132 Cb -0.08 -0.79 -0.05 0.00 -1.51 0.00 0.00 72.50 70.07 1yj9 s THR 132 CO 0.24 -0.17 0.49 -0.69 -2.21 0.00 0.00 174.62 172.29 1yj9 s VAL 133 N 2.48 5.11 -0.00 5.08 1.01 0.60 -1.75 120.40 132.93 1yj9 s VAL 133 Ca 0.11 0.99 -0.13 0.00 0.00 0.00 0.00 61.98 62.95 1yj9 s VAL 133 Cb -0.15 -3.83 0.02 0.00 0.00 0.00 0.00 36.38 32.42 1yj9 s VAL 133 CO -0.16 0.38 0.27 -0.94 0.00 0.00 0.00 175.10 174.64 1yj9 s SER 134 N 0.24 -0.13 0.00 3.32 1.04 -0.77 0.07 113.70 117.48 1yj9 s SER 134 Ca 0.27 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.67 1yj9 s SER 134 Cb -0.16 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.25 1yj9 s SER 134 CO 0.12 -0.46 0.00 0.61 0.98 0.00 0.00 173.24 174.49 1yj9 n GLY 135 N 1.19 -0.29 0.13 7.32 0.00 -0.73 0.18 105.19 112.99 1yj9 n GLY 135 Ca -0.21 -1.05 -0.22 0.00 0.00 0.00 0.00 46.02 44.54 1yj9 n GLY 135 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yj9 h PRO 136 N 0.00 0.32 -6.39 1.61 0.13 -1.81 0.29 132.00 126.15 1yj9 h PRO 136 Ca 0.00 -0.56 -0.54 0.00 -0.87 0.00 0.00 66.00 64.03 1yj9 h PRO 136 Cb 0.00 0.21 -0.08 0.00 0.13 0.00 0.00 31.00 31.26 1yj9 h PRO 136 CO 0.00 1.27 1.06 0.34 -0.23 0.00 0.00 178.00 180.44 1yj9 s ASP 137 N -7.15 6.17 0.45 1.44 -1.08 -1.26 -4.42 116.67 110.81 1yj9 s ASP 137 Ca -0.17 -0.26 0.11 0.00 -0.52 0.00 0.00 52.55 51.71 1yj9 s ASP 137 Cb 0.04 -2.56 1.01 0.00 -1.46 0.00 0.00 42.92 39.96 1yj9 s ASP 137 CO 0.82 -1.79 2.09 -0.29 0.52 0.00 0.00 175.17 176.52 1yj9 h ILE 138 N 6.12 1.06 -0.05 4.11 2.10 -1.89 -1.67 117.51 127.29 1yj9 h ILE 138 Ca -0.27 -0.12 0.03 0.00 1.08 0.00 0.00 64.86 65.58 1yj9 h ILE 138 Cb 1.06 0.67 -0.04 0.00 -1.09 0.00 0.00 36.82 37.42 1yj9 h ILE 138 CO 1.25 0.06 -0.17 -0.33 -1.08 0.00 0.00 178.15 177.88 1yj9 h GLU 139 N 0.35 -0.25 0.51 2.19 4.39 -1.99 0.16 114.58 119.94 1yj9 h GLU 139 Ca 0.11 0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.80 1yj9 h GLU 139 Cb -0.00 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 1yj9 h GLU 139 CO -0.02 -0.17 -0.35 0.00 -1.16 0.00 0.00 179.01 177.31 1yj9 h ALA 140 N 0.70 -1.13 -0.50 3.43 0.00 -1.63 -2.16 119.26 117.97 1yj9 h ALA 140 Ca 0.07 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.89 1yj9 h ALA 140 Cb 0.36 0.50 -0.10 0.00 0.00 0.00 0.00 17.79 18.55 1yj9 h ALA 140 CO -0.20 -1.12 -0.41 0.28 0.00 0.00 0.00 179.25 177.80 1yj9 h VAL 141 N -0.82 0.12 -0.58 0.00 2.07 -1.37 -0.24 116.25 115.42 1yj9 h VAL 141 Ca -0.07 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.55 1yj9 h VAL 141 Cb 0.67 0.12 -0.11 0.00 -1.52 0.00 0.00 31.29 30.45 1yj9 h VAL 141 CO 0.04 0.00 -0.35 1.23 0.02 0.00 0.00 177.57 178.51 1yj9 h GLY 142 N -0.26 -0.18 0.90 2.17 0.00 -0.61 -0.40 103.07 104.69 1yj9 h GLY 142 Ca 0.17 0.46 -0.04 0.00 0.00 0.00 0.00 47.33 47.91 1yj9 h GLY 142 CO -0.63 -0.20 -0.43 1.46 0.00 0.00 0.00 176.54 176.74 1yj9 h GLN 143 N -0.18 -1.16 -0.97 4.80 1.08 -0.61 -1.76 115.11 116.31 1yj9 h GLN 143 Ca 0.22 0.08 0.14 0.00 -1.45 0.00 0.00 58.65 57.64 1yj9 h GLN 143 Cb 0.55 0.26 -0.15 0.00 -0.05 0.00 0.00 27.48 28.10 1yj9 h GLN 143 CO -0.68 -0.77 -0.42 1.15 -0.95 0.00 0.00 178.83 177.16 1yj9 h THR 144 N -1.25 0.01 0.02 -0.54 2.02 -0.77 1.90 112.91 114.29 1yj9 h THR 144 Ca -0.12 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.08 1yj9 h THR 144 Cb 0.92 0.01 -0.05 0.00 -1.74 0.00 0.00 68.15 67.29 1yj9 h THR 144 CO 0.20 0.00 -0.43 0.00 0.37 0.00 0.00 175.52 175.66 1yj9 h ALA 145 N 1.22 -0.72 -0.06 6.16 0.00 -1.00 0.37 119.26 125.23 1yj9 h ALA 145 Ca 0.31 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.20 1yj9 h ALA 145 Cb 0.57 0.76 -0.04 0.00 0.00 0.00 0.00 17.79 19.08 1yj9 h ALA 145 CO -0.96 -0.98 -0.15 0.00 0.00 0.00 0.00 179.25 177.16 1yj9 h ALA 146 N -0.11 -0.12 -0.93 0.00 0.00 0.61 -1.27 119.26 117.45 1yj9 h ALA 146 Ca 0.04 0.03 0.25 0.00 0.00 0.00 0.00 54.91 55.23 1yj9 h ALA 146 Cb 0.67 0.28 -0.14 0.00 0.00 0.00 0.00 17.79 18.60 1yj9 h ALA 146 CO -0.31 -0.62 0.41 -0.44 0.00 0.00 0.00 179.25 178.28 1yj9 h ASP 147 N -0.22 0.30 0.01 0.00 3.32 0.33 0.52 116.42 120.69 1yj9 h ASP 147 Ca 0.07 0.18 -0.00 0.00 0.02 0.00 0.00 57.03 57.30 1yj9 h ASP 147 Cb 0.32 0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1yj9 h ASP 147 CO -0.19 -0.08 -0.00 0.40 -1.72 0.00 0.00 179.24 177.65 1yj9 h ILE 148 N 0.34 1.06 -0.81 0.35 2.04 0.19 0.11 117.51 120.79 1yj9 h ILE 148 Ca 0.61 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 66.31 1yj9 h ILE 148 Cb 1.26 1.19 -0.05 0.00 -0.74 0.00 0.00 36.82 38.48 1yj9 h ILE 148 CO -0.59 0.05 0.51 -0.08 0.00 0.00 0.00 178.15 178.05 1yj9 h GLU 149 N -0.10 0.95 -0.06 2.37 4.81 0.61 -1.75 114.58 121.42 1yj9 h GLU 149 Ca -0.00 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.09 1yj9 h GLU 149 Cb 0.09 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1yj9 h GLU 149 CO 0.00 0.63 -0.36 1.96 -0.73 0.00 0.00 179.01 180.52 1yj9 h GLN 150 N 0.98 0.11 -0.75 1.92 1.08 -0.09 -3.09 115.11 115.27 1yj9 h GLN 150 Ca 0.33 -0.04 0.22 0.00 -1.45 0.00 0.00 58.65 57.70 1yj9 h GLN 150 Cb 0.05 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.44 1yj9 h GLN 150 CO -0.13 0.46 0.56 1.25 -0.95 0.00 0.00 178.83 180.02 1yj9 h LEU 151 N 0.10 0.00 -3.83 1.46 5.85 0.17 0.22 115.31 119.29 1yj9 h LEU 151 Ca 0.01 0.00 -0.42 0.00 0.84 0.00 0.00 57.88 58.31 1yj9 h LEU 151 Cb 0.68 0.00 -0.25 0.00 0.37 0.00 0.00 40.66 41.46 1yj9 h LEU 151 CO 0.05 0.00 0.46 0.35 -0.34 0.00 0.00 178.44 178.96 1yj9 n THR 152 N -4.23 3.04 -2.00 1.05 -2.24 -1.17 -4.98 114.28 103.74 1yj9 n THR 152 Ca 0.15 -2.09 -0.39 0.00 -2.27 0.00 0.00 64.05 59.45 1yj9 n THR 152 Cb 0.84 -0.43 0.01 0.00 -2.10 0.00 0.00 70.33 68.65 1yj9 n THR 152 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1yj9 s ARG 153 N -3.27 3.70 -0.07 -0.78 3.52 0.78 -4.88 118.95 117.95 1yj9 s ARG 153 Ca 0.54 2.13 -0.02 0.00 -0.13 0.00 0.00 55.73 58.24 1yj9 s ARG 153 Cb 0.46 -2.56 0.03 0.00 -1.56 0.00 0.00 34.95 31.33 1yj9 s ARG 153 CO 0.09 -0.71 0.04 -1.50 -0.81 0.00 0.00 175.30 172.41 1yj9 s ILE 154 N -1.32 0.13 -0.19 4.11 2.07 -1.26 -5.03 121.20 119.70 1yj9 s ILE 154 Ca 0.62 0.21 -0.14 0.00 -1.41 0.00 0.00 60.65 59.93 1yj9 s ILE 154 Cb -0.37 -0.38 -0.08 0.00 0.13 0.00 0.00 42.46 41.76 1yj9 s ILE 154 CO 0.47 0.16 -0.31 0.59 -1.91 0.00 0.00 174.94 173.93 1yj9 n ASN 155 N 5.22 1.79 -0.21 4.50 3.02 -1.26 -4.71 115.26 123.62 1yj9 n ASN 155 Ca -0.05 0.30 -0.02 0.00 -0.03 0.00 0.00 54.58 54.79 1yj9 n ASN 155 Cb 0.50 -0.71 0.01 0.00 -0.61 0.00 0.00 39.78 38.97 1yj9 n ASN 155 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1yj9 n ASP 156 N -4.24 -0.39 -4.92 6.41 5.75 -1.26 -4.67 116.55 113.24 1yj9 n ASP 156 Ca -0.29 0.94 -0.24 0.00 -0.01 0.00 0.00 54.79 55.19 1yj9 n ASP 156 Cb 0.64 -0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.53 1yj9 n ASP 156 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1yj9 s LYS 157 N -5.46 2.30 -0.12 0.11 1.02 -1.26 -5.08 119.74 111.24 1yj9 s LYS 157 Ca -0.07 -1.89 -0.29 0.00 0.02 0.00 0.00 55.97 53.74 1yj9 s LYS 157 Cb 0.10 -2.22 -0.03 0.00 -0.52 0.00 0.00 37.83 35.15 1yj9 s LYS 157 CO 0.37 -0.59 1.49 0.34 -0.92 0.00 0.00 175.35 176.04 1yj9 s ASP 158 N -4.32 6.74 0.24 2.83 -1.08 -1.26 -4.92 116.67 114.91 1yj9 s ASP 158 Ca 0.41 1.93 -0.06 0.00 -0.52 0.00 0.00 52.55 54.31 1yj9 s ASP 158 Cb -0.03 -2.54 0.26 0.00 -1.46 0.00 0.00 42.92 39.15 1yj9 s ASP 158 CO 0.25 -0.90 1.84 0.58 0.52 0.00 0.00 175.17 177.46 1yj9 h VAL 159 N 5.61 1.25 0.00 1.11 2.07 -1.88 -1.38 116.25 123.04 1yj9 h VAL 159 Ca -0.33 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.49 1yj9 h VAL 159 Cb 1.14 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1yj9 h VAL 159 CO 0.97 0.30 0.01 0.54 0.02 0.00 0.00 177.57 179.41 1yj9 n ARG 160 N -4.31 0.09 -0.06 1.57 1.74 -1.26 -2.73 116.66 111.70 1yj9 n ARG 160 Ca 0.08 0.59 -0.10 0.00 -0.77 0.00 0.00 57.85 57.65 1yj9 n ARG 160 Cb 0.14 -1.82 -0.05 0.00 -1.02 0.00 0.00 32.46 29.72 1yj9 n ARG 160 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1yj9 n VAL 161 N -2.00 0.63 -3.28 1.55 0.31 -0.95 -4.87 118.33 109.72 1yj9 n VAL 161 Ca -0.01 -0.20 -0.45 0.00 -0.01 0.00 0.00 64.34 63.68 1yj9 n VAL 161 Cb 0.03 -1.29 -0.06 0.00 -0.91 0.00 0.00 33.84 31.61 1yj9 n VAL 161 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1yj9 s PHE 162 N -2.21 3.17 -0.40 3.52 0.40 -0.56 -4.87 117.98 117.02 1yj9 s PHE 162 Ca -0.15 -0.93 0.04 0.00 -0.60 0.00 0.00 56.93 55.28 1yj9 s PHE 162 Cb 0.05 -3.52 0.06 0.00 0.51 0.00 0.00 43.02 40.11 1yj9 s PHE 162 CO 0.23 -0.98 0.80 1.04 0.70 0.00 0.00 175.22 177.01 1yj9 n GLN 163 N 5.60 0.84 -1.42 0.44 6.02 -1.24 -4.42 117.38 123.20 1yj9 n GLN 163 Ca -0.11 -1.09 -0.37 0.00 -0.01 0.00 0.00 57.00 55.41 1yj9 n GLN 163 Cb 0.43 -1.08 0.05 0.00 1.02 0.00 0.00 30.24 30.66 1yj9 n GLN 163 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1yj9 n ASP 164 N 0.06 -0.94 0.00 1.08 9.92 -1.26 -4.79 116.55 120.62 1yj9 n ASP 164 Ca 0.03 0.69 0.00 0.00 -0.53 0.00 0.00 54.79 54.98 1yj9 n ASP 164 Cb 0.18 -1.21 0.00 0.00 -0.64 0.00 0.00 41.12 39.45 1yj9 n ASP 164 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1yj9 n GLY 165 N 1.70 3.67 3.89 0.44 0.00 0.11 -4.96 105.19 110.04 1yj9 n GLY 165 Ca 0.11 -1.64 -0.31 0.00 0.00 0.00 0.00 46.02 44.19 1yj9 n GLY 165 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yj9 s VAL 166 N -2.00 5.02 -0.03 1.61 1.01 -1.26 -1.12 120.40 123.63 1yj9 s VAL 166 Ca 0.00 0.22 -0.06 0.00 0.00 0.00 0.00 61.98 62.14 1yj9 s VAL 166 Cb 0.00 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.73 1yj9 s VAL 166 CO 0.00 -0.12 0.14 -0.31 0.00 0.00 0.00 175.10 174.81 1yj9 s TYR 167 N -1.86 -0.07 -0.17 5.22 1.51 0.02 -4.62 117.35 117.38 1yj9 s TYR 167 Ca 0.45 0.16 -0.29 0.00 -1.01 0.00 0.00 57.07 56.37 1yj9 s TYR 167 Cb -0.11 0.01 -0.03 0.00 -0.11 0.00 0.00 41.96 41.72 1yj9 s TYR 167 CO 0.25 -0.17 1.51 0.42 -1.11 0.00 0.00 175.55 176.45 1yj9 s ILE 168 N -0.57 3.85 -0.20 2.71 -1.09 -1.26 -0.56 121.20 124.08 1yj9 s ILE 168 Ca -0.07 1.00 -0.04 0.00 -2.23 0.00 0.00 60.65 59.31 1yj9 s ILE 168 Cb -0.04 -3.76 -0.20 0.00 -1.58 0.00 0.00 42.46 36.88 1yj9 s ILE 168 CO 0.01 -0.22 0.02 0.41 -1.23 0.00 0.00 174.94 173.93 1yj9 n THR 169 N 5.91 1.61 -4.69 2.92 -1.04 0.51 -4.94 114.28 114.57 1yj9 n THR 169 Ca 0.17 -0.56 -0.23 0.00 -2.04 0.00 0.00 64.05 61.38 1yj9 n THR 169 Cb 0.45 -1.61 -0.15 0.00 -1.82 0.00 0.00 70.33 67.19 1yj9 n THR 169 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1yj9 s ARG 170 N -2.53 1.30 -0.11 -2.82 0.52 -0.94 -4.94 118.95 109.43 1yj9 s ARG 170 Ca -0.30 -0.52 0.03 0.00 -0.52 0.00 0.00 55.73 54.42 1yj9 s ARG 170 Cb 0.08 -1.22 0.01 0.00 0.52 0.00 0.00 34.95 34.34 1yj9 s ARG 170 CO 0.66 0.28 -0.22 0.15 0.02 0.00 0.00 175.30 176.18 1yj9 s LYS 171 N -0.19 2.93 0.00 3.54 1.02 -1.26 -2.01 119.74 123.77 1yj9 s LYS 171 Ca 0.03 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.19 1yj9 s LYS 171 Cb -0.07 -2.29 0.02 0.00 -0.52 0.00 0.00 37.83 34.97 1yj9 s LYS 171 CO 0.00 0.09 0.52 -0.35 -0.92 0.00 0.00 175.35 174.69