#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rq9 n ASN 2 N 0.00 0.00 -2.32 7.83 2.85 -1.26 -5.19 115.26 117.17 2rq9 n ASN 2 Ca 0.00 0.00 -0.10 0.00 -0.11 0.00 0.00 54.58 54.37 2rq9 n ASN 2 Cb 0.00 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 40.99 2rq9 n ASN 2 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 2rq9 n TYR 3 N -0.26 -0.14 -0.02 1.20 4.01 -1.26 -5.11 117.16 115.58 2rq9 n TYR 3 Ca 0.00 -1.25 -0.03 0.00 -0.16 0.00 0.00 57.90 56.45 2rq9 n TYR 3 Cb 0.00 0.06 -0.01 0.00 -0.31 0.00 0.00 39.34 39.08 2rq9 n TYR 3 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2rq9 n LYS 4 N -0.36 0.20 -2.74 -0.72 4.01 -1.26 -4.99 118.16 112.30 2rq9 n LYS 4 Ca 0.00 0.08 -0.07 0.00 -0.51 0.00 0.00 58.31 57.81 2rq9 n LYS 4 Cb 0.28 -0.78 0.05 0.00 -0.51 0.00 0.00 35.03 34.07 2rq9 n LYS 4 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 2rq9 n LYS 5 N -3.56 0.68 -2.52 1.97 4.81 -1.26 -4.80 118.16 113.48 2rq9 n LYS 5 Ca -0.05 -1.63 -0.38 0.00 -0.87 0.00 0.00 58.31 55.38 2rq9 n LYS 5 Cb 0.20 -1.32 -0.04 0.00 0.02 0.00 0.00 35.03 33.89 2rq9 n LYS 5 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2rq9 s PRO 6 N 0.65 4.34 0.14 1.64 0.04 -1.26 -4.01 135.00 136.54 2rq9 s PRO 6 Ca 0.31 1.62 -0.03 0.00 0.04 0.00 0.00 61.00 62.94 2rq9 s PRO 6 Cb 0.21 -2.78 -0.03 0.00 0.04 0.00 0.00 34.50 31.94 2rq9 s PRO 6 CO -0.21 -0.01 0.11 0.21 0.04 0.00 0.00 177.00 177.14 2rq9 s LYS 7 N -2.11 0.99 -0.03 4.56 2.47 0.48 -3.94 119.74 122.15 2rq9 s LYS 7 Ca 0.53 -1.38 0.06 0.00 -1.56 0.00 0.00 55.97 53.62 2rq9 s LYS 7 Cb -0.26 0.28 -0.01 0.00 -1.46 0.00 0.00 37.83 36.38 2rq9 s LYS 7 CO 0.32 -0.30 -0.20 -0.51 0.16 0.00 0.00 175.35 174.82 2rq9 s LEU 8 N -3.03 2.00 -0.48 5.43 1.43 -0.38 -1.39 118.68 122.26 2rq9 s LEU 8 Ca 0.22 -0.38 -0.20 0.00 -1.03 0.00 0.00 54.13 52.74 2rq9 s LEU 8 Cb 0.06 -1.06 0.04 0.00 0.03 0.00 0.00 46.19 45.27 2rq9 s LEU 8 CO 0.01 0.22 0.67 -0.76 0.23 0.00 0.00 176.35 176.72 2rq9 s LEU 9 N -0.27 4.66 0.35 1.79 1.02 -1.26 -0.73 118.68 124.24 2rq9 s LEU 9 Ca 0.03 -0.60 -0.13 0.00 0.02 0.00 0.00 54.13 53.45 2rq9 s LEU 9 Cb -0.10 -2.61 -0.08 0.00 0.02 0.00 0.00 46.19 43.43 2rq9 s LEU 9 CO 0.01 -0.88 0.74 -0.47 0.02 0.00 0.00 176.35 175.77 2rq9 s TYR 10 N 2.86 3.42 -0.54 0.29 5.04 -0.74 -2.41 117.35 125.27 2rq9 s TYR 10 Ca 0.20 1.13 0.05 0.00 -2.44 0.00 0.00 57.07 56.01 2rq9 s TYR 10 Cb -0.16 -2.48 0.19 0.00 0.35 0.00 0.00 41.96 39.86 2rq9 s TYR 10 CO 0.16 0.02 0.48 0.00 -1.34 0.00 0.00 175.55 174.87 2rq9 n SER 12 N 2.03 0.15 -0.32 0.00 3.41 -1.26 0.21 113.62 117.84 2rq9 n SER 12 Ca 0.25 1.04 0.01 0.00 -0.26 0.00 0.00 58.87 59.91 2rq9 n SER 12 Cb 0.43 -0.51 0.08 0.00 -0.26 0.00 0.00 64.21 63.95 2rq9 n SER 12 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 2rq9 h ASN 13 N 0.00 -1.07 0.00 4.04 -1.24 -1.39 -3.30 115.58 112.62 2rq9 h ASN 13 Ca 0.68 0.28 0.00 0.00 0.71 0.00 0.00 56.30 57.96 2rq9 h ASN 13 Cb 2.21 0.62 0.00 0.00 0.73 0.00 0.00 38.32 41.88 2rq9 h ASN 13 CO -0.34 -0.30 -0.90 0.61 -1.29 0.00 0.00 177.43 175.22 2rq9 n GLY 14 N -1.52 0.00 0.35 1.57 0.00 0.38 -4.96 105.19 101.01 2rq9 n GLY 14 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2rq9 n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rq9 n GLY 15 N 3.09 0.61 3.27 -0.02 0.00 0.56 -5.02 105.19 107.68 2rq9 n GLY 15 Ca 0.00 -0.63 -0.13 0.00 0.00 0.00 0.00 46.02 45.26 2rq9 n GLY 15 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2rq9 s HIS 16 N -2.23 1.15 -0.03 1.61 3.76 -1.26 -4.56 115.29 113.73 2rq9 s HIS 16 Ca 0.00 -1.34 0.02 0.00 -0.15 0.00 0.00 55.06 53.59 2rq9 s HIS 16 Cb 0.00 -0.47 -0.03 0.00 1.11 0.00 0.00 32.58 33.19 2rq9 s HIS 16 CO 0.00 -0.74 -0.08 -0.06 -0.85 0.00 0.00 174.74 173.01 2rq9 s PHE 17 N -3.98 2.88 -0.47 1.40 0.08 -0.15 -2.54 117.98 115.19 2rq9 s PHE 17 Ca 0.37 -0.03 -0.29 0.00 0.12 0.00 0.00 56.93 57.10 2rq9 s PHE 17 Cb 0.05 -1.65 0.03 0.00 -0.57 0.00 0.00 43.02 40.88 2rq9 s PHE 17 CO 0.14 0.33 1.13 -1.17 -0.10 0.00 0.00 175.22 175.55 2rq9 s LEU 18 N -1.07 3.66 0.14 -0.37 2.96 -1.01 -1.94 118.68 121.05 2rq9 s LEU 18 Ca 0.14 0.50 0.07 0.00 -0.22 0.00 0.00 54.13 54.62 2rq9 s LEU 18 Cb -0.11 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 2rq9 s LEU 18 CO 0.04 -1.23 -0.04 0.00 -1.32 0.00 0.00 176.35 173.80 2rq9 s ARG 19 N 4.39 2.31 -0.16 1.98 1.70 -0.98 -4.63 118.95 123.55 2rq9 s ARG 19 Ca 0.48 -1.04 0.00 0.00 -0.47 0.00 0.00 55.73 54.70 2rq9 s ARG 19 Cb -0.07 -2.36 0.03 0.00 -0.57 0.00 0.00 34.95 31.98 2rq9 s ARG 19 CO 0.31 0.49 -0.13 0.42 -1.08 0.00 0.00 175.30 175.30 2rq9 s ILE 20 N -1.48 1.60 0.46 4.99 1.01 -1.26 -3.16 121.20 123.36 2rq9 s ILE 20 Ca 0.25 -0.74 -0.10 0.00 0.00 0.00 0.00 60.65 60.07 2rq9 s ILE 20 Cb -0.10 -1.55 -0.06 0.00 0.01 0.00 0.00 42.46 40.77 2rq9 s ILE 20 CO 0.17 0.38 0.83 -0.76 0.00 0.00 0.00 174.94 175.56 2rq9 s LEU 21 N 1.46 3.68 0.00 2.97 1.43 0.18 -4.82 118.68 123.59 2rq9 s LEU 21 Ca 0.03 1.15 0.23 0.00 -1.03 0.00 0.00 54.13 54.52 2rq9 s LEU 21 Cb -0.14 -4.08 1.28 0.00 0.03 0.00 0.00 46.19 43.28 2rq9 s LEU 21 CO -0.10 -0.52 1.77 -0.81 0.23 0.00 0.00 176.35 176.91 2rq9 n PRO 22 N -1.76 0.52 0.00 1.29 -0.04 -1.26 -1.94 135.00 131.81 2rq9 n PRO 22 Ca 0.03 0.04 0.13 0.00 -0.04 0.00 0.00 63.50 63.65 2rq9 n PRO 22 Cb 0.54 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.77 2rq9 n PRO 22 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2rq9 n ASP 23 N -1.15 1.88 -0.46 3.54 2.03 -1.26 -4.93 116.55 116.19 2rq9 n ASP 23 Ca 0.14 -1.48 0.00 0.00 0.52 0.00 0.00 54.79 53.97 2rq9 n ASP 23 Cb 0.14 0.14 0.00 0.00 -0.72 0.00 0.00 41.12 40.68 2rq9 n ASP 23 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2rq9 n GLY 24 N 1.31 0.87 3.32 0.27 0.00 -0.82 -5.06 105.19 105.10 2rq9 n GLY 24 Ca 0.14 -0.50 -0.27 0.00 0.00 0.00 0.00 46.02 45.39 2rq9 n GLY 24 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rq9 s THR 25 N -2.73 1.96 -0.11 2.61 2.01 -1.24 -4.45 115.64 113.68 2rq9 s THR 25 Ca 0.00 -1.50 -0.00 0.00 0.31 0.00 0.00 61.69 60.49 2rq9 s THR 25 Cb 0.00 -1.73 0.02 0.00 0.01 0.00 0.00 72.50 70.81 2rq9 s THR 25 CO 0.00 0.13 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.30 2rq9 s VAL 26 N -0.98 1.03 0.11 3.82 1.01 -1.26 -0.65 120.40 123.48 2rq9 s VAL 26 Ca 0.10 -0.29 -0.06 0.00 0.00 0.00 0.00 61.98 61.73 2rq9 s VAL 26 Cb -0.10 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.22 2rq9 s VAL 26 CO 0.04 0.37 0.16 -1.81 0.00 0.00 0.00 175.10 173.85 2rq9 s ASP 27 N 1.69 0.19 0.26 3.32 1.01 -1.19 -4.29 116.67 117.67 2rq9 s ASP 27 Ca 0.05 -0.86 -0.07 0.00 0.71 0.00 0.00 52.55 52.38 2rq9 s ASP 27 Cb -0.13 0.33 -0.06 0.00 1.01 0.00 0.00 42.92 44.08 2rq9 s ASP 27 CO -0.08 -0.75 0.55 -0.83 0.21 0.00 0.00 175.17 174.27 2rq9 s GLY 28 N -2.93 2.07 -0.24 0.21 0.00 0.21 -2.31 107.32 104.33 2rq9 s GLY 28 Ca 0.11 -0.42 -0.12 0.00 0.00 0.00 0.00 44.72 44.29 2rq9 s GLY 28 CO -0.06 -0.30 0.56 -1.08 0.00 0.00 0.00 173.10 172.22 2rq9 s THR 29 N -1.95 -0.30 -0.93 0.90 -1.32 -0.82 -4.81 115.64 106.41 2rq9 s THR 29 Ca 0.45 0.05 -0.01 0.00 -1.21 0.00 0.00 61.69 60.98 2rq9 s THR 29 Cb -0.11 -0.84 0.34 0.00 -1.51 0.00 0.00 72.50 70.38 2rq9 s THR 29 CO 0.26 0.02 1.85 -1.14 -2.21 0.00 0.00 174.62 173.40 2rq9 n ARG 30 N 4.69 4.27 -3.47 7.08 0.63 -1.26 -0.98 116.66 127.61 2rq9 n ARG 30 Ca -0.18 -4.23 -0.22 0.00 -0.92 0.00 0.00 57.85 52.30 2rq9 n ARG 30 Cb 0.55 -2.38 -0.12 0.00 0.45 0.00 0.00 32.46 30.95 2rq9 n ARG 30 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2rq9 s ASP 31 N -1.39 2.33 -0.69 6.15 2.15 -1.26 -5.03 116.67 118.93 2rq9 s ASP 31 Ca 0.45 -0.86 -0.05 0.00 0.43 0.00 0.00 52.55 52.51 2rq9 s ASP 31 Cb 0.30 0.15 -0.05 0.00 -0.30 0.00 0.00 42.92 43.02 2rq9 s ASP 31 CO -0.24 -0.40 1.84 0.54 -0.17 0.00 0.00 175.17 176.74 2rq9 n ARG 32 N 5.29 1.55 0.00 4.34 3.00 -1.26 -3.11 116.66 126.47 2rq9 n ARG 32 Ca -0.04 -1.25 0.00 0.00 -0.01 0.00 0.00 57.85 56.55 2rq9 n ARG 32 Cb 0.45 -2.37 0.00 0.00 0.00 0.00 0.00 32.46 30.55 2rq9 n ARG 32 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2rq9 n SER 33 N 4.58 0.40 -4.53 0.55 2.88 -1.26 -5.07 113.62 111.17 2rq9 n SER 33 Ca 0.34 0.00 -0.53 0.00 -1.33 0.00 0.00 58.87 57.35 2rq9 n SER 33 Cb 0.11 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.52 2rq9 n SER 33 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2rq9 n ASP 34 N -2.35 0.60 -1.60 -3.46 -0.08 -1.18 -4.80 116.55 103.68 2rq9 n ASP 34 Ca 0.00 1.14 -0.11 0.00 -1.51 0.00 0.00 54.79 54.32 2rq9 n ASP 34 Cb 0.14 -1.07 0.11 0.00 2.34 0.00 0.00 41.12 42.64 2rq9 n ASP 34 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2rq9 n GLN 35 N 1.73 1.85 0.00 -0.67 1.13 -1.26 -3.83 117.38 116.32 2rq9 n GLN 35 Ca 0.18 -1.61 0.00 0.00 -1.94 0.00 0.00 57.00 53.63 2rq9 n GLN 35 Cb 0.18 -1.66 0.00 0.00 0.11 0.00 0.00 30.24 28.86 2rq9 n GLN 35 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2rq9 n HIS 36 N -0.29 0.00 -0.29 1.08 8.25 -1.26 -4.57 115.22 118.15 2rq9 n HIS 36 Ca 0.30 0.00 0.34 0.00 -0.26 0.00 0.00 57.72 58.10 2rq9 n HIS 36 Cb 1.08 0.07 0.72 0.00 1.12 0.00 0.00 29.99 32.98 2rq9 n HIS 36 CO 0.00 0.00 0.00 -0.84 0.64 0.00 0.00 176.34 176.14 2rq9 h ILE 37 N 0.00 0.30 -0.22 1.59 3.07 -1.82 -3.33 117.51 117.10 2rq9 h ILE 37 Ca 0.00 0.00 -0.07 0.00 1.55 0.00 0.00 64.86 66.34 2rq9 h ILE 37 Cb 0.68 0.34 -0.01 0.00 -0.27 0.00 0.00 36.82 37.57 2rq9 h ILE 37 CO 0.00 0.00 0.22 -1.10 -1.05 0.00 0.00 178.15 176.22 2rq9 s GLN 38 N -4.81 1.46 0.18 0.16 -0.21 -1.26 -4.68 119.66 110.49 2rq9 s GLN 38 Ca -0.05 -0.40 -0.12 0.00 0.02 0.00 0.00 55.36 54.81 2rq9 s GLN 38 Cb 0.21 -4.99 -0.07 0.00 1.00 0.00 0.00 33.01 29.16 2rq9 s GLN 38 CO 0.73 -5.08 0.53 -0.51 -2.12 0.00 0.00 175.29 168.84 2rq9 s LEU 39 N 15.67 4.26 -0.31 2.90 1.43 -0.49 -3.56 118.68 138.58 2rq9 s LEU 39 Ca 0.81 0.98 -0.09 0.00 -1.03 0.00 0.00 54.13 54.79 2rq9 s LEU 39 Cb -0.06 -3.43 0.00 0.00 0.03 0.00 0.00 46.19 42.73 2rq9 s LEU 39 CO 0.15 0.03 0.14 -1.10 0.23 0.00 0.00 176.35 175.80 2rq9 s GLN 40 N -2.35 3.22 -0.05 1.70 -1.52 0.17 0.18 119.66 121.02 2rq9 s GLN 40 Ca 0.42 -0.79 -0.16 0.00 -1.95 0.00 0.00 55.36 52.88 2rq9 s GLN 40 Cb -0.13 -3.54 -0.05 0.00 -0.22 0.00 0.00 33.01 29.07 2rq9 s GLN 40 CO 0.20 -0.45 0.43 -0.51 -0.25 0.00 0.00 175.29 174.71 2rq9 s LEU 41 N 1.58 4.39 0.04 2.90 1.02 -1.26 -2.42 118.68 124.94 2rq9 s LEU 41 Ca 0.04 0.88 -0.01 0.00 0.02 0.00 0.00 54.13 55.07 2rq9 s LEU 41 Cb -0.17 -2.62 -0.03 0.00 0.02 0.00 0.00 46.19 43.39 2rq9 s LEU 41 CO 0.05 0.19 -0.03 -0.44 0.02 0.00 0.00 176.35 176.14 2rq9 s SER 42 N -0.35 0.44 -0.16 2.29 0.01 -0.15 -4.94 113.70 110.84 2rq9 s SER 42 Ca 0.24 -0.86 -0.01 0.00 1.31 0.00 0.00 55.95 56.63 2rq9 s SER 42 Cb -0.16 0.17 -0.01 0.00 0.21 0.00 0.00 66.02 66.23 2rq9 s SER 42 CO 0.12 -0.51 -0.13 0.00 0.41 0.00 0.00 173.24 173.13 2rq9 s ALA 43 N -3.22 2.59 -0.09 1.44 0.00 -1.26 0.12 121.76 121.34 2rq9 s ALA 43 Ca 0.01 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 50.95 2rq9 s ALA 43 Cb 0.03 -1.32 -0.06 0.00 0.00 0.00 0.00 23.12 21.77 2rq9 s ALA 43 CO -0.07 -0.04 -0.07 -1.91 0.00 0.00 0.00 175.76 173.66 2rq9 n GLU 44 N 4.08 0.49 -4.38 0.00 2.13 -1.24 -5.00 120.64 116.71 2rq9 n GLU 44 Ca -0.19 0.05 -0.19 0.00 0.66 0.00 0.00 57.16 57.49 2rq9 n GLU 44 Cb 0.52 -1.18 -0.10 0.00 0.27 0.00 0.00 31.44 30.94 2rq9 n GLU 44 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2rq9 s SER 45 N -4.78 2.33 -0.08 4.31 0.01 -1.26 -5.05 113.70 109.19 2rq9 s SER 45 Ca -0.11 -1.20 -0.29 0.00 1.31 0.00 0.00 55.95 55.65 2rq9 s SER 45 Cb 0.03 -0.09 -0.05 0.00 0.21 0.00 0.00 66.02 66.12 2rq9 s SER 45 CO 0.22 -0.42 1.71 0.54 0.41 0.00 0.00 173.24 175.70 2rq9 s VAL 46 N -3.20 3.51 -0.02 3.43 0.11 -1.26 -1.02 120.40 121.95 2rq9 s VAL 46 Ca 0.29 0.60 0.00 0.00 -2.93 0.00 0.00 61.98 59.94 2rq9 s VAL 46 Cb 0.05 -3.43 0.00 0.00 -1.53 0.00 0.00 36.38 31.47 2rq9 s VAL 46 CO 0.10 -0.10 0.00 0.61 -3.33 0.00 0.00 175.10 172.39 2rq9 n GLY 47 N 4.37 0.47 3.32 6.54 0.00 -1.26 -5.01 105.19 113.63 2rq9 n GLY 47 Ca 0.19 -0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2rq9 n GLY 47 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2rq9 s GLU 48 N -0.44 2.17 0.04 1.61 2.02 -0.19 0.44 118.70 124.36 2rq9 s GLU 48 Ca 0.00 -0.91 0.02 0.00 0.02 0.00 0.00 54.97 54.10 2rq9 s GLU 48 Cb 0.00 -2.08 -0.02 0.00 0.10 0.00 0.00 34.13 32.13 2rq9 s GLU 48 CO 0.00 0.56 -0.07 0.14 0.02 0.00 0.00 175.26 175.91 2rq9 s VAL 49 N -0.60 0.47 -0.10 2.63 -7.23 -0.47 -3.60 120.40 111.50 2rq9 s VAL 49 Ca 0.10 -1.12 0.03 0.00 -1.81 0.00 0.00 61.98 59.17 2rq9 s VAL 49 Cb -0.10 -0.64 -0.01 0.00 0.56 0.00 0.00 36.38 36.19 2rq9 s VAL 49 CO -0.01 -0.45 -0.20 -0.31 -0.31 0.00 0.00 175.10 173.82 2rq9 s TYR 50 N -1.60 2.62 -0.31 2.82 2.02 0.32 -2.38 117.35 120.84 2rq9 s TYR 50 Ca -0.09 -0.81 -0.01 0.00 -0.37 0.00 0.00 57.07 55.79 2rq9 s TYR 50 Cb -0.09 -1.72 0.06 0.00 -0.40 0.00 0.00 41.96 39.81 2rq9 s TYR 50 CO -0.00 -0.28 0.01 0.42 -1.57 0.00 0.00 175.55 174.12 2rq9 s ILE 51 N 0.18 2.85 0.05 2.71 1.01 -1.26 -0.97 121.20 125.76 2rq9 s ILE 51 Ca -0.12 -1.56 0.06 0.00 0.00 0.00 0.00 60.65 59.04 2rq9 s ILE 51 Cb -0.16 -2.71 -0.02 0.00 0.01 0.00 0.00 42.46 39.57 2rq9 s ILE 51 CO 0.06 -0.19 -0.18 -0.75 0.00 0.00 0.00 174.94 173.88 2rq9 s LYS 52 N 1.19 1.16 0.16 2.79 2.20 -1.01 -0.22 119.74 126.01 2rq9 s LYS 52 Ca -0.03 -0.89 -0.30 0.00 -0.36 0.00 0.00 55.97 54.39 2rq9 s LYS 52 Cb -0.20 -1.25 -0.07 0.00 -1.51 0.00 0.00 37.83 34.80 2rq9 s LYS 52 CO -0.02 0.31 0.98 0.45 -0.36 0.00 0.00 175.35 176.71 2rq9 s SER 53 N -1.25 7.50 0.00 1.43 0.15 0.23 -0.65 113.70 121.11 2rq9 s SER 53 Ca 0.05 1.90 0.23 0.00 0.70 0.00 0.00 55.95 58.83 2rq9 s SER 53 Cb -0.09 -2.60 0.70 0.00 -1.71 0.00 0.00 66.02 62.32 2rq9 s SER 53 CO 0.02 -0.03 1.54 0.35 1.20 0.00 0.00 173.24 176.31 2rq9 n THR 54 N 2.30 0.19 0.00 6.45 -2.24 -1.23 -3.35 114.28 116.39 2rq9 n THR 54 Ca 0.01 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 2rq9 n THR 54 Cb 0.48 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.35 2rq9 n THR 54 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2rq9 n GLU 55 N 0.61 0.00 0.31 -0.78 4.07 -1.26 -4.83 120.64 118.77 2rq9 n GLU 55 Ca 0.17 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 57.12 2rq9 n GLU 55 Cb 0.42 -0.24 -0.08 0.00 -0.06 0.00 0.00 31.44 31.48 2rq9 n GLU 55 CO 0.00 0.00 0.00 1.79 -0.06 0.00 0.00 177.13 178.86 2rq9 h THR 56 N 0.00 0.30 0.00 6.31 1.35 -1.88 -3.48 112.91 115.51 2rq9 h THR 56 Ca 0.00 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 2rq9 h THR 56 Cb 0.00 0.39 0.00 0.00 -1.73 0.00 0.00 68.15 66.81 2rq9 h THR 56 CO 0.00 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 175.91 2rq9 n GLY 57 N -0.83 1.94 3.74 5.82 0.00 -1.21 -5.09 105.19 109.55 2rq9 n GLY 57 Ca -0.12 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 2rq9 n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rq9 s GLN 58 N -0.18 2.63 0.02 1.61 -0.21 -1.26 -4.89 119.66 117.38 2rq9 s GLN 58 Ca 0.00 -1.17 0.00 0.00 0.02 0.00 0.00 55.36 54.21 2rq9 s GLN 58 Cb 0.00 -2.40 -0.04 0.00 1.00 0.00 0.00 33.01 31.57 2rq9 s GLN 58 CO 0.00 0.40 0.10 0.71 -2.12 0.00 0.00 175.29 174.38 2rq9 s TYR 59 N -2.10 3.30 -0.32 0.91 2.02 -0.73 -0.60 117.35 119.83 2rq9 s TYR 59 Ca 0.31 0.19 -0.28 0.00 -0.37 0.00 0.00 57.07 56.92 2rq9 s TYR 59 Cb -0.08 -1.72 0.01 0.00 -0.40 0.00 0.00 41.96 39.78 2rq9 s TYR 59 CO 0.22 0.55 1.01 -1.17 -1.57 0.00 0.00 175.55 174.60 2rq9 s LEU 60 N -1.97 3.96 0.05 -1.29 2.96 0.69 0.85 118.68 123.92 2rq9 s LEU 60 Ca 0.26 0.93 0.01 0.00 -0.22 0.00 0.00 54.13 55.11 2rq9 s LEU 60 Cb -0.12 -3.44 -0.03 0.00 0.50 0.00 0.00 46.19 43.10 2rq9 s LEU 60 CO 0.17 -0.84 -0.05 0.00 -1.32 0.00 0.00 176.35 174.32 2rq9 s ALA 61 N 3.53 0.48 -0.25 5.97 0.00 -0.62 -4.26 121.76 126.61 2rq9 s ALA 61 Ca 0.43 -0.91 -0.04 0.00 0.00 0.00 0.00 51.96 51.44 2rq9 s ALA 61 Cb -0.12 0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.15 2rq9 s ALA 61 CO 0.15 -0.18 -0.01 1.41 0.00 0.00 0.00 175.76 177.13 2rq9 s MET 62 N -2.45 3.10 0.00 0.00 1.75 -1.25 -0.13 119.30 120.31 2rq9 s MET 62 Ca -0.04 -0.82 0.00 0.00 -1.25 0.00 0.00 55.69 53.57 2rq9 s MET 62 Cb -0.03 -3.12 0.00 0.00 2.84 0.00 0.00 34.83 34.51 2rq9 s MET 62 CO -0.03 -0.35 0.00 -3.47 -0.65 0.00 0.00 175.02 170.52 2rq9 n ASP 63 N 4.78 -0.19 0.03 1.11 -0.08 -0.80 -4.91 116.55 116.48 2rq9 n ASP 63 Ca -0.16 -0.07 -0.10 0.00 -1.51 0.00 0.00 54.79 52.95 2rq9 n ASP 63 Cb 0.49 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.81 2rq9 n ASP 63 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 2rq9 h THR 64 N -0.74 1.23 0.00 5.18 1.35 -1.99 -3.25 112.91 114.69 2rq9 h THR 64 Ca 0.00 -2.99 0.00 0.00 -0.55 0.00 0.00 66.41 62.87 2rq9 h THR 64 Cb 0.00 2.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.07 2rq9 h THR 64 CO 0.00 0.74 0.11 0.44 -0.25 0.00 0.00 175.52 176.56 2rq9 h ASP 65 N 0.01 0.00 0.00 5.36 5.19 -2.04 -3.44 116.42 121.50 2rq9 h ASP 65 Ca -0.17 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.24 2rq9 h ASP 65 Cb 1.92 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.43 2rq9 h ASP 65 CO 0.11 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.84 2rq9 n GLY 66 N -1.18 0.65 3.92 2.75 0.00 -1.23 -4.63 105.19 105.47 2rq9 n GLY 66 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 2rq9 n GLY 66 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2rq9 s LEU 67 N 0.00 3.49 -0.02 0.99 2.01 -1.26 0.56 118.68 124.45 2rq9 s LEU 67 Ca 0.00 0.71 -0.04 0.00 0.01 0.00 0.00 54.13 54.80 2rq9 s LEU 67 Cb 0.00 -3.59 -0.04 0.00 0.01 0.00 0.00 46.19 42.56 2rq9 s LEU 67 CO 0.00 -0.78 0.20 -0.76 1.01 0.00 0.00 176.35 176.02 2rq9 s LEU 68 N -4.79 4.37 0.00 1.79 1.43 -1.26 -1.91 118.68 118.32 2rq9 s LEU 68 Ca 0.50 0.43 -0.18 0.00 -1.03 0.00 0.00 54.13 53.85 2rq9 s LEU 68 Cb -0.10 -2.55 0.03 0.00 0.03 0.00 0.00 46.19 43.60 2rq9 s LEU 68 CO 0.43 0.28 0.39 -0.72 0.23 0.00 0.00 176.35 176.96 2rq9 s TYR 69 N -1.27 -0.26 -0.17 0.29 -0.85 0.81 -4.25 117.35 111.64 2rq9 s TYR 69 Ca 0.25 0.33 -0.29 0.00 -0.52 0.00 0.00 57.07 56.85 2rq9 s TYR 69 Cb -0.13 0.17 -0.00 0.00 0.38 0.00 0.00 41.96 42.38 2rq9 s TYR 69 CO 0.16 -0.48 1.09 0.20 -1.52 0.00 0.00 175.55 174.99 2rq9 s GLY 70 N -1.59 1.88 0.07 5.49 0.00 -1.26 -1.59 107.32 110.34 2rq9 s GLY 70 Ca -0.10 0.32 -0.23 0.00 0.00 0.00 0.00 44.72 44.71 2rq9 s GLY 70 CO 0.02 2.18 0.70 -1.35 0.00 0.00 0.00 173.10 174.66 2rq9 s SER 71 N 1.34 7.19 0.29 1.64 1.04 0.25 -4.78 113.70 120.67 2rq9 s SER 71 Ca 0.48 1.41 0.05 0.00 0.48 0.00 0.00 55.95 58.37 2rq9 s SER 71 Cb -0.18 -2.44 0.45 0.00 0.10 0.00 0.00 66.02 63.95 2rq9 s SER 71 CO 0.12 0.13 1.72 0.06 0.98 0.00 0.00 173.24 176.24 2rq9 h GLN 72 N 5.11 0.33 -5.65 4.02 3.07 -1.92 -1.93 115.11 118.14 2rq9 h GLN 72 Ca -0.46 -0.14 -0.47 0.00 0.09 0.00 0.00 58.65 57.67 2rq9 h GLN 72 Cb 1.21 -0.01 -0.16 0.00 0.08 0.00 0.00 27.48 28.59 2rq9 h GLN 72 CO 0.68 0.64 -0.76 0.95 0.09 0.00 0.00 178.83 180.43 2rq9 s THR 73 N -4.30 1.67 -0.41 1.86 -4.23 -1.26 -4.89 115.64 104.07 2rq9 s THR 73 Ca -0.05 -2.00 -0.29 0.00 -1.18 0.00 0.00 61.69 58.17 2rq9 s THR 73 Cb 0.14 -1.86 0.01 0.00 1.34 0.00 0.00 72.50 72.13 2rq9 s THR 73 CO 0.78 -0.46 1.41 -2.16 -0.54 0.00 0.00 174.62 173.65 2rq9 s PRO 74 N -3.13 3.57 0.19 3.99 0.04 -1.26 -4.83 135.00 133.57 2rq9 s PRO 74 Ca 0.17 0.93 0.08 0.00 0.04 0.00 0.00 61.00 62.22 2rq9 s PRO 74 Cb -0.03 -4.02 -0.04 0.00 0.04 0.00 0.00 34.50 30.44 2rq9 s PRO 74 CO 0.06 -1.57 -0.16 -0.80 0.04 0.00 0.00 177.00 174.57 2rq9 s ASN 75 N 3.93 2.65 0.45 6.66 0.01 -1.26 -5.01 114.94 122.37 2rq9 s ASN 75 Ca 0.61 -0.94 0.28 0.00 -0.71 0.00 0.00 52.86 52.10 2rq9 s ASN 75 Cb -0.14 -0.15 1.33 0.00 0.41 0.00 0.00 41.25 42.71 2rq9 s ASN 75 CO 0.33 -0.10 1.73 -0.33 -1.51 0.00 0.00 177.10 177.22 2rq9 h GLU 76 N 2.91 0.19 -0.22 -0.60 5.08 -1.94 1.63 114.58 121.62 2rq9 h GLU 76 Ca -0.40 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.01 2rq9 h GLU 76 Cb 1.22 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 2rq9 h GLU 76 CO 0.56 0.12 0.20 0.93 -1.00 0.00 0.00 179.01 179.83 2rq9 h GLU 77 N 0.19 0.00 0.00 2.33 5.08 -1.95 0.92 114.58 121.15 2rq9 h GLU 77 Ca 0.67 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.03 2rq9 h GLU 77 Cb 2.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.36 2rq9 h GLU 77 CO -0.25 0.00 -0.04 0.00 -1.00 0.00 0.00 179.01 177.72 2rq9 s LEU 79 N -5.95 4.07 0.33 0.00 2.96 0.32 -4.30 118.68 116.11 2rq9 s LEU 79 Ca 0.07 0.92 0.09 0.00 -0.22 0.00 0.00 54.13 54.99 2rq9 s LEU 79 Cb 0.06 -3.07 -0.05 0.00 0.50 0.00 0.00 46.19 43.63 2rq9 s LEU 79 CO 0.66 -0.47 0.01 -0.36 -1.32 0.00 0.00 176.35 174.88 2rq9 s PHE 80 N 2.73 2.56 -0.21 5.38 0.40 -1.00 -1.41 117.98 126.43 2rq9 s PHE 80 Ca 0.32 -0.42 -0.08 0.00 -0.60 0.00 0.00 56.93 56.15 2rq9 s PHE 80 Cb -0.15 -1.47 -0.04 0.00 0.51 0.00 0.00 43.02 41.87 2rq9 s PHE 80 CO 0.08 0.48 0.08 -0.51 0.70 0.00 0.00 175.22 176.05 2rq9 s LEU 81 N -3.72 3.71 0.07 -0.37 2.01 0.34 -1.37 118.68 119.35 2rq9 s LEU 81 Ca 0.35 -0.03 0.04 0.00 0.01 0.00 0.00 54.13 54.51 2rq9 s LEU 81 Cb -0.01 -1.97 -0.04 0.00 0.01 0.00 0.00 46.19 44.19 2rq9 s LEU 81 CO 0.19 0.08 -0.02 -0.70 1.01 0.00 0.00 176.35 176.92 2rq9 s GLU 82 N 0.94 2.54 0.18 1.70 -6.30 0.17 -1.38 118.70 116.55 2rq9 s GLU 82 Ca 0.04 -0.82 -0.11 0.00 -2.50 0.00 0.00 54.97 51.58 2rq9 s GLU 82 Cb -0.14 -2.53 0.00 0.00 0.00 0.00 0.00 34.13 31.46 2rq9 s GLU 82 CO 0.03 0.55 0.37 0.50 0.02 0.00 0.00 175.26 176.73 2rq9 s ARG 83 N -2.13 1.27 -0.45 4.30 3.52 -1.20 -4.65 118.95 119.60 2rq9 s ARG 83 Ca 0.24 -1.12 -0.19 0.00 -0.13 0.00 0.00 55.73 54.53 2rq9 s ARG 83 Cb -0.12 0.42 0.03 0.00 -1.56 0.00 0.00 34.95 33.73 2rq9 s ARG 83 CO 0.16 -0.50 0.56 -1.17 -0.81 0.00 0.00 175.30 173.55 2rq9 s LEU 84 N -2.95 4.77 0.17 -0.88 1.98 -1.26 -2.51 118.68 118.00 2rq9 s LEU 84 Ca 0.16 -0.62 0.02 0.00 -2.89 0.00 0.00 54.13 50.80 2rq9 s LEU 84 Cb 0.02 -2.53 -0.04 0.00 0.66 0.00 0.00 46.19 44.30 2rq9 s LEU 84 CO 0.01 -0.74 0.32 -1.61 -1.89 0.00 0.00 176.35 172.43 2rq9 s GLU 85 N 2.52 3.45 0.40 1.98 2.02 0.99 -5.01 118.70 125.07 2rq9 s GLU 85 Ca 0.17 -0.58 -0.06 0.00 0.02 0.00 0.00 54.97 54.52 2rq9 s GLU 85 Cb -0.17 -2.93 0.09 0.00 0.10 0.00 0.00 34.13 31.23 2rq9 s GLU 85 CO 0.15 0.48 0.21 0.39 0.02 0.00 0.00 175.26 176.51 2rq9 n GLU 86 N -0.71 -1.54 -1.49 1.61 1.02 -1.26 -1.79 120.64 116.47 2rq9 n GLU 86 Ca -0.07 -0.35 -0.16 0.00 -0.02 0.00 0.00 57.16 56.56 2rq9 n GLU 86 Cb 0.54 -0.55 -0.07 0.00 -0.02 0.00 0.00 31.44 31.34 2rq9 n GLU 86 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2rq9 n ASN 87 N -2.52 -4.29 -3.55 1.62 3.02 -1.26 -1.93 115.26 106.36 2rq9 n ASN 87 Ca 0.03 0.39 -0.24 0.00 -0.03 0.00 0.00 54.58 54.73 2rq9 n ASN 87 Cb 0.14 -3.89 0.04 0.00 -0.61 0.00 0.00 39.78 35.47 2rq9 n ASN 87 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 2rq9 n HIS 88 N -2.11 -2.14 -4.07 3.10 -0.00 -1.22 -5.00 115.22 103.78 2rq9 n HIS 88 Ca -0.16 0.63 -0.09 0.00 0.46 0.00 0.00 57.72 58.56 2rq9 n HIS 88 Cb 0.54 -3.57 -0.09 0.00 -0.12 0.00 0.00 29.99 26.75 2rq9 n HIS 88 CO 0.00 0.00 0.00 0.71 0.46 0.00 0.00 176.34 177.51 2rq9 s TYR 89 N -3.35 0.63 0.30 1.57 2.02 -0.74 -4.98 117.35 112.80 2rq9 s TYR 89 Ca 0.37 -1.04 0.10 0.00 -0.37 0.00 0.00 57.07 56.14 2rq9 s TYR 89 Cb -0.12 -0.33 -0.05 0.00 -0.40 0.00 0.00 41.96 41.07 2rq9 s TYR 89 CO 0.83 -0.55 -0.03 -0.80 -1.57 0.00 0.00 175.55 173.44 2rq9 s ASN 90 N -2.99 4.24 0.23 2.29 -0.87 0.17 -0.00 114.94 118.01 2rq9 s ASN 90 Ca 0.18 -0.85 0.03 0.00 -1.57 0.00 0.00 52.86 50.66 2rq9 s ASN 90 Cb 0.06 -0.63 -0.05 0.00 -0.02 0.00 0.00 41.25 40.62 2rq9 s ASN 90 CO -0.02 -0.09 0.00 0.42 -2.57 0.00 0.00 177.10 174.84 2rq9 s THR 91 N -2.43 0.99 -0.12 1.60 -4.23 -1.04 0.19 115.64 110.60 2rq9 s THR 91 Ca 0.33 -2.03 -0.07 0.00 -1.18 0.00 0.00 61.69 58.74 2rq9 s THR 91 Cb -0.04 -2.35 0.04 0.00 1.34 0.00 0.00 72.50 71.49 2rq9 s THR 91 CO 0.19 -0.31 0.29 -0.31 -0.54 0.00 0.00 174.62 173.94 2rq9 s TYR 92 N -3.45 -0.39 0.03 3.99 2.02 -1.25 -3.26 117.35 115.05 2rq9 s TYR 92 Ca 0.29 0.89 0.03 0.00 -0.37 0.00 0.00 57.07 57.91 2rq9 s TYR 92 Cb 0.06 0.11 -0.02 0.00 -0.40 0.00 0.00 41.96 41.71 2rq9 s TYR 92 CO 0.09 -0.24 -0.08 0.42 -1.57 0.00 0.00 175.55 174.17 2rq9 s ILE 93 N 0.99 0.62 0.25 2.71 1.01 -0.48 -2.77 121.20 123.53 2rq9 s ILE 93 Ca -0.07 -0.88 -0.30 0.00 0.00 0.00 0.00 60.65 59.41 2rq9 s ILE 93 Cb -0.08 -0.63 -0.09 0.00 0.01 0.00 0.00 42.46 41.68 2rq9 s ILE 93 CO -0.07 -0.20 1.14 -0.55 0.00 0.00 0.00 174.94 175.26 2rq9 s SER 94 N -1.18 7.19 0.00 3.58 0.15 -1.24 0.12 113.70 122.33 2rq9 s SER 94 Ca -0.05 2.27 0.00 0.00 0.70 0.00 0.00 55.95 58.87 2rq9 s SER 94 Cb -0.08 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.61 2rq9 s SER 94 CO 0.00 -0.23 0.79 1.17 1.20 0.00 0.00 173.24 176.17 2rq9 n LYS 95 N 1.59 0.00 -0.33 5.44 4.81 -0.50 0.53 118.16 129.70 2rq9 n LYS 95 Ca 0.01 0.42 0.36 0.00 -0.87 0.00 0.00 58.31 58.22 2rq9 n LYS 95 Cb 0.45 -1.35 0.75 0.00 0.02 0.00 0.00 35.03 34.91 2rq9 n LYS 95 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 2rq9 h LYS 96 N 0.00 0.00 -2.16 1.64 3.64 -1.81 0.12 116.57 118.00 2rq9 h LYS 96 Ca 0.00 0.00 -0.60 0.00 -1.27 0.00 0.00 60.65 58.78 2rq9 h LYS 96 Cb 0.00 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 31.41 2rq9 h LYS 96 CO 0.00 0.00 -0.56 0.72 -2.27 0.00 0.00 179.45 177.34 2rq9 n HIS 97 N -4.17 3.90 -0.12 1.91 8.25 -1.09 -4.76 115.22 119.15 2rq9 n HIS 97 Ca 0.26 -3.78 -0.21 0.00 -0.26 0.00 0.00 57.72 53.73 2rq9 n HIS 97 Cb 1.27 -0.46 -0.07 0.00 1.12 0.00 0.00 29.99 31.84 2rq9 n HIS 97 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2rq9 n ALA 98 N -0.28 1.02 0.23 -1.41 0.00 0.19 -3.71 120.51 116.55 2rq9 n ALA 98 Ca 0.33 -0.92 0.18 0.00 0.00 0.00 0.00 53.44 53.03 2rq9 n ALA 98 Cb 0.43 0.04 0.84 0.00 0.00 0.00 0.00 19.45 20.75 2rq9 n ALA 98 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2rq9 h GLU 99 N -1.00 0.00 0.00 0.00 5.08 -1.83 1.34 114.58 118.17 2rq9 h GLU 99 Ca -0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2rq9 h GLU 99 Cb 1.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.59 2rq9 h GLU 99 CO -0.25 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.39 2rq9 n LYS 100 N -3.44 0.32 -3.54 2.33 5.02 -1.26 -4.91 118.16 112.68 2rq9 n LYS 100 Ca 0.02 0.06 -0.22 0.00 -2.02 0.00 0.00 58.31 56.14 2rq9 n LYS 100 Cb 0.40 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.93 2rq9 n LYS 100 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2rq9 n ASN 101 N -1.30 -5.87 -4.43 4.39 4.13 0.46 -4.87 115.26 107.77 2rq9 n ASN 101 Ca 0.11 -0.78 -0.33 0.00 1.68 0.00 0.00 54.58 55.26 2rq9 n ASN 101 Cb 0.20 -3.56 -0.13 0.00 -1.54 0.00 0.00 39.78 34.75 2rq9 n ASN 101 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 2rq9 s TRP 102 N -3.26 2.87 0.06 3.10 0.51 -1.25 -4.71 118.94 116.26 2rq9 s TRP 102 Ca 0.27 -0.47 0.07 0.00 -2.12 0.00 0.00 56.10 53.85 2rq9 s TRP 102 Cb -0.09 -1.85 -0.04 0.00 -0.81 0.00 0.00 33.47 30.69 2rq9 s TRP 102 CO 0.84 -0.09 -0.14 -0.06 -0.51 0.00 0.00 176.95 176.98 2rq9 s PHE 103 N 0.18 2.66 0.00 -1.98 0.40 -1.24 -3.79 117.98 114.20 2rq9 s PHE 103 Ca -0.06 -0.19 0.00 0.00 -0.60 0.00 0.00 56.93 56.08 2rq9 s PHE 103 Cb -0.15 -1.46 0.00 0.00 0.51 0.00 0.00 43.02 41.92 2rq9 s PHE 103 CO 0.04 0.34 0.00 0.28 0.70 0.00 0.00 175.22 176.58 2rq9 n VAL 104 N 1.23 0.00 -1.22 -0.44 0.31 -1.12 -4.53 118.33 112.57 2rq9 n VAL 104 Ca -0.15 0.28 0.14 0.00 -0.01 0.00 0.00 64.34 64.60 2rq9 n VAL 104 Cb 0.52 -1.24 -0.06 0.00 -0.91 0.00 0.00 33.84 32.15 2rq9 n VAL 104 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2rq9 n GLY 105 N 0.13 -2.10 2.87 2.92 0.00 -1.25 -4.07 105.19 103.69 2rq9 n GLY 105 Ca 0.00 -0.78 -0.16 0.00 0.00 0.00 0.00 46.02 45.08 2rq9 n GLY 105 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2rq9 s LEU 106 N -6.30 1.50 0.00 0.99 1.43 -1.26 -2.58 118.68 112.46 2rq9 s LEU 106 Ca 0.00 -0.05 -0.11 0.00 -1.03 0.00 0.00 54.13 52.94 2rq9 s LEU 106 Cb 0.00 -0.22 0.17 0.00 0.03 0.00 0.00 46.19 46.17 2rq9 s LEU 106 CO 0.00 -0.04 0.39 0.29 0.23 0.00 0.00 176.35 177.21 2rq9 n LYS 107 N 3.70 -1.60 0.00 1.70 5.02 0.56 -4.62 118.16 122.91 2rq9 n LYS 107 Ca -0.22 -0.65 0.13 0.00 -2.02 0.00 0.00 58.31 55.56 2rq9 n LYS 107 Cb 0.53 -1.17 0.49 0.00 -0.02 0.00 0.00 35.03 34.87 2rq9 n LYS 107 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2rq9 n LYS 108 N -1.88 0.52 -0.41 1.97 0.00 -1.26 -3.28 118.16 113.81 2rq9 n LYS 108 Ca 0.06 -0.22 0.05 0.00 0.00 0.00 0.00 58.31 58.20 2rq9 n LYS 108 Cb 0.27 -1.50 0.22 0.00 0.00 0.00 0.00 35.03 34.02 2rq9 n LYS 108 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2rq9 n ASN 109 N -1.05 3.25 -1.83 3.14 4.13 -1.26 -4.86 115.26 116.78 2rq9 n ASN 109 Ca 0.11 -2.34 -0.16 0.00 1.68 0.00 0.00 54.58 53.88 2rq9 n ASN 109 Cb 0.31 -0.49 -0.00 0.00 -1.54 0.00 0.00 39.78 38.06 2rq9 n ASN 109 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2rq9 n GLY 110 N 0.70 -0.26 3.49 7.41 0.00 -1.21 -4.94 105.19 110.38 2rq9 n GLY 110 Ca 0.16 -0.22 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 2rq9 n GLY 110 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rq9 s SER 111 N -2.37 3.04 0.19 1.61 0.01 -1.26 0.66 113.70 115.58 2rq9 s SER 111 Ca 0.03 -1.28 -0.30 0.00 1.31 0.00 0.00 55.95 55.71 2rq9 s SER 111 Cb -0.01 -0.22 -0.08 0.00 0.21 0.00 0.00 66.02 65.91 2rq9 s SER 111 CO 0.04 -0.41 1.19 0.00 0.41 0.00 0.00 173.24 174.47 2rq9 s LYS 113 N -0.28 4.28 0.31 0.00 2.20 -1.07 -4.51 119.74 120.67 2rq9 s LYS 113 Ca 0.52 0.55 -0.22 0.00 -0.36 0.00 0.00 55.97 56.46 2rq9 s LYS 113 Cb -0.33 -3.51 -0.15 0.00 -1.51 0.00 0.00 37.83 32.34 2rq9 s LYS 113 CO 0.37 -0.04 0.22 0.54 -0.36 0.00 0.00 175.35 176.08 2rq9 n ARG 114 N 4.33 0.00 0.34 4.03 3.00 -1.26 -4.82 116.66 122.29 2rq9 n ARG 114 Ca -0.04 0.00 -0.15 0.00 -0.01 0.00 0.00 57.85 57.65 2rq9 n ARG 114 Cb 0.51 -0.92 -0.08 0.00 0.00 0.00 0.00 32.46 31.97 2rq9 n ARG 114 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 2rq9 h GLY 115 N 0.51 -0.92 -3.33 -0.13 0.00 -0.12 -3.06 103.07 96.01 2rq9 h GLY 115 Ca -0.31 0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 2rq9 h GLY 115 CO 0.46 -0.34 -0.01 -1.55 0.00 0.00 0.00 176.54 175.10 2rq9 n PRO 116 N -5.39 0.81 -0.46 4.80 -0.04 -1.26 -2.55 135.00 130.91 2rq9 n PRO 116 Ca -0.12 -0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 2rq9 n PRO 116 Cb 0.37 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 32.64 2rq9 n PRO 116 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2rq9 n ARG 117 N 1.70 0.00 -4.30 0.54 5.12 -1.16 -5.10 116.66 113.46 2rq9 n ARG 117 Ca 0.03 -0.78 -0.24 0.00 -1.93 0.00 0.00 57.85 54.92 2rq9 n ARG 117 Cb 0.40 -0.41 -0.08 0.00 -1.16 0.00 0.00 32.46 31.21 2rq9 n ARG 117 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2rq9 s THR 118 N 0.00 2.90 0.19 0.55 -4.23 -1.06 -4.91 115.64 109.08 2rq9 s THR 118 Ca 0.00 -1.96 -0.23 0.00 -1.18 0.00 0.00 61.69 58.33 2rq9 s THR 118 Cb 0.00 -2.79 0.07 0.00 1.34 0.00 0.00 72.50 71.12 2rq9 s THR 118 CO 0.00 -0.26 1.01 -1.00 -0.54 0.00 0.00 174.62 173.82 2rq9 s HIS 119 N -2.45 0.02 -0.14 3.99 3.76 -1.26 -4.88 115.29 114.32 2rq9 s HIS 119 Ca 0.34 -0.41 -0.28 0.00 -0.15 0.00 0.00 55.06 54.57 2rq9 s HIS 119 Cb -0.03 0.69 -0.01 0.00 1.11 0.00 0.00 32.58 34.34 2rq9 s HIS 119 CO 0.20 -0.93 0.93 0.71 -0.85 0.00 0.00 174.74 174.80 2rq9 s TYR 120 N -2.47 3.46 0.00 1.40 2.02 -1.26 -3.53 117.35 116.96 2rq9 s TYR 120 Ca 0.19 1.44 0.00 0.00 -0.37 0.00 0.00 57.07 58.32 2rq9 s TYR 120 Cb -0.02 -3.12 0.00 0.00 -0.40 0.00 0.00 41.96 38.42 2rq9 s TYR 120 CO 0.05 -0.25 0.00 0.41 -1.57 0.00 0.00 175.55 174.19 2rq9 n GLY 121 N 3.27 1.19 3.88 0.71 0.00 -1.26 -5.12 105.19 107.85 2rq9 n GLY 121 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 2rq9 n GLY 121 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rq9 s GLN 122 N 0.00 3.78 -0.00 1.61 -0.21 -1.23 -4.96 119.66 118.65 2rq9 s GLN 122 Ca 0.00 0.23 0.07 0.00 0.02 0.00 0.00 55.36 55.68 2rq9 s GLN 122 Cb 0.00 -2.72 0.21 0.00 1.00 0.00 0.00 33.01 31.51 2rq9 s GLN 122 CO 0.00 0.36 1.18 1.17 -2.12 0.00 0.00 175.29 175.88 2rq9 n LYS 123 N 0.02 1.57 -0.05 2.91 3.00 -1.26 -3.60 118.16 120.74 2rq9 n LYS 123 Ca -0.01 -0.87 -0.22 0.00 -0.00 0.00 0.00 58.31 57.21 2rq9 n LYS 123 Cb 0.52 -1.19 -0.13 0.00 0.00 0.00 0.00 35.03 34.23 2rq9 n LYS 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2rq9 n ALA 124 N 0.21 0.87 -0.09 3.14 0.00 -1.26 -1.13 120.51 122.24 2rq9 n ALA 124 Ca 0.08 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.94 2rq9 n ALA 124 Cb 0.21 -0.58 0.28 0.00 0.00 0.00 0.00 19.45 19.36 2rq9 n ALA 124 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2rq9 h ILE 125 N -0.45 1.18 -2.79 0.00 3.07 -1.87 -3.31 117.51 113.34 2rq9 h ILE 125 Ca -0.41 -0.55 -0.57 0.00 1.55 0.00 0.00 64.86 64.88 2rq9 h ILE 125 Cb 1.69 0.55 -0.03 0.00 -0.27 0.00 0.00 36.82 38.76 2rq9 h ILE 125 CO -0.07 0.22 1.18 -0.76 -1.05 0.00 0.00 178.15 177.67 2rq9 s LEU 126 N -9.44 3.69 0.04 0.16 1.43 -1.25 -4.18 118.68 109.13 2rq9 s LEU 126 Ca -0.09 1.39 0.07 0.00 -1.03 0.00 0.00 54.13 54.47 2rq9 s LEU 126 Cb 0.16 -3.53 -0.03 0.00 0.03 0.00 0.00 46.19 42.83 2rq9 s LEU 126 CO 0.77 -1.47 -0.21 -0.36 0.23 0.00 0.00 176.35 175.31 2rq9 s PHE 127 N 5.94 1.83 -0.14 0.29 0.40 0.50 -3.99 117.98 122.82 2rq9 s PHE 127 Ca 0.74 -0.38 -0.01 0.00 -0.60 0.00 0.00 56.93 56.69 2rq9 s PHE 127 Cb -0.23 -1.09 0.03 0.00 0.51 0.00 0.00 43.02 42.25 2rq9 s PHE 127 CO 0.32 0.09 -0.06 -1.17 0.70 0.00 0.00 175.22 175.10 2rq9 s LEU 128 N -1.17 1.40 -0.47 -0.37 2.96 -1.18 0.42 118.68 120.27 2rq9 s LEU 128 Ca 0.08 -0.50 -0.28 0.00 -0.22 0.00 0.00 54.13 53.20 2rq9 s LEU 128 Cb -0.09 -0.86 0.01 0.00 0.50 0.00 0.00 46.19 45.75 2rq9 s LEU 128 CO 0.02 -0.16 1.44 -2.16 -1.32 0.00 0.00 176.35 174.17 2rq9 s PRO 129 N 1.68 3.44 -0.03 0.98 0.04 -1.26 -1.79 135.00 138.06 2rq9 s PRO 129 Ca 0.03 0.77 -0.21 0.00 0.04 0.00 0.00 61.00 61.62 2rq9 s PRO 129 Cb -0.14 -4.08 -0.05 0.00 0.04 0.00 0.00 34.50 30.27 2rq9 s PRO 129 CO -0.08 -1.75 0.62 -0.51 0.04 0.00 0.00 177.00 175.33 2rq9 s LEU 130 N 5.83 4.38 0.14 -3.56 1.43 0.09 -4.85 118.68 122.15 2rq9 s LEU 130 Ca 0.59 1.16 -0.30 0.00 -1.03 0.00 0.00 54.13 54.55 2rq9 s LEU 130 Cb -0.13 -2.97 -0.07 0.00 0.03 0.00 0.00 46.19 43.06 2rq9 s LEU 130 CO 0.30 0.03 1.13 -2.16 0.23 0.00 0.00 176.35 175.88 2rq9 s PRO 131 N 0.15 4.54 0.00 1.29 0.04 -1.26 -1.25 135.00 138.50 2rq9 s PRO 131 Ca 0.33 1.74 0.04 0.00 0.04 0.00 0.00 61.00 63.14 2rq9 s PRO 131 Cb -0.18 -3.30 -0.00 0.00 0.04 0.00 0.00 34.50 31.06 2rq9 s PRO 131 CO 0.17 -0.04 0.40 1.55 0.04 0.00 0.00 177.00 179.12 2rq9 n VAL 132 N 2.84 0.00 -3.64 -0.36 3.14 -1.25 -4.95 118.33 114.10 2rq9 n VAL 132 Ca 0.05 -0.46 -0.03 0.00 -2.96 0.00 0.00 64.34 60.93 2rq9 n VAL 132 Cb 0.46 1.04 -0.07 0.00 -1.06 0.00 0.00 33.84 34.22 2rq9 n VAL 132 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 2rq9 s SER 133 N -0.80 -0.56 0.88 6.55 0.15 -1.26 -5.05 113.70 113.61 2rq9 s SER 133 Ca 0.03 0.90 -0.17 0.00 0.70 0.00 0.00 55.95 57.42 2rq9 s SER 133 Cb 0.03 1.22 -0.15 0.00 -1.71 0.00 0.00 66.02 65.42 2rq9 s SER 133 CO 0.09 -0.14 -0.67 -1.20 1.20 0.00 0.00 173.24 172.52 2rq9 n SER 134 N 3.75 -5.46 -3.59 5.45 7.64 -1.26 -4.67 113.62 115.47 2rq9 n SER 134 Ca -0.19 0.26 -0.16 0.00 1.01 0.00 0.00 58.87 59.79 2rq9 n SER 134 Cb 0.58 -0.75 -0.07 0.00 -1.01 0.00 0.00 64.21 62.96 2rq9 n SER 134 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2rq9 s ASP 135 N -0.97 -0.59 1.28 6.43 1.47 -1.26 -4.83 116.67 118.21 2rq9 s ASP 135 Ca 0.42 0.77 -0.19 0.00 1.18 0.00 0.00 52.55 54.73 2rq9 s ASP 135 Cb -0.23 0.71 0.30 0.00 -0.34 0.00 0.00 42.92 43.36 2rq9 s ASP 135 CO 0.78 -0.48 0.68 0.00 0.68 0.00 0.00 175.17 176.82 2rq9 n LEU 136 N 1.45 0.00 0.00 2.11 -0.00 -1.26 -4.90 117.00 114.41 2rq9 n LEU 136 Ca -0.18 -0.68 0.00 0.00 -0.00 0.00 0.00 56.01 55.15 2rq9 n LEU 136 Cb 0.56 -0.86 0.00 0.00 -0.00 0.00 0.00 43.42 43.12 2rq9 n LEU 136 CO 0.19 -2.64 0.09 -0.62 -0.00 0.00 0.00 177.39 174.41 2rq9 n GLU 137 N -4.09 0.00 0.04 1.47 1.02 -1.26 -4.91 120.64 112.92 2rq9 n GLU 137 Ca 0.11 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.43 2rq9 n GLU 137 Cb 0.47 -0.66 0.00 0.00 -0.02 0.00 0.00 31.44 31.23 2rq9 n GLU 137 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2rq9 n HIS 138 N -0.38 -2.11 -3.55 -0.32 8.25 -1.26 -5.16 115.22 110.69 2rq9 n HIS 138 Ca 0.00 0.24 -0.12 0.00 -0.26 0.00 0.00 57.72 57.58 2rq9 n HIS 138 Cb 0.00 0.96 -0.05 0.00 1.12 0.00 0.00 29.99 32.03 2rq9 n HIS 138 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2rq9 s HIS 139 N -1.18 -0.42 1.00 4.41 -3.43 -1.26 -5.10 115.29 109.30 2rq9 s HIS 139 Ca 0.00 0.64 -0.11 0.00 -0.80 0.00 0.00 55.06 54.79 2rq9 s HIS 139 Cb 0.00 0.46 0.19 0.00 -1.43 0.00 0.00 32.58 31.80 2rq9 s HIS 139 CO 0.00 -0.43 1.10 -1.58 -2.00 0.00 0.00 174.74 171.83 2rq9 s HIS 140 N -1.53 1.54 0.43 0.38 2.46 -1.26 -5.05 115.29 112.26 2rq9 s HIS 140 Ca -0.02 1.58 0.03 0.00 0.47 0.00 0.00 55.06 57.12 2rq9 s HIS 140 Cb -0.00 -3.25 -0.03 0.00 -0.13 0.00 0.00 32.58 29.16 2rq9 s HIS 140 CO 0.01 -3.17 0.07 -3.38 -2.47 0.00 0.00 174.74 165.81 2rq9 s HIS 141 N -2.59 1.89 0.27 3.88 -3.43 -1.26 -5.17 115.29 108.87 2rq9 s HIS 141 Ca 0.67 -1.09 -0.09 0.00 -0.80 0.00 0.00 55.06 53.74 2rq9 s HIS 141 Cb -0.23 -1.36 -0.00 0.00 -1.43 0.00 0.00 32.58 29.55 2rq9 s HIS 141 CO 0.60 -0.04 0.45 -3.38 -2.00 0.00 0.00 174.74 170.38 2rq9 s HIS 142 N -3.08 0.59 -0.54 0.38 -3.43 -1.26 -5.33 115.29 102.62 2rq9 s HIS 142 Ca 0.20 -0.92 0.00 0.00 -0.80 0.00 0.00 55.06 53.54 2rq9 s HIS 142 Cb 0.04 0.08 0.00 0.00 -1.43 0.00 0.00 32.58 31.26 2rq9 s HIS 142 CO 0.11 -1.01 0.14 1.58 -2.00 0.00 0.00 174.74 173.56