#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qy9 s GLN 4 N 0.00 1.59 -0.05 0.54 -0.21 0.16 -2.62 119.66 119.07 1qy9 s GLN 4 Ca 0.00 -1.76 0.03 0.00 0.02 0.00 0.00 55.36 53.65 1qy9 s GLN 4 Cb 0.00 -1.43 0.00 0.00 1.00 0.00 0.00 33.01 32.58 1qy9 s GLN 4 CO 0.00 0.18 -0.14 0.54 -2.12 0.00 0.00 175.29 173.75 1qy9 s VAL 5 N -2.78 1.19 -0.03 1.09 0.11 0.22 -2.60 120.40 117.60 1qy9 s VAL 5 Ca 0.28 -0.56 0.06 0.00 -2.93 0.00 0.00 61.98 58.83 1qy9 s VAL 5 Cb -0.00 -1.05 -0.02 0.00 -1.53 0.00 0.00 36.38 33.77 1qy9 s VAL 5 CO 0.12 0.36 -0.19 -0.31 -3.33 0.00 0.00 175.10 171.75 1qy9 s TYR 6 N 0.30 2.55 -0.29 1.54 1.51 0.16 -1.42 117.35 121.70 1qy9 s TYR 6 Ca -0.08 -0.27 -0.07 0.00 -1.01 0.00 0.00 57.07 55.64 1qy9 s TYR 6 Cb -0.12 -1.57 0.00 0.00 -0.11 0.00 0.00 41.96 40.16 1qy9 s TYR 6 CO 0.02 0.10 0.07 -1.58 -1.11 0.00 0.00 175.55 173.06 1qy9 s HIS 7 N -0.70 3.13 -0.05 2.71 2.46 -0.39 -1.82 115.29 120.64 1qy9 s HIS 7 Ca 0.11 -0.93 0.05 0.00 0.47 0.00 0.00 55.06 54.76 1qy9 s HIS 7 Cb -0.10 -2.25 -0.00 0.00 -0.13 0.00 0.00 32.58 30.10 1qy9 s HIS 7 CO 0.00 -0.55 -0.20 0.08 -2.47 0.00 0.00 174.74 171.60 1qy9 s VAL 8 N 1.51 1.65 -0.30 0.89 1.01 -0.61 -0.91 120.40 123.64 1qy9 s VAL 8 Ca 0.03 -0.83 -0.14 0.00 0.00 0.00 0.00 61.98 61.04 1qy9 s VAL 8 Cb -0.17 -1.42 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 1qy9 s VAL 8 CO 0.02 0.47 0.33 -1.81 0.00 0.00 0.00 175.10 174.11 1qy9 s ASP 9 N 0.05 6.18 0.25 3.32 1.01 -0.34 -0.64 116.67 126.49 1qy9 s ASP 9 Ca -0.06 0.04 -0.03 0.00 0.71 0.00 0.00 52.55 53.22 1qy9 s ASP 9 Cb -0.13 -2.19 -0.05 0.00 1.01 0.00 0.00 42.92 41.57 1qy9 s ASP 9 CO 0.03 -0.21 0.48 0.00 0.21 0.00 0.00 175.17 175.68 1qy9 s ALA 10 N 1.99 3.72 -1.26 5.23 0.00 -0.13 -1.15 121.76 130.15 1qy9 s ALA 10 Ca 0.12 -0.70 -0.02 0.00 0.00 0.00 0.00 51.96 51.36 1qy9 s ALA 10 Cb -0.16 -2.15 0.00 0.00 0.00 0.00 0.00 23.12 20.81 1qy9 s ALA 10 CO 0.11 0.32 0.29 1.19 0.00 0.00 0.00 175.76 177.66 1qy9 n PHE 11 N -0.85 -1.22 -3.48 0.00 3.72 0.10 -1.25 117.46 114.49 1qy9 n PHE 11 Ca -0.03 0.25 -0.10 0.00 -0.05 0.00 0.00 57.45 57.52 1qy9 n PHE 11 Cb 0.54 -3.53 -0.02 0.00 -0.94 0.00 0.00 39.48 35.52 1qy9 n PHE 11 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 1qy9 s THR 12 N -2.94 0.00 -1.04 4.37 -1.32 -1.15 -4.35 115.64 109.22 1qy9 s THR 12 Ca 0.14 0.00 0.15 0.00 -1.21 0.00 0.00 61.69 60.78 1qy9 s THR 12 Cb -0.06 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.84 1qy9 s THR 12 CO 0.18 0.00 0.73 -1.20 -2.21 0.00 0.00 174.62 172.12 1qy9 n SER 13 N -0.27 1.11 -4.60 8.08 7.64 -1.26 -2.61 113.62 121.70 1qy9 n SER 13 Ca -0.12 -1.06 -0.39 0.00 1.01 0.00 0.00 58.87 58.32 1qy9 n SER 13 Cb 0.63 0.76 -0.09 0.00 -1.01 0.00 0.00 64.21 64.50 1qy9 n SER 13 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1qy9 s GLN 14 N -2.17 4.00 0.34 1.43 -0.21 -1.26 -4.86 119.66 116.93 1qy9 s GLN 14 Ca 0.09 0.02 -0.27 0.00 0.02 0.00 0.00 55.36 55.23 1qy9 s GLN 14 Cb 0.12 -3.66 -0.13 0.00 1.00 0.00 0.00 33.01 30.34 1qy9 s GLN 14 CO 0.52 -0.29 1.01 -2.30 -2.12 0.00 0.00 175.29 172.10 1qy9 n PRO 15 N 5.34 1.38 -0.99 2.91 -0.02 -1.26 -1.95 135.00 140.41 1qy9 n PRO 15 Ca -0.08 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1qy9 n PRO 15 Cb 0.51 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 1qy9 n PRO 15 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1qy9 n PHE 16 N -0.06 0.00 -3.82 6.00 3.72 -1.26 -5.00 117.46 117.04 1qy9 n PHE 16 Ca 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.49 1qy9 n PHE 16 Cb 0.35 -0.53 0.00 0.00 -0.94 0.00 0.00 39.48 38.36 1qy9 n PHE 16 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1qy9 n ARG 17 N -1.92 2.12 0.00 -1.08 5.12 -0.82 -4.77 116.66 115.30 1qy9 n ARG 17 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1qy9 n ARG 17 Cb 0.12 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.42 1qy9 n ARG 17 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1qy9 n GLY 18 N 5.00 0.62 3.13 -0.13 0.00 -0.33 -4.61 105.19 108.88 1qy9 n GLY 18 Ca 0.00 -0.80 -0.33 0.00 0.00 0.00 0.00 46.02 44.89 1qy9 n GLY 18 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1qy9 s ASN 19 N -4.00 3.86 0.35 1.61 3.84 -0.38 -4.74 114.94 115.47 1qy9 s ASN 19 Ca 0.00 -0.93 -0.26 0.00 0.21 0.00 0.00 52.86 51.89 1qy9 s ASN 19 Cb 0.00 -1.55 -0.10 0.00 -0.55 0.00 0.00 41.25 39.05 1qy9 s ASN 19 CO 0.00 -0.09 0.99 -0.94 -2.79 0.00 0.00 177.10 174.27 1qy9 s SER 20 N 1.25 7.14 0.03 -4.21 1.04 -1.26 -0.96 113.70 116.72 1qy9 s SER 20 Ca -0.00 1.93 -0.08 0.00 0.48 0.00 0.00 55.95 58.28 1qy9 s SER 20 Cb -0.16 -2.58 -0.00 0.00 0.10 0.00 0.00 66.02 63.37 1qy9 s SER 20 CO -0.08 -0.22 0.15 0.00 0.98 0.00 0.00 173.24 174.07 1qy9 s ALA 21 N -1.61 -0.26 0.11 5.32 0.00 0.18 -4.40 121.76 121.10 1qy9 s ALA 21 Ca 0.52 -0.34 -0.07 0.00 0.00 0.00 0.00 51.96 52.08 1qy9 s ALA 21 Cb -0.20 0.23 -0.06 0.00 0.00 0.00 0.00 23.12 23.09 1qy9 s ALA 21 CO 0.26 -0.31 0.37 0.20 0.00 0.00 0.00 175.76 176.28 1qy9 s GLY 22 N -1.95 2.27 -0.07 0.00 0.00 -0.94 -1.58 107.32 105.05 1qy9 s GLY 22 Ca -0.07 -0.50 0.01 0.00 0.00 0.00 0.00 44.72 44.16 1qy9 s GLY 22 CO -0.03 -0.36 -0.08 0.14 0.00 0.00 0.00 173.10 172.77 1qy9 s VAL 23 N -1.54 0.88 -0.05 1.40 1.01 -0.76 -0.41 120.40 120.94 1qy9 s VAL 23 Ca 0.37 -0.29 0.05 0.00 0.00 0.00 0.00 61.98 62.12 1qy9 s VAL 23 Cb -0.13 -0.87 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 1qy9 s VAL 23 CO 0.21 0.32 -0.21 -0.69 0.00 0.00 0.00 175.10 174.73 1qy9 s VAL 24 N 1.10 1.73 0.19 2.92 1.01 0.21 -0.66 120.40 126.91 1qy9 s VAL 24 Ca -0.07 -0.89 -0.22 0.00 0.00 0.00 0.00 61.98 60.81 1qy9 s VAL 24 Cb -0.14 -1.47 0.05 0.00 0.00 0.00 0.00 36.38 34.82 1qy9 s VAL 24 CO -0.01 0.49 0.61 0.72 0.00 0.00 0.00 175.10 176.91 1qy9 s PHE 25 N -0.09 -0.39 0.48 5.22 -0.12 -1.07 -1.42 117.98 120.60 1qy9 s PHE 25 Ca -0.03 0.09 -0.22 0.00 -0.05 0.00 0.00 56.93 56.72 1qy9 s PHE 25 Cb -0.12 0.57 -0.07 0.00 -0.63 0.00 0.00 43.02 42.77 1qy9 s PHE 25 CO 0.03 -0.95 1.19 -2.14 -0.05 0.00 0.00 175.22 173.29 1qy9 s PRO 26 N -3.81 3.60 -0.03 1.99 0.02 -1.26 0.37 135.00 135.88 1qy9 s PRO 26 Ca 0.05 1.83 0.15 0.00 0.02 0.00 0.00 61.00 63.05 1qy9 s PRO 26 Cb -0.02 -2.33 0.47 0.00 0.02 0.00 0.00 34.50 32.64 1qy9 s PRO 26 CO -0.07 -0.69 1.40 0.00 -0.33 0.00 0.00 177.00 177.31 1qy9 n ALA 27 N -0.68 2.42 0.20 -1.55 0.00 -0.93 -4.71 120.51 115.27 1qy9 n ALA 27 Ca 0.08 -1.36 0.05 0.00 0.00 0.00 0.00 53.44 52.21 1qy9 n ALA 27 Cb 0.48 -0.67 0.48 0.00 0.00 0.00 0.00 19.45 19.74 1qy9 n ALA 27 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1qy9 h ASP 28 N 2.87 0.05 -0.53 0.00 5.19 -1.98 -2.47 116.42 119.56 1qy9 h ASP 28 Ca 0.00 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 1qy9 h ASP 28 Cb 0.96 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.46 1qy9 h ASP 28 CO 0.05 0.23 0.00 0.59 -3.12 0.00 0.00 179.24 176.99 1qy9 n ASN 29 N -4.31 4.98 -4.87 6.45 5.03 -1.26 -4.93 115.26 116.35 1qy9 n ASN 29 Ca -0.02 -2.75 -0.36 0.00 0.87 0.00 0.00 54.58 52.32 1qy9 n ASN 29 Cb 0.25 -0.61 -0.06 0.00 -1.02 0.00 0.00 39.78 38.35 1qy9 n ASN 29 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1qy9 s LEU 30 N -2.40 4.40 0.71 3.41 1.43 -0.93 -5.11 118.68 120.18 1qy9 s LEU 30 Ca 0.50 0.63 -0.08 0.00 -1.03 0.00 0.00 54.13 54.15 1qy9 s LEU 30 Cb 0.36 -2.48 0.05 0.00 0.03 0.00 0.00 46.19 44.15 1qy9 s LEU 30 CO 0.18 0.31 1.05 -0.94 0.23 0.00 0.00 176.35 177.17 1qy9 s SER 31 N -1.37 4.98 0.25 2.29 1.04 -1.26 -4.98 113.70 114.66 1qy9 s SER 31 Ca 0.23 0.69 -0.03 0.00 0.48 0.00 0.00 55.95 57.31 1qy9 s SER 31 Cb -0.14 -1.38 0.41 0.00 0.10 0.00 0.00 66.02 65.01 1qy9 s SER 31 CO 0.12 -1.53 1.83 -0.08 0.98 0.00 0.00 173.24 174.56 1qy9 h GLU 32 N -0.64 0.90 -0.65 4.02 4.81 -1.99 -2.65 114.58 118.37 1qy9 h GLU 32 Ca -0.45 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 58.68 1qy9 h GLU 32 Cb 1.30 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 1qy9 h GLU 32 CO 0.62 0.60 0.24 0.00 -0.73 0.00 0.00 179.01 179.74 1qy9 h ALA 33 N 1.46 0.85 0.00 2.92 0.00 -2.05 -1.45 119.26 120.99 1qy9 h ALA 33 Ca 0.42 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1qy9 h ALA 33 Cb 0.31 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1qy9 h ALA 33 CO -0.22 0.49 0.00 1.04 0.00 0.00 0.00 179.25 180.56 1qy9 n GLN 34 N -4.39 0.33 0.00 0.00 6.02 -1.00 -1.55 117.38 116.79 1qy9 n GLN 34 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 1qy9 n GLN 34 Cb 0.19 -1.30 0.00 0.00 1.02 0.00 0.00 30.24 30.15 1qy9 n GLN 34 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1qy9 n GLN 36 N 0.73 0.00 -0.16 -1.09 -0.06 -0.55 -1.17 117.38 115.07 1qy9 n GLN 36 Ca 0.00 0.00 -0.08 0.00 -2.00 0.00 0.00 57.00 54.92 1qy9 n GLN 36 Cb 0.15 0.00 0.07 0.00 -4.06 0.00 0.00 30.24 26.40 1qy9 n GLN 36 CO 0.00 0.00 0.00 -0.07 -0.20 0.00 0.00 177.06 176.79 1qy9 h LEU 37 N 0.00 0.93 -0.16 1.69 3.38 -1.55 -0.93 115.31 118.67 1qy9 h LEU 37 Ca 0.00 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 1qy9 h LEU 37 Cb 0.00 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1qy9 h LEU 37 CO 0.00 1.01 0.01 0.40 0.09 0.00 0.00 178.44 179.95 1qy9 h ILE 38 N 0.87 1.25 -0.69 1.22 2.04 -1.42 -0.62 117.51 120.15 1qy9 h ILE 38 Ca 0.15 -0.81 0.05 0.00 1.00 0.00 0.00 64.86 65.25 1qy9 h ILE 38 Cb 0.56 1.47 -0.05 0.00 -0.74 0.00 0.00 36.82 38.06 1qy9 h ILE 38 CO 0.03 0.24 0.40 0.00 0.00 0.00 0.00 178.15 178.83 1qy9 h ALA 39 N 0.78 0.92 -0.51 1.87 0.00 -1.79 -0.06 119.26 120.46 1qy9 h ALA 39 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1qy9 h ALA 39 Cb 0.36 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1qy9 h ALA 39 CO 0.01 0.12 0.32 -0.09 0.00 0.00 0.00 179.25 179.60 1qy9 h ARG 40 N 0.76 0.61 -0.59 0.00 2.43 -1.06 -2.19 114.38 114.35 1qy9 h ARG 40 Ca 0.30 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.36 1qy9 h ARG 40 Cb 0.13 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1qy9 h ARG 40 CO -0.16 0.41 0.08 1.49 -1.51 0.00 0.00 179.97 180.27 1qy9 h GLU 41 N 0.63 0.99 -0.01 0.20 4.57 -0.33 -2.88 114.58 117.75 1qy9 h GLU 41 Ca 0.20 -0.28 -0.15 0.00 -1.18 0.00 0.00 59.36 57.96 1qy9 h GLU 41 Cb -0.01 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.46 1qy9 h GLU 41 CO -0.08 0.95 -0.69 -0.07 -1.18 0.00 0.00 179.01 177.94 1qy9 h LEU 42 N 0.89 0.07 0.00 1.64 3.38 -1.00 -3.47 115.31 116.81 1qy9 h LEU 42 Ca 0.18 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1qy9 h LEU 42 Cb 0.45 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1qy9 h LEU 42 CO 0.02 0.73 0.00 0.61 0.09 0.00 0.00 178.44 179.89 1qy9 n GLY 43 N 0.44 0.49 3.75 0.83 0.00 -0.83 -5.01 105.19 104.86 1qy9 n GLY 43 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 1qy9 n GLY 43 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1qy9 s HIS 44 N -2.30 2.35 0.34 1.61 3.76 -1.26 -4.92 115.29 114.87 1qy9 s HIS 44 Ca 0.00 1.60 0.07 0.00 -0.15 0.00 0.00 55.06 56.58 1qy9 s HIS 44 Cb 0.00 -3.18 0.74 0.00 1.11 0.00 0.00 32.58 31.25 1qy9 s HIS 44 CO 0.00 -2.05 1.88 0.66 -0.85 0.00 0.00 174.74 174.38 1qy9 h SER 45 N -0.86 0.72 -4.40 1.40 4.64 -1.93 -3.37 113.55 109.75 1qy9 h SER 45 Ca -0.45 0.03 -0.16 0.00 -0.47 0.00 0.00 61.79 60.74 1qy9 h SER 45 Cb 1.25 -0.11 -0.23 0.00 -0.31 0.00 0.00 62.40 62.99 1qy9 h SER 45 CO 0.50 0.39 -0.50 -1.61 -0.87 0.00 0.00 176.83 174.74 1qy9 s GLU 46 N -5.74 0.35 -0.10 4.77 8.01 -1.26 -4.09 118.70 120.64 1qy9 s GLU 46 Ca -0.10 -0.09 0.03 0.00 0.01 0.00 0.00 54.97 54.82 1qy9 s GLU 46 Cb 0.21 0.15 -0.01 0.00 -4.31 0.00 0.00 34.13 30.18 1qy9 s GLU 46 CO 0.79 -0.07 -0.21 0.99 0.01 0.00 0.00 175.26 176.77 1qy9 s THR 47 N -0.67 2.37 -0.12 3.63 2.01 -0.14 -2.22 115.64 120.50 1qy9 s THR 47 Ca -0.08 -0.92 -0.09 0.00 0.31 0.00 0.00 61.69 60.92 1qy9 s THR 47 Cb -0.04 -1.93 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 1qy9 s THR 47 CO 0.01 0.55 0.18 0.00 -0.69 0.00 0.00 174.62 174.67 1qy9 s ALA 48 N 0.24 3.81 -0.18 7.40 0.00 0.46 -1.67 121.76 131.82 1qy9 s ALA 48 Ca -0.14 -0.59 -0.01 0.00 0.00 0.00 0.00 51.96 51.23 1qy9 s ALA 48 Cb -0.17 -2.07 0.01 0.00 0.00 0.00 0.00 23.12 20.89 1qy9 s ALA 48 CO 0.07 0.51 -0.14 -0.06 0.00 0.00 0.00 175.76 176.14 1qy9 s PHE 49 N -0.75 2.83 -0.19 0.00 0.40 0.27 -0.62 117.98 119.91 1qy9 s PHE 49 Ca 0.15 -1.26 -0.14 0.00 -0.60 0.00 0.00 56.93 55.07 1qy9 s PHE 49 Cb -0.12 -1.96 -0.04 0.00 0.51 0.00 0.00 43.02 41.40 1qy9 s PHE 49 CO 0.04 -0.63 0.33 -0.51 0.70 0.00 0.00 175.22 175.15 1qy9 s LEU 50 N 1.20 4.18 0.11 -0.37 1.43 -0.51 -1.47 118.68 123.25 1qy9 s LEU 50 Ca 0.02 0.46 0.05 0.00 -1.03 0.00 0.00 54.13 53.63 1qy9 s LEU 50 Cb -0.14 -2.41 -0.04 0.00 0.03 0.00 0.00 46.19 43.63 1qy9 s LEU 50 CO -0.06 0.00 -0.12 -0.76 0.23 0.00 0.00 176.35 175.64 1qy9 s LEU 51 N 0.98 2.39 0.40 1.79 1.43 0.52 -2.18 118.68 124.00 1qy9 s LEU 51 Ca 0.17 -0.79 -0.27 0.00 -1.03 0.00 0.00 54.13 52.21 1qy9 s LEU 51 Cb -0.14 -0.44 -0.10 0.00 0.03 0.00 0.00 46.19 45.54 1qy9 s LEU 51 CO 0.06 -0.18 1.47 -2.28 0.23 0.00 0.00 176.35 175.64 1qy9 s HIS 52 N -2.15 2.56 -0.01 0.29 5.65 -1.26 -1.26 115.29 119.10 1qy9 s HIS 52 Ca 0.06 1.20 0.08 0.00 0.25 0.00 0.00 55.06 56.64 1qy9 s HIS 52 Cb -0.05 -3.99 -0.02 0.00 -1.18 0.00 0.00 32.58 27.34 1qy9 s HIS 52 CO 0.02 -2.96 -0.24 0.45 -0.65 0.00 0.00 174.74 171.35 1qy9 s SER 53 N -0.25 3.24 0.00 9.88 0.15 -1.26 -4.45 113.70 121.01 1qy9 s SER 53 Ca 0.55 -0.46 0.23 0.00 0.70 0.00 0.00 55.95 56.97 1qy9 s SER 53 Cb -0.46 -0.40 0.13 0.00 -1.71 0.00 0.00 66.02 63.58 1qy9 s SER 53 CO 0.61 0.31 1.19 0.47 1.20 0.00 0.00 173.24 177.02 1qy9 n ASP 54 N 2.22 2.33 -0.22 5.45 8.00 -1.26 -4.40 116.55 128.67 1qy9 n ASP 54 Ca -0.16 -1.67 0.03 0.00 0.71 0.00 0.00 54.79 53.70 1qy9 n ASP 54 Cb 0.51 0.27 0.04 0.00 -0.02 0.00 0.00 41.12 41.93 1qy9 n ASP 54 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1qy9 n ASP 55 N 0.47 0.98 -1.65 -2.24 5.75 -1.26 -5.10 116.55 113.50 1qy9 n ASP 55 Ca 0.11 -2.16 -0.00 0.00 -0.01 0.00 0.00 54.79 52.73 1qy9 n ASP 55 Cb 0.51 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 1qy9 n ASP 55 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1qy9 n SER 56 N -0.50 -0.41 0.10 -1.12 3.41 -1.26 -5.00 113.62 108.83 1qy9 n SER 56 Ca 0.05 -1.19 -0.04 0.00 -0.26 0.00 0.00 58.87 57.43 1qy9 n SER 56 Cb 0.59 0.66 0.02 0.00 -0.26 0.00 0.00 64.21 65.22 1qy9 n SER 56 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1qy9 h ASP 57 N 0.52 0.00 -4.18 4.04 3.32 -1.57 -3.42 116.42 115.13 1qy9 h ASP 57 Ca -0.07 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.00 1qy9 h ASP 57 Cb 0.31 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 39.64 1qy9 h ASP 57 CO 0.09 0.81 0.36 0.54 -1.72 0.00 0.00 179.24 179.32 1qy9 s VAL 58 N -3.14 0.00 -0.08 -1.35 0.11 -1.22 -4.63 120.40 110.09 1qy9 s VAL 58 Ca -0.00 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.04 1qy9 s VAL 58 Cb 0.11 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.93 1qy9 s VAL 58 CO 0.79 0.00 -0.02 -0.60 -3.33 0.00 0.00 175.10 171.94 1qy9 s ARG 59 N -0.64 2.92 -0.05 1.54 3.52 -0.39 -1.00 118.95 124.84 1qy9 s ARG 59 Ca -0.03 -0.45 0.03 0.00 -0.13 0.00 0.00 55.73 55.15 1qy9 s ARG 59 Cb -0.02 -2.74 0.01 0.00 -1.56 0.00 0.00 34.95 30.64 1qy9 s ARG 59 CO 0.02 0.69 -0.14 0.42 -0.81 0.00 0.00 175.30 175.49 1qy9 s ILE 60 N -0.86 1.23 -0.09 4.11 1.01 -0.61 -0.36 121.20 125.64 1qy9 s ILE 60 Ca 0.13 -0.57 -0.00 0.00 0.00 0.00 0.00 60.65 60.21 1qy9 s ILE 60 Cb -0.11 -1.09 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 1qy9 s ILE 60 CO 0.02 0.37 -0.05 -0.13 0.00 0.00 0.00 174.94 175.15 1qy9 s ARG 61 N 0.38 2.97 -0.13 2.79 0.52 -0.54 -4.51 118.95 120.43 1qy9 s ARG 61 Ca -0.10 -0.52 0.01 0.00 -0.52 0.00 0.00 55.73 54.60 1qy9 s ARG 61 Cb -0.14 -2.69 -0.01 0.00 0.52 0.00 0.00 34.95 32.64 1qy9 s ARG 61 CO 0.03 0.58 -0.17 0.71 0.02 0.00 0.00 175.30 176.47 1qy9 s TYR 62 N -0.58 2.72 -0.06 -0.53 1.51 -1.26 -0.57 117.35 118.59 1qy9 s TYR 62 Ca 0.09 -0.90 0.02 0.00 -1.01 0.00 0.00 57.07 55.27 1qy9 s TYR 62 Cb -0.12 -1.82 0.01 0.00 -0.11 0.00 0.00 41.96 39.93 1qy9 s TYR 62 CO 0.02 -0.36 -0.11 -0.06 -1.11 0.00 0.00 175.55 173.93 1qy9 s PHE 63 N 0.50 1.32 0.94 2.71 0.40 -0.67 -1.25 117.98 121.93 1qy9 s PHE 63 Ca -0.12 -0.46 -0.15 0.00 -0.60 0.00 0.00 56.93 55.61 1qy9 s PHE 63 Cb -0.16 -0.98 0.17 0.00 0.51 0.00 0.00 43.02 42.56 1qy9 s PHE 63 CO 0.05 -0.24 1.25 0.95 0.70 0.00 0.00 175.22 177.93 1qy9 s THR 64 N 0.63 1.97 0.63 0.64 -4.23 -0.02 -0.97 115.64 114.29 1qy9 s THR 64 Ca -0.13 0.00 0.33 0.00 -1.18 0.00 0.00 61.69 60.71 1qy9 s THR 64 Cb -0.15 -2.94 0.36 0.00 1.34 0.00 0.00 72.50 71.12 1qy9 s THR 64 CO 0.03 0.00 2.10 -0.65 -0.54 0.00 0.00 174.62 175.56 1qy9 h PRO 65 N -1.57 0.00 0.00 3.99 0.11 -1.75 -3.27 132.00 129.51 1qy9 h PRO 65 Ca -0.45 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 1qy9 h PRO 65 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1qy9 h PRO 65 CO 0.47 0.00 -1.28 0.25 -0.21 0.00 0.00 178.00 177.23 1qy9 n THR 66 N -3.37 0.13 -3.70 -1.15 -2.24 -1.26 -3.98 114.28 98.71 1qy9 n THR 66 Ca -0.00 -0.16 -0.14 0.00 -2.27 0.00 0.00 64.05 61.48 1qy9 n THR 66 Cb 0.30 -0.12 -0.08 0.00 -2.10 0.00 0.00 70.33 68.33 1qy9 n THR 66 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1qy9 s VAL 67 N -2.27 0.05 0.32 2.28 0.11 -1.23 -5.13 120.40 114.53 1qy9 s VAL 67 Ca -0.02 -0.40 -0.28 0.00 -2.93 0.00 0.00 61.98 58.35 1qy9 s VAL 67 Cb 0.03 -0.76 -0.09 0.00 -1.53 0.00 0.00 36.38 34.03 1qy9 s VAL 67 CO 0.21 -0.22 1.15 -0.70 -3.33 0.00 0.00 175.10 172.21 1qy9 s GLU 68 N -1.56 4.43 0.18 1.54 2.12 -1.26 -0.84 118.70 123.31 1qy9 s GLU 68 Ca -0.11 1.88 0.08 0.00 0.36 0.00 0.00 54.97 57.18 1qy9 s GLU 68 Cb -0.03 -3.02 -0.04 0.00 0.26 0.00 0.00 34.13 31.30 1qy9 s GLU 68 CO 0.04 -0.00 -0.17 0.14 -0.54 0.00 0.00 175.26 174.72 1qy9 s VAL 69 N -1.24 1.81 0.14 3.70 -7.23 -0.38 -4.91 120.40 112.29 1qy9 s VAL 69 Ca 0.49 -1.99 -0.15 0.00 -1.81 0.00 0.00 61.98 58.52 1qy9 s VAL 69 Cb -0.33 -1.90 0.02 0.00 0.56 0.00 0.00 36.38 34.74 1qy9 s VAL 69 CO 0.42 -0.38 1.70 -0.65 -0.31 0.00 0.00 175.10 175.88 1qy9 h PRO 70 N 3.07 0.67 -1.58 4.82 0.11 -1.94 -3.36 132.00 133.79 1qy9 h PRO 70 Ca -0.41 -0.12 0.14 0.00 0.11 0.00 0.00 66.00 65.72 1qy9 h PRO 70 Cb 1.21 -0.11 -0.22 0.00 0.11 0.00 0.00 31.00 31.99 1qy9 h PRO 70 CO 0.54 0.61 0.65 -1.50 -0.21 0.00 0.00 178.00 178.09 1qy9 s ILE 71 N -5.57 0.00 -0.08 4.15 2.07 -1.26 -3.51 121.20 117.00 1qy9 s ILE 71 Ca -0.13 0.00 -0.15 0.00 -1.41 0.00 0.00 60.65 58.96 1qy9 s ILE 71 Cb 0.11 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.73 1qy9 s ILE 71 CO 0.76 0.00 0.36 0.00 -1.91 0.00 0.00 174.94 174.16 1qy9 h GLY 73 N 4.68 -0.56 1.43 0.00 0.00 -1.95 -1.83 103.07 104.83 1qy9 h GLY 73 Ca -0.28 0.21 -0.10 0.00 0.00 0.00 0.00 47.33 47.16 1qy9 h GLY 73 CO 0.33 -0.20 -0.19 1.12 0.00 0.00 0.00 176.54 177.60 1qy9 h HIS 74 N -0.66 0.74 -0.19 5.60 2.07 -1.95 -1.11 115.15 119.65 1qy9 h HIS 74 Ca -0.06 -0.15 -0.09 0.00 -2.85 0.00 0.00 60.37 57.22 1qy9 h HIS 74 Cb 0.48 -0.18 -0.01 0.00 2.57 0.00 0.00 27.41 30.26 1qy9 h HIS 74 CO -0.02 0.81 -0.27 0.00 -3.07 0.00 0.00 177.93 175.38 1qy9 h ALA 75 N 1.20 1.18 -0.27 6.11 0.00 -1.91 -1.27 119.26 124.29 1qy9 h ALA 75 Ca 0.09 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 1qy9 h ALA 75 Cb 0.66 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1qy9 h ALA 75 CO 0.05 0.53 -0.17 1.15 0.00 0.00 0.00 179.25 180.81 1qy9 h THR 76 N 0.32 1.30 -0.10 0.00 2.02 -0.62 -1.06 112.91 114.77 1qy9 h THR 76 Ca 0.05 -1.28 0.00 0.00 0.77 0.00 0.00 66.41 65.95 1qy9 h THR 76 Cb 0.65 1.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.61 1qy9 h THR 76 CO 0.05 0.40 0.07 0.58 0.37 0.00 0.00 175.52 176.99 1qy9 h VAL 77 N 0.32 1.05 -0.43 3.16 2.07 -1.08 -1.74 116.25 119.60 1qy9 h VAL 77 Ca 0.06 -0.11 0.06 0.00 0.82 0.00 0.00 66.70 67.53 1qy9 h VAL 77 Cb 0.69 0.93 -0.06 0.00 -1.52 0.00 0.00 31.29 31.34 1qy9 h VAL 77 CO 0.05 0.04 0.10 0.00 0.02 0.00 0.00 177.57 177.78 1qy9 h ALA 78 N 1.01 0.48 -0.22 1.67 0.00 -1.17 -1.19 119.26 119.84 1qy9 h ALA 78 Ca 0.04 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1qy9 h ALA 78 Cb 0.01 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1qy9 h ALA 78 CO -0.01 -0.30 0.08 0.00 0.00 0.00 0.00 179.25 179.02 1qy9 h ALA 79 N 1.31 0.29 0.00 0.00 0.00 -0.94 -1.26 119.26 118.67 1qy9 h ALA 79 Ca 0.21 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1qy9 h ALA 79 Cb 0.24 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1qy9 h ALA 79 CO -0.26 -0.10 -0.35 0.45 0.00 0.00 0.00 179.25 178.99 1qy9 h HIS 80 N 0.20 0.00 0.05 0.00 3.86 -1.21 -0.42 115.15 117.63 1qy9 h HIS 80 Ca 0.07 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1qy9 h HIS 80 Cb 0.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.67 1qy9 h HIS 80 CO -0.01 0.35 -0.02 -0.92 0.86 0.00 0.00 177.93 178.19 1qy9 h TYR 81 N 0.00 -0.06 -0.42 2.45 5.03 -0.91 -0.09 116.97 122.97 1qy9 h TYR 81 Ca -0.00 -0.00 0.04 0.00 2.58 0.00 0.00 58.73 61.35 1qy9 h TYR 81 Cb 0.94 0.02 -0.04 0.00 1.55 0.00 0.00 36.73 39.20 1qy9 h TYR 81 CO 0.00 0.37 0.19 0.28 -1.32 0.00 0.00 178.16 177.68 1qy9 h VAL 82 N -0.51 0.93 -0.54 1.81 2.07 -1.12 -0.87 116.25 118.02 1qy9 h VAL 82 Ca -0.01 -0.13 -0.07 0.00 0.82 0.00 0.00 66.70 67.31 1qy9 h VAL 82 Cb 0.45 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1qy9 h VAL 82 CO 0.01 0.07 0.06 -0.09 0.02 0.00 0.00 177.57 177.64 1qy9 h ARG 83 N 0.38 0.88 -0.47 1.57 2.43 -1.01 -0.63 114.38 117.53 1qy9 h ARG 83 Ca 0.19 -0.22 -0.09 0.00 -0.81 0.00 0.00 59.98 59.05 1qy9 h ARG 83 Cb 0.13 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1qy9 h ARG 83 CO -0.16 0.84 -0.05 0.00 -1.51 0.00 0.00 179.97 179.10 1qy9 h ALA 84 N 1.23 0.64 -0.15 2.80 0.00 -0.68 -1.95 119.26 121.15 1qy9 h ALA 84 Ca 0.17 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1qy9 h ALA 84 Cb 0.41 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1qy9 h ALA 84 CO 0.01 0.49 0.04 0.87 0.00 0.00 0.00 179.25 180.66 1qy9 h LYS 85 N 0.71 0.24 -0.38 0.00 1.79 -0.71 -1.58 116.57 116.65 1qy9 h LYS 85 Ca 0.13 -0.06 -0.08 0.00 -2.18 0.00 0.00 60.65 58.46 1qy9 h LYS 85 Cb 0.58 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.18 1qy9 h LYS 85 CO 0.03 0.38 -0.10 0.28 -1.08 0.00 0.00 179.45 178.96 1qy9 h VAL 86 N 0.06 1.25 -0.02 0.50 2.07 -1.09 -3.09 116.25 115.93 1qy9 h VAL 86 Ca 0.05 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.47 1qy9 h VAL 86 Cb 0.24 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1qy9 h VAL 86 CO -0.00 0.37 -0.27 0.18 0.02 0.00 0.00 177.57 177.87 1qy9 n LEU 87 N -4.18 2.20 -3.56 2.57 4.77 -0.74 -5.00 117.00 113.07 1qy9 n LEU 87 Ca 0.01 -0.77 -0.19 0.00 -0.03 0.00 0.00 56.01 55.03 1qy9 n LEU 87 Cb 0.34 -0.01 0.06 0.00 -2.33 0.00 0.00 43.42 41.48 1qy9 n LEU 87 CO 0.42 0.39 0.04 0.61 -1.33 0.00 0.00 177.39 177.52 1qy9 n GLY 88 N 1.37 -0.34 3.84 -0.72 0.00 -0.64 -4.99 105.19 103.72 1qy9 n GLY 88 Ca 0.12 0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 1qy9 n GLY 88 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qy9 s LEU 89 N -6.55 3.15 0.00 0.99 1.43 -0.94 -5.06 118.68 111.70 1qy9 s LEU 89 Ca 0.04 1.52 0.00 0.00 -1.03 0.00 0.00 54.13 54.66 1qy9 s LEU 89 Cb -0.02 -4.46 0.00 0.00 0.03 0.00 0.00 46.19 41.74 1qy9 s LEU 89 CO 0.77 -1.23 0.00 0.61 0.23 0.00 0.00 176.35 176.73 1qy9 n GLY 90 N -2.31 3.22 3.55 -3.19 0.00 -1.26 -4.95 105.19 100.25 1qy9 n GLY 90 Ca 0.07 -1.73 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 1qy9 n GLY 90 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qy9 s ASN 91 N -0.19 6.00 0.04 1.61 0.01 -1.26 -4.54 114.94 116.61 1qy9 s ASN 91 Ca 0.00 -0.30 0.06 0.00 -0.71 0.00 0.00 52.86 51.91 1qy9 s ASN 91 Cb 0.00 -2.55 -0.02 0.00 0.41 0.00 0.00 41.25 39.08 1qy9 s ASN 91 CO 0.00 -1.93 -0.18 0.00 -1.51 0.00 0.00 177.10 173.48 1qy9 s THR 93 N -0.79 3.35 0.25 0.00 2.01 -1.26 -0.77 115.64 118.43 1qy9 s THR 93 Ca 0.05 -0.50 0.04 0.00 0.31 0.00 0.00 61.69 61.59 1qy9 s THR 93 Cb -0.08 -2.51 -0.05 0.00 0.01 0.00 0.00 72.50 69.86 1qy9 s THR 93 CO 0.01 0.43 -0.00 0.27 -0.69 0.00 0.00 174.62 174.65 1qy9 s ILE 94 N 1.36 1.14 -0.11 1.82 -4.36 -0.06 -5.00 121.20 115.99 1qy9 s ILE 94 Ca 0.04 -2.04 -0.01 0.00 -0.26 0.00 0.00 60.65 58.38 1qy9 s ILE 94 Cb -0.14 -2.43 -0.03 0.00 1.25 0.00 0.00 42.46 41.11 1qy9 s ILE 94 CO -0.03 -0.27 -0.05 0.26 0.24 0.00 0.00 174.94 175.09 1qy9 s TRP 95 N -3.35 2.99 0.21 1.37 0.52 -1.26 -0.16 118.94 119.25 1qy9 s TRP 95 Ca 0.30 -0.14 0.09 0.00 0.02 0.00 0.00 56.10 56.37 1qy9 s TRP 95 Cb 0.06 -1.83 -0.04 0.00 -1.15 0.00 0.00 33.47 30.50 1qy9 s TRP 95 CO 0.10 0.15 -0.06 1.14 0.02 0.00 0.00 176.95 178.31 1qy9 s GLN 96 N -0.24 2.16 -0.01 4.98 -2.07 -0.52 -1.46 119.66 122.50 1qy9 s GLN 96 Ca 0.04 -1.31 0.06 0.00 -1.82 0.00 0.00 55.36 52.33 1qy9 s GLN 96 Cb -0.13 -2.17 -0.03 0.00 -1.09 0.00 0.00 33.01 29.59 1qy9 s GLN 96 CO 0.02 0.41 -0.18 0.99 -1.32 0.00 0.00 175.29 175.21 1qy9 s THR 97 N -1.92 2.73 0.33 3.63 2.01 -0.17 -1.65 115.64 120.60 1qy9 s THR 97 Ca 0.27 -1.00 -0.05 0.00 0.31 0.00 0.00 61.69 61.23 1qy9 s THR 97 Cb -0.08 -2.08 0.02 0.00 0.01 0.00 0.00 72.50 70.37 1qy9 s THR 97 CO 0.17 0.49 0.52 -1.54 -0.69 0.00 0.00 174.62 173.57 1qy9 n SER 98 N 2.03 -1.48 0.21 3.53 3.41 -0.15 -1.57 113.62 119.60 1qy9 n SER 98 Ca -0.17 -2.64 0.16 0.00 -0.26 0.00 0.00 58.87 55.97 1qy9 n SER 98 Cb 0.52 2.65 0.82 0.00 -0.26 0.00 0.00 64.21 67.94 1qy9 n SER 98 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1qy9 h LEU 99 N 0.00 0.00 -0.05 1.04 3.38 -1.81 -1.53 115.31 116.34 1qy9 h LEU 99 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1qy9 h LEU 99 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1qy9 h LEU 99 CO 0.35 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.88 1qy9 n ALA 100 N -2.36 2.11 0.00 1.53 0.00 -1.23 -4.98 120.51 115.57 1qy9 n ALA 100 Ca 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1qy9 n ALA 100 Cb 0.29 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1qy9 n ALA 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qy9 n GLY 101 N 0.98 0.23 3.47 0.00 0.00 -0.58 -5.00 105.19 104.29 1qy9 n GLY 101 Ca 0.06 -1.89 -0.34 0.00 0.00 0.00 0.00 46.02 43.84 1qy9 n GLY 101 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1qy9 s LYS 102 N 0.00 3.65 0.03 1.61 2.20 -1.26 -0.98 119.74 125.00 1qy9 s LYS 102 Ca 0.00 -0.51 0.04 0.00 -0.36 0.00 0.00 55.97 55.14 1qy9 s LYS 102 Cb 0.00 -3.03 -0.02 0.00 -1.51 0.00 0.00 37.83 33.27 1qy9 s LYS 102 CO 0.00 0.10 -0.13 -1.01 -0.36 0.00 0.00 175.35 173.95 1qy9 s HIS 103 N 0.75 1.13 -0.17 4.03 3.76 -0.66 -4.98 115.29 119.16 1qy9 s HIS 103 Ca -0.00 -0.34 -0.22 0.00 -0.15 0.00 0.00 55.06 54.34 1qy9 s HIS 103 Cb -0.14 -0.67 -0.02 0.00 1.11 0.00 0.00 32.58 32.85 1qy9 s HIS 103 CO 0.02 0.02 0.70 0.50 -0.85 0.00 0.00 174.74 175.13 1qy9 s ARG 104 N -1.08 4.28 -0.07 1.40 3.52 -1.26 -1.44 118.95 124.29 1qy9 s ARG 104 Ca 0.01 0.77 0.03 0.00 -0.13 0.00 0.00 55.73 56.41 1qy9 s ARG 104 Cb -0.08 -3.55 -0.02 0.00 -1.56 0.00 0.00 34.95 29.74 1qy9 s ARG 104 CO 0.01 -0.21 -0.17 0.08 -0.81 0.00 0.00 175.30 174.21 1qy9 s VAL 105 N 1.77 2.79 -0.06 7.11 1.01 0.77 -1.59 120.40 132.20 1qy9 s VAL 105 Ca 0.33 -0.80 0.04 0.00 0.00 0.00 0.00 61.98 61.55 1qy9 s VAL 105 Cb -0.16 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.10 1qy9 s VAL 105 CO 0.12 0.57 -0.19 -0.89 0.00 0.00 0.00 175.10 174.71 1qy9 s THR 106 N -0.33 2.64 -0.14 3.92 2.01 0.06 -0.88 115.64 122.92 1qy9 s THR 106 Ca 0.03 -0.86 0.01 0.00 0.31 0.00 0.00 61.69 61.18 1qy9 s THR 106 Cb -0.13 -2.01 -0.00 0.00 0.01 0.00 0.00 72.50 70.37 1qy9 s THR 106 CO 0.02 0.57 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.72 1qy9 s ILE 107 N -0.36 2.48 -0.06 1.82 1.01 0.05 -0.72 121.20 125.42 1qy9 s ILE 107 Ca 0.03 -0.85 0.04 0.00 0.00 0.00 0.00 60.65 59.87 1qy9 s ILE 107 Cb -0.12 -2.02 -0.00 0.00 0.01 0.00 0.00 42.46 40.33 1qy9 s ILE 107 CO 0.02 0.53 -0.19 -1.61 0.00 0.00 0.00 174.94 173.70 1qy9 s GLU 108 N 0.65 2.16 -0.25 2.79 2.02 -0.53 -2.01 118.70 123.53 1qy9 s GLU 108 Ca -0.09 -0.67 -0.06 0.00 0.02 0.00 0.00 54.97 54.16 1qy9 s GLU 108 Cb -0.16 -1.78 -0.02 0.00 0.10 0.00 0.00 34.13 32.28 1qy9 s GLU 108 CO 0.02 0.21 0.04 0.21 0.02 0.00 0.00 175.26 175.75 1qy9 s LYS 109 N 0.20 3.47 -0.06 1.61 2.20 -1.26 -1.04 119.74 124.86 1qy9 s LYS 109 Ca -0.09 -0.59 0.02 0.00 -0.36 0.00 0.00 55.97 54.94 1qy9 s LYS 109 Cb -0.14 -3.23 0.02 0.00 -1.51 0.00 0.00 37.83 32.96 1qy9 s LYS 109 CO 0.04 -0.24 -0.10 -1.01 -0.36 0.00 0.00 175.35 173.69 1qy9 s HIS 110 N 1.55 1.26 -1.26 4.03 3.76 -0.57 -4.93 115.29 119.14 1qy9 s HIS 110 Ca 0.06 -0.46 -0.03 0.00 -0.15 0.00 0.00 55.06 54.48 1qy9 s HIS 110 Cb -0.15 -0.97 -0.01 0.00 1.11 0.00 0.00 32.58 32.56 1qy9 s HIS 110 CO 0.01 -0.27 0.74 0.09 -0.85 0.00 0.00 174.74 174.46 1qy9 n ASN 111 N 3.97 -2.04 -0.33 1.40 3.02 -1.26 -1.53 115.26 118.49 1qy9 n ASN 111 Ca -0.23 -0.82 -0.04 0.00 -0.03 0.00 0.00 54.58 53.47 1qy9 n ASN 111 Cb 0.51 -4.15 -0.02 0.00 -0.61 0.00 0.00 39.78 35.52 1qy9 n ASN 111 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1qy9 n ASP 112 N -3.04 -4.97 -4.50 6.41 9.92 -1.26 -4.95 116.55 114.17 1qy9 n ASP 112 Ca -0.26 0.10 -0.24 0.00 -0.53 0.00 0.00 54.79 53.86 1qy9 n ASP 112 Cb 0.67 -3.28 -0.11 0.00 -0.64 0.00 0.00 41.12 37.76 1qy9 n ASP 112 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1qy9 s ASP 113 N -1.86 3.02 0.04 -2.24 -1.08 -0.58 -5.14 116.67 108.83 1qy9 s ASP 113 Ca 0.00 -1.30 0.08 0.00 -0.52 0.00 0.00 52.55 50.81 1qy9 s ASP 113 Cb 0.00 -0.22 -0.03 0.00 -1.46 0.00 0.00 42.92 41.22 1qy9 s ASP 113 CO 0.00 -0.44 -0.22 -0.31 0.52 0.00 0.00 175.17 174.72 1qy9 s TYR 114 N -2.99 1.92 -0.11 -5.34 2.02 -1.26 -1.51 117.35 110.08 1qy9 s TYR 114 Ca 0.33 -0.38 0.02 0.00 -0.37 0.00 0.00 57.07 56.67 1qy9 s TYR 114 Cb 0.07 -1.14 -0.01 0.00 -0.40 0.00 0.00 41.96 40.47 1qy9 s TYR 114 CO 0.15 0.10 -0.17 0.50 -1.57 0.00 0.00 175.55 174.56 1qy9 s ARG 115 N -1.20 3.19 -0.14 -0.62 3.52 -0.20 -4.39 118.95 119.11 1qy9 s ARG 115 Ca 0.08 -0.75 -0.02 0.00 -0.13 0.00 0.00 55.73 54.91 1qy9 s ARG 115 Cb -0.09 -2.50 -0.02 0.00 -1.56 0.00 0.00 34.95 30.78 1qy9 s ARG 115 CO 0.02 0.24 -0.07 0.42 -0.81 0.00 0.00 175.30 175.10 1qy9 s ILE 116 N 0.24 3.57 -0.01 4.11 -1.09 -0.10 -1.45 121.20 126.48 1qy9 s ILE 116 Ca -0.11 -0.48 0.05 0.00 -2.23 0.00 0.00 60.65 57.88 1qy9 s ILE 116 Cb -0.16 -2.54 -0.03 0.00 -1.58 0.00 0.00 42.46 38.16 1qy9 s ILE 116 CO 0.06 0.51 -0.17 -0.44 -1.23 0.00 0.00 174.94 173.68 1qy9 s SER 117 N 0.25 3.83 -0.10 3.58 0.01 0.10 -1.32 113.70 120.06 1qy9 s SER 117 Ca -0.05 -0.31 0.02 0.00 1.31 0.00 0.00 55.95 56.92 1qy9 s SER 117 Cb -0.15 -0.71 0.01 0.00 0.21 0.00 0.00 66.02 65.39 1qy9 s SER 117 CO 0.04 0.31 -0.16 -0.22 0.41 0.00 0.00 173.24 173.62 1qy9 s LEU 118 N -0.96 1.78 -0.16 2.44 2.96 0.65 -0.76 118.68 124.63 1qy9 s LEU 118 Ca 0.12 -0.43 -0.22 0.00 -0.22 0.00 0.00 54.13 53.39 1qy9 s LEU 118 Cb -0.10 -1.10 -0.03 0.00 0.50 0.00 0.00 46.19 45.46 1qy9 s LEU 118 CO 0.02 0.05 0.68 -0.70 -1.32 0.00 0.00 176.35 175.08 1qy9 s GLU 119 N 0.78 4.28 0.63 1.98 2.12 -0.62 -1.00 118.70 126.86 1qy9 s GLU 119 Ca -0.11 0.74 -0.03 0.00 0.36 0.00 0.00 54.97 55.93 1qy9 s GLU 119 Cb -0.16 -3.55 0.13 0.00 0.26 0.00 0.00 34.13 30.81 1qy9 s GLU 119 CO 0.02 -0.19 0.86 1.04 -0.54 0.00 0.00 175.26 176.45 1qy9 n GLN 120 N 4.80 -0.18 -0.45 4.30 6.02 0.10 -4.44 117.38 127.53 1qy9 n GLN 120 Ca -0.00 -2.09 -0.08 0.00 -0.01 0.00 0.00 57.00 54.82 1qy9 n GLN 120 Cb 0.50 -0.65 0.06 0.00 1.02 0.00 0.00 30.24 31.17 1qy9 n GLN 120 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1qy9 n GLY 121 N -1.34 -1.61 3.72 1.08 0.00 -0.03 -4.67 105.19 102.34 1qy9 n GLY 121 Ca 0.13 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 44.12 1qy9 n GLY 121 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qy9 s THR 122 N -1.72 3.64 0.31 2.61 2.01 -1.26 -4.62 115.64 116.62 1qy9 s THR 122 Ca 0.20 1.22 -0.29 0.00 0.31 0.00 0.00 61.69 63.13 1qy9 s THR 122 Cb -0.01 -3.78 -0.11 0.00 0.01 0.00 0.00 72.50 68.62 1qy9 s THR 122 CO 0.15 0.12 1.43 -2.84 -0.69 0.00 0.00 174.62 172.78 1qy9 s PRO 123 N 0.80 4.23 0.02 4.92 0.02 -1.26 -4.38 135.00 139.36 1qy9 s PRO 123 Ca 0.60 2.38 0.01 0.00 0.02 0.00 0.00 61.00 64.01 1qy9 s PRO 123 Cb -0.33 -3.05 -0.01 0.00 0.02 0.00 0.00 34.50 31.12 1qy9 s PRO 123 CO 0.31 -0.41 -0.05 0.20 -0.33 0.00 0.00 177.00 176.73 1qy9 s GLY 124 N 0.00 0.29 -0.10 0.52 0.00 0.51 -4.98 107.32 103.55 1qy9 s GLY 124 Ca 0.55 -0.46 -0.02 0.00 0.00 0.00 0.00 44.72 44.79 1qy9 s GLY 124 CO 0.52 -0.48 0.02 -1.36 0.00 0.00 0.00 173.10 171.80 1qy9 s PHE 125 N -0.86 0.63 0.52 1.90 0.08 -1.26 -0.87 117.98 118.11 1qy9 s PHE 125 Ca -0.07 -0.28 -0.09 0.00 0.12 0.00 0.00 56.93 56.62 1qy9 s PHE 125 Cb -0.06 -0.80 -0.05 0.00 -0.57 0.00 0.00 43.02 41.54 1qy9 s PHE 125 CO -0.00 -0.39 0.88 -1.21 -0.10 0.00 0.00 175.22 174.40 1qy9 s GLU 126 N 1.99 3.63 0.22 0.44 0.41 -0.32 -5.00 118.70 120.07 1qy9 s GLU 126 Ca 0.03 0.48 -0.31 0.00 -0.41 0.00 0.00 54.97 54.77 1qy9 s GLU 126 Cb -0.14 -2.26 -0.15 0.00 -1.78 0.00 0.00 34.13 29.80 1qy9 s GLU 126 CO -0.06 -0.30 1.08 -2.30 -0.49 0.00 0.00 175.26 173.19 1qy9 n PRO 127 N -2.22 1.21 -1.61 0.39 -0.02 -1.26 -4.60 135.00 126.88 1qy9 n PRO 127 Ca 0.03 0.43 -0.41 0.00 -2.02 0.00 0.00 63.50 61.52 1qy9 n PRO 127 Cb 0.54 -1.86 0.01 0.00 -0.02 0.00 0.00 33.50 32.18 1qy9 n PRO 127 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1qy9 n PRO 128 N 1.33 1.37 -2.58 0.52 -0.02 -1.26 -4.71 135.00 129.65 1qy9 n PRO 128 Ca 0.13 0.49 -0.42 0.00 -2.02 0.00 0.00 63.50 61.68 1qy9 n PRO 128 Cb 0.28 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 1qy9 n PRO 128 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1qy9 s LEU 129 N -0.55 4.30 0.00 2.45 1.43 0.17 -5.00 118.68 121.48 1qy9 s LEU 129 Ca 0.63 1.72 0.04 0.00 -1.03 0.00 0.00 54.13 55.48 1qy9 s LEU 129 Cb -0.56 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.09 1qy9 s LEU 129 CO 0.57 -0.46 0.13 -0.62 0.23 0.00 0.00 176.35 176.19 1qy9 n GLU 130 N 4.73 0.52 0.00 1.70 1.02 -1.26 -4.42 120.64 122.93 1qy9 n GLU 130 Ca 0.09 -2.15 0.00 0.00 -0.02 0.00 0.00 57.16 55.09 1qy9 n GLU 130 Cb 0.48 1.41 0.00 0.00 -0.02 0.00 0.00 31.44 33.31 1qy9 n GLU 130 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1qy9 n GLY 131 N 0.04 3.24 0.23 0.62 0.00 -1.26 -2.28 105.19 105.77 1qy9 n GLY 131 Ca -0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 46.02 45.88 1qy9 n GLY 131 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1qy9 h GLU 132 N 0.00 0.41 -0.09 1.61 5.08 -1.98 -2.23 114.58 117.38 1qy9 h GLU 132 Ca 0.00 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1qy9 h GLU 132 Cb 0.00 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 1qy9 h GLU 132 CO 0.00 0.64 0.01 1.15 -1.00 0.00 0.00 179.01 179.81 1qy9 h THR 133 N 0.37 1.23 -0.48 1.13 2.02 -1.85 -0.15 112.91 115.18 1qy9 h THR 133 Ca 0.06 -0.71 0.03 0.00 0.77 0.00 0.00 66.41 66.55 1qy9 h THR 133 Cb 0.64 1.54 -0.04 0.00 -1.74 0.00 0.00 68.15 68.56 1qy9 h THR 133 CO 0.05 0.20 0.26 -0.09 0.37 0.00 0.00 175.52 176.31 1qy9 h ARG 134 N -0.11 0.51 -0.92 6.66 2.43 -1.37 -1.50 114.38 120.09 1qy9 h ARG 134 Ca 0.03 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1qy9 h ARG 134 Cb 0.31 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 1qy9 h ARG 134 CO 0.00 0.34 0.53 0.00 -1.51 0.00 0.00 179.97 179.33 1qy9 h ALA 135 N 1.23 1.21 -0.62 2.80 0.00 -1.29 -2.23 119.26 120.36 1qy9 h ALA 135 Ca 0.20 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1qy9 h ALA 135 Cb 0.06 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1qy9 h ALA 135 CO -0.11 0.66 0.20 0.00 0.00 0.00 0.00 179.25 179.99 1qy9 h ALA 136 N 1.31 0.81 -0.20 0.00 0.00 -0.53 -1.13 119.26 119.53 1qy9 h ALA 136 Ca 0.33 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1qy9 h ALA 136 Cb -0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1qy9 h ALA 136 CO -0.06 0.47 0.03 0.82 0.00 0.00 0.00 179.25 180.51 1qy9 h ILE 137 N 0.88 1.23 -0.59 0.00 2.04 -0.96 -0.86 117.51 119.25 1qy9 h ILE 137 Ca 0.20 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.30 1qy9 h ILE 137 Cb 0.28 1.36 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 1qy9 h ILE 137 CO -0.01 0.23 0.39 0.40 0.00 0.00 0.00 178.15 179.17 1qy9 h ILE 138 N 0.11 1.16 -0.39 -0.67 2.04 -1.34 -2.12 117.51 116.30 1qy9 h ILE 138 Ca 0.06 -0.29 -0.09 0.00 1.00 0.00 0.00 64.86 65.53 1qy9 h ILE 138 Cb 0.33 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 1qy9 h ILE 138 CO 0.01 0.15 -0.14 -1.13 0.00 0.00 0.00 178.15 177.03 1qy9 h ASN 139 N 0.80 0.70 0.47 1.72 -1.24 -1.10 -1.69 115.58 115.24 1qy9 h ASN 139 Ca 0.22 -0.22 -0.06 0.00 0.71 0.00 0.00 56.30 56.95 1qy9 h ASN 139 Cb -0.08 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 38.77 1qy9 h ASN 139 CO -0.05 0.86 -0.27 0.00 -1.29 0.00 0.00 177.43 176.69 1qy9 h ALA 140 N 1.20 1.28 -0.01 1.57 0.00 -0.74 -0.13 119.26 122.44 1qy9 h ALA 140 Ca 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1qy9 h ALA 140 Cb 0.61 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1qy9 h ALA 140 CO 0.04 0.34 -0.04 1.28 0.00 0.00 0.00 179.25 180.87 1qy9 n LEU 141 N -3.82 0.56 -3.47 0.00 4.77 -0.83 -0.95 117.00 113.25 1qy9 n LEU 141 Ca -0.01 -0.13 -0.23 0.00 -0.03 0.00 0.00 56.01 55.61 1qy9 n LEU 141 Cb 0.36 -0.07 0.07 0.00 -2.33 0.00 0.00 43.42 41.45 1qy9 n LEU 141 CO 0.35 0.10 0.22 1.41 -1.33 0.00 0.00 177.39 178.14 1qy9 n HIS 142 N -0.67 -2.75 -4.12 -1.77 8.25 -0.06 -4.67 115.22 109.43 1qy9 n HIS 142 Ca 0.19 0.95 -0.19 0.00 -0.26 0.00 0.00 57.72 58.41 1qy9 n HIS 142 Cb 0.24 -4.91 -0.02 0.00 1.12 0.00 0.00 29.99 26.42 1qy9 n HIS 142 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1qy9 n LEU 143 N -4.82 0.00 -4.35 2.41 4.77 -0.67 -5.03 117.00 109.31 1qy9 n LEU 143 Ca -0.00 -1.99 -0.18 0.00 -0.03 0.00 0.00 56.01 53.81 1qy9 n LEU 143 Cb 0.56 0.10 -0.10 0.00 -2.33 0.00 0.00 43.42 41.66 1qy9 n LEU 143 CO 0.62 -0.39 -0.23 0.42 -1.33 0.00 0.00 177.39 176.48 1qy9 s THR 144 N -1.99 0.51 0.58 -5.08 -4.23 -1.26 -4.31 115.64 99.85 1qy9 s THR 144 Ca 0.10 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.89 1qy9 s THR 144 Cb -0.01 -2.58 0.35 0.00 1.34 0.00 0.00 72.50 71.60 1qy9 s THR 144 CO 0.07 0.00 2.21 -0.33 -0.54 0.00 0.00 174.62 176.03 1qy9 h GLU 145 N 2.26 0.00 0.00 3.99 4.39 -1.97 -0.48 114.58 122.77 1qy9 h GLU 145 Ca -0.36 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.34 1qy9 h GLU 145 Cb 1.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 1qy9 h GLU 145 CO 0.58 0.00 0.00 -0.44 -1.16 0.00 0.00 179.01 177.99 1qy9 h ASP 146 N 0.00 0.00 0.10 1.42 3.32 -2.03 -3.03 116.42 116.20 1qy9 h ASP 146 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1qy9 h ASP 146 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1qy9 h ASP 146 CO -0.00 0.00 -0.49 0.47 -1.72 0.00 0.00 179.24 177.50 1qy9 n ASP 147 N -2.56 1.48 -4.83 6.45 8.00 -0.19 -4.92 116.55 119.99 1qy9 n ASP 147 Ca -0.00 -1.17 -0.38 0.00 0.71 0.00 0.00 54.79 53.95 1qy9 n ASP 147 Cb 0.16 0.44 -0.06 0.00 -0.02 0.00 0.00 41.12 41.63 1qy9 n ASP 147 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1qy9 s ILE 148 N -2.60 5.04 -0.09 0.53 -1.09 -1.15 -1.34 121.20 120.51 1qy9 s ILE 148 Ca 0.18 0.84 -0.35 0.00 -2.23 0.00 0.00 60.65 59.08 1qy9 s ILE 148 Cb 0.18 -3.71 -0.13 0.00 -1.58 0.00 0.00 42.46 37.22 1qy9 s ILE 148 CO 0.61 0.57 1.79 -0.11 -1.23 0.00 0.00 174.94 176.56 1qy9 n LEU 149 N 1.93 3.10 -4.74 2.97 7.94 -0.51 -4.66 117.00 123.02 1qy9 n LEU 149 Ca -0.14 1.02 -0.42 0.00 -1.11 0.00 0.00 56.01 55.36 1qy9 n LEU 149 Cb 0.52 -1.32 -0.01 0.00 0.53 0.00 0.00 43.42 43.14 1qy9 n LEU 149 CO 0.38 -0.21 1.16 -2.65 -1.11 0.00 0.00 177.39 174.96 1qy9 n PRO 150 N 5.75 2.58 -1.45 1.96 -0.02 -1.26 -2.98 135.00 139.59 1qy9 n PRO 150 Ca 0.22 0.91 -0.12 0.00 -2.02 0.00 0.00 63.50 62.50 1qy9 n PRO 150 Cb 0.25 -2.65 -0.04 0.00 -0.02 0.00 0.00 33.50 31.04 1qy9 n PRO 150 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qy9 n GLY 151 N 1.56 1.10 3.26 -1.23 0.00 -1.26 -5.01 105.19 103.60 1qy9 n GLY 151 Ca 0.06 -0.48 -0.25 0.00 0.00 0.00 0.00 46.02 45.35 1qy9 n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qy9 s LEU 152 N -2.71 2.20 0.44 0.99 1.43 -1.16 -5.14 118.68 114.72 1qy9 s LEU 152 Ca 0.00 -0.56 -0.16 0.00 -1.03 0.00 0.00 54.13 52.38 1qy9 s LEU 152 Cb 0.00 -0.94 -0.09 0.00 0.03 0.00 0.00 46.19 45.19 1qy9 s LEU 152 CO 0.00 0.13 0.89 -2.16 0.23 0.00 0.00 176.35 175.45 1qy9 s PRO 153 N -1.34 4.01 -0.19 1.29 0.04 -1.26 -4.91 135.00 132.63 1qy9 s PRO 153 Ca 0.07 0.86 -0.16 0.00 0.04 0.00 0.00 61.00 61.81 1qy9 s PRO 153 Cb -0.09 -2.25 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 1qy9 s PRO 153 CO 0.02 -0.09 0.42 0.42 0.04 0.00 0.00 177.00 177.81 1qy9 s ILE 154 N -2.34 5.19 0.08 0.56 1.01 -1.26 -4.64 121.20 119.80 1qy9 s ILE 154 Ca 0.58 0.75 -0.26 0.00 0.00 0.00 0.00 60.65 61.72 1qy9 s ILE 154 Cb -0.10 -3.75 0.07 0.00 0.01 0.00 0.00 42.46 38.70 1qy9 s ILE 154 CO 0.24 0.25 0.65 0.00 0.00 0.00 0.00 174.94 176.08 1qy9 s GLN 155 N 1.27 1.17 -0.07 2.79 -2.07 -1.26 -0.65 119.66 120.83 1qy9 s GLN 155 Ca 0.20 -0.23 -0.30 0.00 -1.82 0.00 0.00 55.36 53.21 1qy9 s GLN 155 Cb -0.15 0.54 -0.03 0.00 -1.09 0.00 0.00 33.01 32.29 1qy9 s GLN 155 CO 0.08 -0.47 1.14 0.08 -1.32 0.00 0.00 175.29 174.80 1qy9 s VAL 156 N -2.89 4.43 0.17 3.63 1.01 -1.26 -4.40 120.40 121.08 1qy9 s VAL 156 Ca -0.02 1.73 0.06 0.00 0.00 0.00 0.00 61.98 63.75 1qy9 s VAL 156 Cb -0.01 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.21 1qy9 s VAL 156 CO -0.06 -0.00 -0.12 0.00 0.00 0.00 0.00 175.10 174.93 1qy9 s ALA 157 N 2.15 1.67 -0.06 5.51 0.00 -0.37 -1.17 121.76 129.50 1qy9 s ALA 157 Ca 0.53 -1.56 -0.26 0.00 0.00 0.00 0.00 51.96 50.67 1qy9 s ALA 157 Cb -0.22 0.00 0.06 0.00 0.00 0.00 0.00 23.12 22.95 1qy9 s ALA 157 CO 0.21 -0.04 0.58 -0.08 0.00 0.00 0.00 175.76 176.43 1qy9 s THR 158 N -3.19 0.01 -0.09 0.00 -1.32 -0.05 -1.51 115.64 109.49 1qy9 s THR 158 Ca 0.19 -0.12 0.13 0.00 -1.21 0.00 0.00 61.69 60.68 1qy9 s THR 158 Cb 0.01 -0.89 0.25 0.00 -1.51 0.00 0.00 72.50 70.37 1qy9 s THR 158 CO 0.03 -0.07 1.12 0.35 -2.21 0.00 0.00 174.62 173.85 1qy9 n THR 159 N 1.17 1.22 0.00 5.08 -2.24 -1.26 -0.36 114.28 117.88 1qy9 n THR 159 Ca -0.19 -1.69 0.00 0.00 -2.27 0.00 0.00 64.05 59.90 1qy9 n THR 159 Cb 0.57 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 1qy9 n THR 159 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qy9 n GLY 160 N -0.77 2.51 2.73 3.38 0.00 -1.26 -0.85 105.19 110.94 1qy9 n GLY 160 Ca 0.11 -0.29 -0.19 0.00 0.00 0.00 0.00 46.02 45.65 1qy9 n GLY 160 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1qy9 s HIS 161 N 0.00 -0.24 0.50 1.61 5.65 -1.26 -5.08 115.29 116.47 1qy9 s HIS 161 Ca 0.00 0.10 -0.22 0.00 0.25 0.00 0.00 55.06 55.19 1qy9 s HIS 161 Cb 0.00 -0.42 -0.06 0.00 -1.18 0.00 0.00 32.58 30.92 1qy9 s HIS 161 CO 0.00 -0.64 1.19 -1.54 -0.65 0.00 0.00 174.74 173.10 1qy9 s SER 162 N 2.31 5.89 0.06 9.88 1.04 -1.26 -4.79 113.70 126.82 1qy9 s SER 162 Ca 0.07 2.36 0.01 0.00 0.48 0.00 0.00 55.95 58.88 1qy9 s SER 162 Cb -0.16 -2.60 -0.03 0.00 0.10 0.00 0.00 66.02 63.33 1qy9 s SER 162 CO -0.15 -1.12 -0.06 -0.54 0.98 0.00 0.00 173.24 172.35 1qy9 s LYS 163 N -2.87 0.61 0.00 4.02 -0.14 -0.57 -4.58 119.74 116.21 1qy9 s LYS 163 Ca 0.67 -0.99 0.00 0.00 -1.36 0.00 0.00 55.97 54.29 1qy9 s LYS 163 Cb -0.30 -0.13 0.00 0.00 -1.68 0.00 0.00 37.83 35.72 1qy9 s LYS 163 CO 0.35 -0.01 0.00 0.28 -0.76 0.00 0.00 175.35 175.21 1qy9 n VAL 164 N 0.80 0.00 0.00 3.17 0.31 -0.01 -1.24 118.33 121.37 1qy9 n VAL 164 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 1qy9 n VAL 164 Cb 0.58 -1.81 0.00 0.00 -0.91 0.00 0.00 33.84 31.70 1qy9 n VAL 164 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1qy9 n ILE 166 N -0.17 0.00 -2.58 2.52 5.41 -0.80 -0.74 119.36 123.01 1qy9 n ILE 166 Ca 0.00 0.00 -0.43 0.00 1.00 0.00 0.00 62.75 63.32 1qy9 n ILE 166 Cb 0.00 0.00 -0.02 0.00 -0.71 0.00 0.00 39.64 38.91 1qy9 n ILE 166 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1qy9 s PRO 167 N 0.00 4.00 0.09 0.38 0.04 -1.26 -1.87 135.00 136.38 1qy9 s PRO 167 Ca 0.00 1.07 0.01 0.00 0.04 0.00 0.00 61.00 62.12 1qy9 s PRO 167 Cb 0.00 -3.79 -0.04 0.00 0.04 0.00 0.00 34.50 30.71 1qy9 s PRO 167 CO 0.00 -1.00 0.23 -0.51 0.04 0.00 0.00 177.00 175.76 1qy9 s LEU 168 N 3.91 4.33 0.65 -3.56 1.43 0.62 -1.43 118.68 124.63 1qy9 s LEU 168 Ca 0.48 0.22 -0.18 0.00 -1.03 0.00 0.00 54.13 53.63 1qy9 s LEU 168 Cb -0.13 -2.92 -0.01 0.00 0.03 0.00 0.00 46.19 43.17 1qy9 s LEU 168 CO 0.19 0.13 1.28 -0.54 0.23 0.00 0.00 176.35 177.63 1qy9 s LYS 169 N -2.75 2.54 0.57 1.70 1.02 -0.45 -4.47 119.74 117.91 1qy9 s LYS 169 Ca 0.35 2.01 0.37 0.00 0.02 0.00 0.00 55.97 58.71 1qy9 s LYS 169 Cb -0.12 -1.85 1.82 0.00 -0.52 0.00 0.00 37.83 37.16 1qy9 s LYS 169 CO 0.28 -1.59 2.12 -1.00 -0.92 0.00 0.00 175.35 174.24 1qy9 h PRO 170 N 0.48 0.00 0.00 -1.68 0.13 -1.91 -2.44 132.00 126.58 1qy9 h PRO 170 Ca -0.51 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 1qy9 h PRO 170 Cb 1.33 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.46 1qy9 h PRO 170 CO 0.53 0.00 -0.05 0.93 -0.23 0.00 0.00 178.00 179.17 1qy9 h GLU 171 N 0.00 0.00 -6.80 0.86 3.07 -1.94 -3.45 114.58 106.32 1qy9 h GLU 171 Ca 0.00 0.00 -0.51 0.00 -0.50 0.00 0.00 59.36 58.35 1qy9 h GLU 171 Cb 0.23 0.00 0.04 0.00 -0.84 0.00 0.00 28.75 28.18 1qy9 h GLU 171 CO 0.00 0.05 0.56 0.08 -1.40 0.00 0.00 179.01 178.31 1qy9 s VAL 172 N -3.68 3.20 -1.06 3.13 1.01 -0.92 -4.93 120.40 117.15 1qy9 s VAL 172 Ca 0.01 1.15 -0.20 0.00 0.00 0.00 0.00 61.98 62.94 1qy9 s VAL 172 Cb 0.09 -3.73 0.10 0.00 0.00 0.00 0.00 36.38 32.84 1qy9 s VAL 172 CO 0.57 0.25 1.39 -0.62 0.00 0.00 0.00 175.10 176.68 1qy9 s ASP 173 N -0.46 6.67 0.33 3.32 -1.08 -1.26 -4.86 116.67 119.33 1qy9 s ASP 173 Ca 0.49 -2.00 0.02 0.00 -0.52 0.00 0.00 52.55 50.53 1qy9 s ASP 173 Cb -0.35 -2.49 0.58 0.00 -1.46 0.00 0.00 42.92 39.20 1qy9 s ASP 173 CO 0.44 -1.21 1.93 -0.29 0.52 0.00 0.00 175.17 176.56 1qy9 h ILE 174 N 6.01 1.18 0.00 4.11 2.10 -1.94 -1.49 117.51 127.48 1qy9 h ILE 174 Ca 0.24 -0.55 -0.00 0.00 1.08 0.00 0.00 64.86 65.63 1qy9 h ILE 174 Cb 0.97 0.55 -0.00 0.00 -1.09 0.00 0.00 36.82 37.26 1qy9 h ILE 174 CO 1.30 0.22 -0.02 0.44 -1.08 0.00 0.00 178.15 179.01 1qy9 h ASP 175 N 0.73 0.00 0.74 2.19 3.32 -1.99 -2.41 116.42 119.00 1qy9 h ASP 175 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1qy9 h ASP 175 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1qy9 h ASP 175 CO -0.02 0.02 -0.20 0.00 -1.72 0.00 0.00 179.24 177.32 1qy9 n ALA 176 N -2.12 2.84 -1.73 3.45 0.00 -0.56 -4.90 120.51 117.49 1qy9 n ALA 176 Ca -0.01 -0.21 -0.42 0.00 0.00 0.00 0.00 53.44 52.79 1qy9 n ALA 176 Cb 0.20 -1.32 -0.02 0.00 0.00 0.00 0.00 19.45 18.31 1qy9 n ALA 176 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1qy9 n LEU 177 N -1.45 4.17 -3.35 0.00 4.77 -0.91 -4.96 117.00 115.28 1qy9 n LEU 177 Ca 0.07 1.14 -0.24 0.00 -0.03 0.00 0.00 56.01 56.95 1qy9 n LEU 177 Cb 0.33 -1.57 -0.09 0.00 -2.33 0.00 0.00 43.42 39.76 1qy9 n LEU 177 CO 0.30 0.06 -0.26 -0.55 -1.33 0.00 0.00 177.39 175.61 1qy9 s SER 178 N 0.49 1.47 0.67 -1.43 0.15 -1.26 -5.12 113.70 108.66 1qy9 s SER 178 Ca 0.65 -2.58 -0.16 0.00 0.70 0.00 0.00 55.95 54.56 1qy9 s SER 178 Cb -0.52 -0.10 0.00 0.00 -1.71 0.00 0.00 66.02 63.70 1qy9 s SER 178 CO 0.48 -0.20 1.14 -2.84 1.20 0.00 0.00 173.24 173.02 1qy9 s PRO 179 N 0.52 2.68 -0.58 5.44 0.02 -1.26 -4.90 135.00 136.91 1qy9 s PRO 179 Ca 0.28 1.53 -0.27 0.00 0.02 0.00 0.00 61.00 62.55 1qy9 s PRO 179 Cb -0.05 -1.92 -0.01 0.00 0.02 0.00 0.00 34.50 32.54 1qy9 s PRO 179 CO -0.12 -1.37 1.73 0.34 -0.33 0.00 0.00 177.00 177.25 1qy9 s ASP 180 N -2.32 5.55 0.18 2.53 -1.08 -0.13 -4.88 116.67 116.54 1qy9 s ASP 180 Ca 0.70 0.38 0.01 0.00 -0.52 0.00 0.00 52.55 53.12 1qy9 s ASP 180 Cb -0.23 -2.53 0.07 0.00 -1.46 0.00 0.00 42.92 38.76 1qy9 s ASP 180 CO 0.41 -2.15 1.44 -0.07 0.52 0.00 0.00 175.17 175.31 1qy9 h LEU 181 N 15.29 0.35 -0.92 -1.34 3.38 -1.92 -1.99 115.31 128.16 1qy9 h LEU 181 Ca -0.27 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.43 1qy9 h LEU 181 Cb 1.14 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.75 1qy9 h LEU 181 CO 1.19 0.99 0.40 0.78 0.09 0.00 0.00 178.44 181.89 1qy9 h ASN 182 N 0.18 1.06 -0.47 -0.43 2.35 -1.99 -0.75 115.58 115.53 1qy9 h ASN 182 Ca -0.03 -0.12 -0.06 0.00 -0.55 0.00 0.00 56.30 55.54 1qy9 h ASN 182 Cb 1.35 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 39.43 1qy9 h ASN 182 CO 0.12 0.89 0.07 0.00 -1.65 0.00 0.00 177.43 176.87 1qy9 h ALA 183 N 1.27 0.63 -0.75 -0.83 0.00 -1.87 -1.99 119.26 115.72 1qy9 h ALA 183 Ca 0.28 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1qy9 h ALA 183 Cb 0.10 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1qy9 h ALA 183 CO -0.04 0.36 0.31 -0.07 0.00 0.00 0.00 179.25 179.81 1qy9 h LEU 184 N 0.65 1.03 -0.54 0.00 3.38 -1.14 -1.16 115.31 117.53 1qy9 h LEU 184 Ca 0.14 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1qy9 h LEU 184 Cb 0.40 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1qy9 h LEU 184 CO 0.01 0.92 0.36 0.74 0.09 0.00 0.00 178.44 180.56 1qy9 h THR 185 N 1.08 1.14 -0.32 0.22 2.02 -0.99 0.05 112.91 116.11 1qy9 h THR 185 Ca 0.25 -0.25 -0.10 0.00 0.77 0.00 0.00 66.41 67.08 1qy9 h THR 185 Cb 0.20 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 1qy9 h THR 185 CO -0.02 0.13 -0.23 0.00 0.37 0.00 0.00 175.52 175.77 1qy9 h ALA 186 N 1.20 0.99 -0.43 6.16 0.00 -1.14 -2.88 119.26 123.15 1qy9 h ALA 186 Ca 0.20 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1qy9 h ALA 186 Cb -0.08 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1qy9 h ALA 186 CO -0.05 0.59 0.09 0.82 0.00 0.00 0.00 179.25 180.71 1qy9 h ILE 187 N 0.55 1.24 -0.95 0.00 2.04 -0.78 -2.90 117.51 116.71 1qy9 h ILE 187 Ca 0.08 -0.84 0.12 0.00 1.00 0.00 0.00 64.86 65.21 1qy9 h ILE 187 Cb 0.70 0.96 -0.08 0.00 -0.74 0.00 0.00 36.82 37.66 1qy9 h ILE 187 CO 0.05 0.30 0.61 0.28 0.00 0.00 0.00 178.15 179.38 1qy9 h SER 188 N 0.57 0.84 -0.12 1.72 0.02 -0.79 -0.82 113.55 114.96 1qy9 h SER 188 Ca 0.13 0.04 -0.14 0.00 -0.84 0.00 0.00 61.79 60.99 1qy9 h SER 188 Cb 0.35 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 1qy9 h SER 188 CO 0.00 0.46 -0.39 0.11 -1.14 0.00 0.00 176.83 175.87 1qy9 h LYS 189 N 0.91 0.65 -0.11 3.45 1.57 -1.39 0.64 116.57 122.28 1qy9 h LYS 189 Ca 0.46 -0.33 -0.18 0.00 -1.87 0.00 0.00 60.65 58.73 1qy9 h LYS 189 Cb 0.51 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 1qy9 h LYS 189 CO -0.23 0.93 -0.69 0.87 -0.57 0.00 0.00 179.45 179.76 1qy9 h LYS 190 N 0.53 0.49 -0.00 3.15 1.57 -1.08 -3.32 116.57 117.91 1qy9 h LYS 190 Ca 0.05 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 1qy9 h LYS 190 Cb 0.91 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1qy9 h LYS 190 CO 0.08 1.00 -0.79 0.44 -0.57 0.00 0.00 179.45 179.61 1qy9 n ILE 191 N -3.88 0.00 -3.36 1.86 -5.35 -0.42 -4.99 119.36 103.23 1qy9 n ILE 191 Ca -0.04 -0.07 -0.19 0.00 -0.27 0.00 0.00 62.75 62.18 1qy9 n ILE 191 Cb 0.69 0.98 0.07 0.00 -1.74 0.00 0.00 39.64 39.64 1qy9 n ILE 191 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1qy9 n GLY 192 N 1.47 -0.26 3.02 3.28 0.00 0.19 -5.04 105.19 107.85 1qy9 n GLY 192 Ca 0.06 0.07 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 1qy9 n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qy9 n ASN 194 N 4.44 1.43 -4.08 0.00 3.02 -1.26 -4.32 115.26 114.49 1qy9 n ASN 194 Ca -0.22 -1.20 -0.20 0.00 -0.03 0.00 0.00 54.58 52.93 1qy9 n ASN 194 Cb 0.52 0.15 -0.15 0.00 -0.61 0.00 0.00 39.78 39.70 1qy9 n ASN 194 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1qy9 s GLY 195 N -2.35 0.60 -0.09 7.41 0.00 -1.26 -4.28 107.32 107.35 1qy9 s GLY 195 Ca 0.27 -0.56 0.04 0.00 0.00 0.00 0.00 44.72 44.46 1qy9 s GLY 195 CO 0.47 -0.48 -0.20 -1.36 0.00 0.00 0.00 173.10 171.53 1qy9 s PHE 196 N -0.39 2.61 -0.57 1.90 0.40 0.06 -0.83 117.98 121.15 1qy9 s PHE 196 Ca 0.04 -0.72 0.05 0.00 -0.60 0.00 0.00 56.93 55.69 1qy9 s PHE 196 Cb -0.05 -1.70 0.17 0.00 0.51 0.00 0.00 43.02 41.95 1qy9 s PHE 196 CO -0.00 -0.22 0.43 0.34 0.70 0.00 0.00 175.22 176.47 1qy9 n PHE 197 N 3.18 1.38 -1.93 0.36 7.35 0.09 -1.00 117.46 126.90 1qy9 n PHE 197 Ca -0.18 -3.86 -0.42 0.00 -0.76 0.00 0.00 57.45 52.23 1qy9 n PHE 197 Cb 0.52 -0.23 -0.03 0.00 0.35 0.00 0.00 39.48 40.10 1qy9 n PHE 197 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 1qy9 s PRO 198 N -0.82 4.21 0.09 -7.13 0.04 -1.18 -1.90 135.00 128.31 1qy9 s PRO 198 Ca 0.29 2.39 -0.08 0.00 0.04 0.00 0.00 61.00 63.64 1qy9 s PRO 198 Cb 0.00 -3.12 -0.01 0.00 0.04 0.00 0.00 34.50 31.42 1qy9 s PRO 198 CO -0.18 -0.56 0.17 -0.59 0.04 0.00 0.00 177.00 175.89 1qy9 s PHE 199 N 0.59 0.20 0.12 0.56 -0.71 -0.78 -1.59 117.98 116.37 1qy9 s PHE 199 Ca 0.66 -0.64 -0.05 0.00 -1.04 0.00 0.00 56.93 55.86 1qy9 s PHE 199 Cb -0.44 -0.09 -0.02 0.00 -1.21 0.00 0.00 43.02 41.26 1qy9 s PHE 199 CO 0.38 -0.54 0.15 1.14 -1.34 0.00 0.00 175.22 175.01 1qy9 s GLN 200 N -3.87 0.95 -0.16 1.99 -2.07 0.04 -0.27 119.66 116.26 1qy9 s GLN 200 Ca 0.06 -1.22 -0.03 0.00 -1.82 0.00 0.00 55.36 52.35 1qy9 s GLN 200 Cb 0.05 0.31 -0.02 0.00 -1.09 0.00 0.00 33.01 32.25 1qy9 s GLN 200 CO -0.10 -0.30 -0.05 0.42 -1.32 0.00 0.00 175.29 173.94 1qy9 s ILE 201 N -3.97 3.69 0.06 3.63 1.01 -1.26 -1.18 121.20 123.18 1qy9 s ILE 201 Ca 0.16 -0.42 -0.31 0.00 0.00 0.00 0.00 60.65 60.08 1qy9 s ILE 201 Cb 0.06 -2.62 -0.08 0.00 0.01 0.00 0.00 42.46 39.83 1qy9 s ILE 201 CO -0.03 0.48 1.57 -0.13 0.00 0.00 0.00 174.94 176.83 1qy9 s ARG 202 N 0.56 4.23 -0.00 2.79 0.52 0.00 -4.64 118.95 122.40 1qy9 s ARG 202 Ca -0.04 2.22 -0.38 0.00 -0.52 0.00 0.00 55.73 57.02 1qy9 s ARG 202 Cb -0.15 -3.55 -0.16 0.00 0.52 0.00 0.00 34.95 31.61 1qy9 s ARG 202 CO 0.03 -0.67 1.44 -2.30 0.02 0.00 0.00 175.30 173.82 1qy9 n PRO 203 N 5.39 1.15 -1.00 3.54 -0.02 -1.26 -2.09 135.00 140.71 1qy9 n PRO 203 Ca 0.15 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 1qy9 n PRO 203 Cb 0.41 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1qy9 n PRO 203 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qy9 n GLY 204 N 2.94 0.39 3.10 -1.23 0.00 -1.26 -5.01 105.19 104.12 1qy9 n GLY 204 Ca 0.20 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 1qy9 n GLY 204 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qy9 s LYS 205 N -0.45 0.63 -1.34 1.61 1.02 -0.89 -5.04 119.74 115.28 1qy9 s LYS 205 Ca 0.00 -0.84 -0.11 0.00 0.02 0.00 0.00 55.97 55.04 1qy9 s LYS 205 Cb 0.00 -0.44 0.13 0.00 -0.52 0.00 0.00 37.83 37.00 1qy9 s LYS 205 CO 0.00 0.08 2.00 0.09 -0.92 0.00 0.00 175.35 176.60 1qy9 n ASN 206 N 1.33 4.80 -3.68 2.83 3.02 -1.26 -4.54 115.26 117.75 1qy9 n ASN 206 Ca -0.22 -3.03 -0.12 0.00 -0.03 0.00 0.00 54.58 51.18 1qy9 n ASN 206 Cb 0.55 -1.53 -0.09 0.00 -0.61 0.00 0.00 39.78 38.10 1qy9 n ASN 206 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1qy9 s GLU 207 N 1.18 0.59 0.12 3.52 2.12 -1.26 -1.65 118.70 123.31 1qy9 s GLU 207 Ca 0.42 0.82 0.03 0.00 0.36 0.00 0.00 54.97 56.60 1qy9 s GLU 207 Cb 0.11 0.22 -0.04 0.00 0.26 0.00 0.00 34.13 34.68 1qy9 s GLU 207 CO -0.02 -0.10 -0.08 0.95 -0.54 0.00 0.00 175.26 175.46 1qy9 s THR 208 N 0.68 0.88 -0.04 -1.70 -4.23 -0.51 -0.82 115.64 109.90 1qy9 s THR 208 Ca -0.03 -1.95 0.03 0.00 -1.18 0.00 0.00 61.69 58.56 1qy9 s THR 208 Cb -0.05 -1.71 0.00 0.00 1.34 0.00 0.00 72.50 72.08 1qy9 s THR 208 CO -0.05 -0.80 -0.14 -1.81 -0.54 0.00 0.00 174.62 171.28 1qy9 s ASP 209 N -3.03 1.80 0.15 3.99 1.01 -0.32 -0.44 116.67 119.82 1qy9 s ASP 209 Ca 0.13 -0.29 -0.06 0.00 0.71 0.00 0.00 52.55 53.04 1qy9 s ASP 209 Cb 0.04 -0.56 -0.02 0.00 1.01 0.00 0.00 42.92 43.39 1qy9 s ASP 209 CO -0.02 0.10 0.20 -0.83 0.21 0.00 0.00 175.17 174.83 1qy9 s GLY 210 N 0.20 0.66 0.00 0.21 0.00 -0.64 -0.78 107.32 106.97 1qy9 s GLY 210 Ca -0.06 -1.10 0.00 0.00 0.00 0.00 0.00 44.72 43.57 1qy9 s GLY 210 CO 0.02 -1.03 0.00 0.54 0.00 0.00 0.00 173.10 172.63 1qy9 n ARG 211 N -0.17 0.17 0.00 2.90 1.74 -0.62 -4.10 116.66 116.58 1qy9 n ARG 211 Ca -0.07 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.01 1qy9 n ARG 211 Cb 0.63 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.07 1qy9 n ARG 211 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1qy9 n PHE 213 N 0.00 0.00 -2.97 -1.55 3.72 -0.17 -3.13 117.46 113.37 1qy9 n PHE 213 Ca 0.00 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.26 1qy9 n PHE 213 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1qy9 n PHE 213 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1qy9 n SER 214 N 0.00 0.68 0.29 4.37 3.41 -0.82 -0.76 113.62 120.78 1qy9 n SER 214 Ca 0.00 -2.94 0.15 0.00 -0.26 0.00 0.00 58.87 55.81 1qy9 n SER 214 Cb 0.00 -0.34 0.86 0.00 -0.26 0.00 0.00 64.21 64.47 1qy9 n SER 214 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1qy9 h PRO 215 N 2.96 0.00 -0.06 4.33 0.13 -1.69 -2.48 132.00 135.19 1qy9 h PRO 215 Ca 0.01 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.15 1qy9 h PRO 215 Cb 1.06 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 1qy9 h PRO 215 CO 0.45 0.05 0.05 0.00 -0.23 0.00 0.00 178.00 178.32 1qy9 h ALA 216 N 1.95 1.76 -0.34 -0.56 0.00 -1.87 -1.78 119.26 118.42 1qy9 h ALA 216 Ca -0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1qy9 h ALA 216 Cb 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1qy9 h ALA 216 CO 0.01 -0.08 0.01 0.44 0.00 0.00 0.00 179.25 179.63 1qy9 n ILE 217 N -4.07 2.41 -1.10 0.00 -5.35 -0.95 -4.96 119.36 105.35 1qy9 n ILE 217 Ca -0.02 -1.87 -0.03 0.00 -0.27 0.00 0.00 62.75 60.56 1qy9 n ILE 217 Cb 0.15 -0.27 -0.01 0.00 -1.74 0.00 0.00 39.64 37.76 1qy9 n ILE 217 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1qy9 n GLY 218 N -0.39 0.64 3.12 3.28 0.00 -0.67 -5.01 105.19 106.16 1qy9 n GLY 218 Ca 0.24 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1qy9 n GLY 218 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qy9 s ILE 219 N -2.04 2.99 0.08 -0.61 -1.09 -1.14 -5.00 121.20 114.40 1qy9 s ILE 219 Ca 0.00 -1.86 -0.30 0.00 -2.23 0.00 0.00 60.65 56.26 1qy9 s ILE 219 Cb 0.00 -2.95 -0.16 0.00 -1.58 0.00 0.00 42.46 37.77 1qy9 s ILE 219 CO 0.00 -0.46 1.65 0.58 -1.23 0.00 0.00 174.94 175.48 1qy9 h VAL 220 N 6.45 0.48 -3.08 2.92 2.07 -1.90 -2.13 116.25 121.06 1qy9 h VAL 220 Ca -0.14 0.00 -0.21 0.00 0.82 0.00 0.00 66.70 67.17 1qy9 h VAL 220 Cb 1.05 0.48 -0.30 0.00 -1.52 0.00 0.00 31.29 30.99 1qy9 h VAL 220 CO 0.60 0.00 -0.51 -0.70 0.02 0.00 0.00 177.57 176.98 1qy9 s GLU 221 N -6.08 0.18 -0.09 1.57 2.12 -1.26 -2.60 118.70 112.54 1qy9 s GLU 221 Ca -0.16 0.49 -0.17 0.00 0.36 0.00 0.00 54.97 55.49 1qy9 s GLU 221 Cb 0.05 -0.14 -0.05 0.00 0.26 0.00 0.00 34.13 34.25 1qy9 s GLU 221 CO 0.63 -0.16 0.44 0.34 -0.54 0.00 0.00 175.26 175.97 1qy9 s ASP 222 N 1.24 6.69 0.09 -1.70 2.15 -1.26 -5.02 116.67 118.86 1qy9 s ASP 222 Ca -0.09 0.82 -0.23 0.00 0.43 0.00 0.00 52.55 53.48 1qy9 s ASP 222 Cb -0.11 -2.26 -0.14 0.00 -0.30 0.00 0.00 42.92 40.11 1qy9 s ASP 222 CO -0.08 0.10 1.74 -0.65 -0.17 0.00 0.00 175.17 176.11 1qy9 h PRO 223 N 6.14 -0.00 -2.66 4.34 0.11 -1.90 -3.44 132.00 134.58 1qy9 h PRO 223 Ca -0.44 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.40 1qy9 h PRO 223 Cb 1.19 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 31.95 1qy9 h PRO 223 CO 0.72 -0.00 -0.59 0.08 -0.21 0.00 0.00 178.00 178.00 1qy9 s VAL 224 N -6.19 -0.36 -0.30 3.15 1.01 -1.26 -2.45 120.40 114.00 1qy9 s VAL 224 Ca -0.13 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 1qy9 s VAL 224 Cb 0.06 -0.56 0.06 0.00 0.00 0.00 0.00 36.38 35.94 1qy9 s VAL 224 CO 0.66 -0.05 -0.01 -0.89 0.00 0.00 0.00 175.10 174.81 1qy9 s THR 225 N 2.37 2.80 0.30 3.92 2.01 -1.26 -4.71 115.64 121.06 1qy9 s THR 225 Ca 0.05 -1.53 -0.00 0.00 0.31 0.00 0.00 61.69 60.52 1qy9 s THR 225 Cb -0.14 -2.66 0.19 0.00 0.01 0.00 0.00 72.50 69.90 1qy9 s THR 225 CO -0.10 -0.15 1.88 1.23 -0.69 0.00 0.00 174.62 176.78 1qy9 h GLY 226 N 7.93 0.89 0.43 4.40 0.00 -1.98 -2.29 103.07 112.45 1qy9 h GLY 226 Ca -0.19 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.68 1qy9 h GLY 226 CO 0.53 0.43 0.00 0.70 0.00 0.00 0.00 176.54 178.20 1qy9 n ASN 227 N -4.32 0.16 -0.09 0.19 5.03 -1.26 -1.44 115.26 113.53 1qy9 n ASN 227 Ca 0.05 -1.46 -0.16 0.00 0.87 0.00 0.00 54.58 53.87 1qy9 n ASN 227 Cb 0.17 -0.01 -0.07 0.00 -1.02 0.00 0.00 39.78 38.85 1qy9 n ASN 227 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1qy9 n ALA 228 N -0.68 1.70 -0.04 5.41 0.00 -1.06 -4.53 120.51 121.31 1qy9 n ALA 228 Ca 0.14 -0.75 -0.08 0.00 0.00 0.00 0.00 53.44 52.75 1qy9 n ALA 228 Cb 0.09 0.17 0.09 0.00 0.00 0.00 0.00 19.45 19.80 1qy9 n ALA 228 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1qy9 h ASN 229 N -0.32 0.69 0.64 0.00 2.35 -1.40 -3.23 115.58 114.31 1qy9 h ASN 229 Ca -0.44 -0.29 -0.02 0.00 -0.55 0.00 0.00 56.30 55.00 1qy9 h ASN 229 Cb 1.52 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 39.68 1qy9 h ASN 229 CO -0.17 0.98 -0.48 1.23 -1.65 0.00 0.00 177.43 177.34 1qy9 h GLY 230 N 0.99 -1.24 -3.09 2.83 0.00 -1.50 -1.39 103.07 99.67 1qy9 h GLY 230 Ca 0.06 0.54 0.00 0.00 0.00 0.00 0.00 47.33 47.93 1qy9 h GLY 230 CO 0.07 -0.41 0.00 -1.05 0.00 0.00 0.00 176.54 175.16 1qy9 n PRO 231 N -5.58 0.00 0.00 4.80 -0.02 -1.22 -2.07 135.00 130.90 1qy9 n PRO 231 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 1qy9 n PRO 231 Cb 0.47 -1.35 0.00 0.00 -0.02 0.00 0.00 33.50 32.60 1qy9 n PRO 231 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qy9 n GLY 233 N 1.36 0.00 0.34 -1.23 0.00 -0.52 -0.18 105.19 104.97 1qy9 n GLY 233 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1qy9 n GLY 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qy9 h ALA 234 N 0.00 1.11 -0.92 4.61 0.00 -1.69 -2.78 119.26 119.59 1qy9 h ALA 234 Ca 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1qy9 h ALA 234 Cb 0.00 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.40 1qy9 h ALA 234 CO 0.00 0.57 0.53 2.35 0.00 0.00 0.00 179.25 182.70 1qy9 h TRP 235 N 1.20 1.23 -0.53 0.00 7.01 -0.84 -0.39 115.95 123.63 1qy9 h TRP 235 Ca 0.31 -0.02 -0.04 0.00 2.11 0.00 0.00 58.89 61.26 1qy9 h TRP 235 Cb -0.05 -0.40 -0.03 0.00 -2.10 0.00 0.00 29.16 26.59 1qy9 h TRP 235 CO -0.00 0.83 0.18 -0.07 -2.79 0.00 0.00 178.44 176.59 1qy9 h LEU 236 N 1.27 0.72 -0.02 0.65 3.38 -1.75 -0.55 115.31 119.00 1qy9 h LEU 236 Ca 0.33 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 1qy9 h LEU 236 Cb -0.02 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.55 1qy9 h LEU 236 CO -0.06 0.68 -0.12 0.58 0.09 0.00 0.00 178.44 179.61 1qy9 h VAL 237 N 0.77 1.49 -1.00 1.22 2.07 -1.31 -0.19 116.25 119.31 1qy9 h VAL 237 Ca 0.18 -1.63 0.06 0.00 0.82 0.00 0.00 66.70 66.13 1qy9 h VAL 237 Cb 0.21 2.51 -0.06 0.00 -1.52 0.00 0.00 31.29 32.42 1qy9 h VAL 237 CO -0.01 0.44 0.65 -0.74 0.02 0.00 0.00 177.57 177.93 1qy9 h HIS 238 N -0.48 1.21 -0.63 1.57 -0.00 -0.86 -1.91 115.15 114.03 1qy9 h HIS 238 Ca -0.01 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.39 1qy9 h HIS 238 Cb 0.78 -0.40 0.00 0.00 -0.00 0.00 0.00 27.41 27.79 1qy9 h HIS 238 CO 0.15 0.64 0.00 0.72 -0.00 0.00 0.00 177.93 179.44 1qy9 n HIS 239 N -4.48 1.20 -3.74 5.26 8.25 -0.23 -4.96 115.22 116.51 1qy9 n HIS 239 Ca 0.15 -0.51 -0.24 0.00 -0.26 0.00 0.00 57.72 56.86 1qy9 n HIS 239 Cb 0.16 -0.14 0.04 0.00 1.12 0.00 0.00 29.99 31.17 1qy9 n HIS 239 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1qy9 n ASN 240 N 1.21 -2.49 -0.02 0.41 3.02 -0.72 -4.91 115.26 111.76 1qy9 n ASN 240 Ca 0.23 -0.78 -0.21 0.00 -0.03 0.00 0.00 54.58 53.80 1qy9 n ASN 240 Cb 0.73 -4.12 -0.13 0.00 -0.61 0.00 0.00 39.78 35.64 1qy9 n ASN 240 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1qy9 h VAL 241 N -1.98 1.12 -3.93 2.41 2.07 -1.29 -3.47 116.25 111.18 1qy9 h VAL 241 Ca -0.60 -2.37 -0.69 0.00 0.82 0.00 0.00 66.70 63.86 1qy9 h VAL 241 Cb 1.36 2.74 -0.22 0.00 -1.52 0.00 0.00 31.29 33.65 1qy9 h VAL 241 CO 0.59 0.63 -0.75 -0.76 0.02 0.00 0.00 177.57 177.31 1qy9 s LEU 242 N -7.68 2.86 0.67 2.57 1.43 -1.24 -5.10 118.68 112.17 1qy9 s LEU 242 Ca -0.21 -0.15 -0.15 0.00 -1.03 0.00 0.00 54.13 52.59 1qy9 s LEU 242 Cb 0.04 -1.59 0.00 0.00 0.03 0.00 0.00 46.19 44.67 1qy9 s LEU 242 CO 0.73 0.35 1.13 -2.16 0.23 0.00 0.00 176.35 176.63 1qy9 s PRO 243 N -0.78 2.70 0.24 1.29 0.04 -1.26 -4.90 135.00 132.33 1qy9 s PRO 243 Ca 0.12 1.48 -0.18 0.00 0.04 0.00 0.00 61.00 62.46 1qy9 s PRO 243 Cb -0.11 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.52 1qy9 s PRO 243 CO 0.01 -1.35 0.59 -3.38 0.04 0.00 0.00 177.00 172.91 1qy9 s HIS 244 N -2.23 -0.03 0.44 0.56 -3.43 -1.26 -5.03 115.29 104.32 1qy9 s HIS 244 Ca 0.69 -0.36 0.13 0.00 -0.80 0.00 0.00 55.06 54.71 1qy9 s HIS 244 Cb -0.22 0.46 1.03 0.00 -1.43 0.00 0.00 32.58 32.42 1qy9 s HIS 244 CO 0.41 -1.06 2.03 0.38 -2.00 0.00 0.00 174.74 174.51 1qy9 h ASP 245 N 2.13 0.32 0.00 7.38 3.04 -1.98 -3.47 116.42 123.85 1qy9 h ASP 245 Ca -0.25 -0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.54 1qy9 h ASP 245 Cb 1.26 -0.07 0.00 0.00 -1.04 0.00 0.00 39.33 39.48 1qy9 h ASP 245 CO 0.31 0.21 0.00 0.61 -2.04 0.00 0.00 179.24 178.34 1qy9 n GLY 246 N -1.52 1.03 0.14 7.15 0.00 -1.26 -4.97 105.19 105.76 1qy9 n GLY 246 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 1qy9 n GLY 246 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1qy9 n ASN 247 N 0.00 1.96 -3.97 1.61 5.15 -1.26 -4.66 115.26 114.08 1qy9 n ASN 247 Ca 0.00 0.28 -0.09 0.00 -0.60 0.00 0.00 54.58 54.16 1qy9 n ASN 247 Cb 0.00 -0.77 -0.11 0.00 -0.53 0.00 0.00 39.78 38.36 1qy9 n ASN 247 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1qy9 s VAL 248 N -2.50 0.11 -0.10 3.44 1.01 -1.26 -0.22 120.40 120.87 1qy9 s VAL 248 Ca -0.38 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 60.82 1qy9 s VAL 248 Cb 0.14 -0.24 0.00 0.00 0.00 0.00 0.00 36.38 36.28 1qy9 s VAL 248 CO 0.51 -0.45 -0.21 -0.22 0.00 0.00 0.00 175.10 174.74 1qy9 s LEU 249 N -1.31 1.98 -0.18 3.92 2.96 -0.12 -4.34 118.68 121.58 1qy9 s LEU 249 Ca -0.14 -0.50 -0.02 0.00 -0.22 0.00 0.00 54.13 53.25 1qy9 s LEU 249 Cb -0.09 -1.27 -0.01 0.00 0.50 0.00 0.00 46.19 45.32 1qy9 s LEU 249 CO -0.01 0.12 -0.09 -0.13 -1.32 0.00 0.00 176.35 174.92 1qy9 s ARG 250 N 0.47 3.34 -0.06 1.98 0.52 -1.26 -1.02 118.95 122.91 1qy9 s ARG 250 Ca -0.17 -0.67 0.04 0.00 -0.52 0.00 0.00 55.73 54.41 1qy9 s ARG 250 Cb -0.17 -2.81 -0.00 0.00 0.52 0.00 0.00 34.95 32.48 1qy9 s ARG 250 CO 0.07 -0.04 -0.19 0.08 0.02 0.00 0.00 175.30 175.23 1qy9 s VAL 251 N 1.03 1.61 -0.46 3.52 1.01 -0.19 -4.82 120.40 122.10 1qy9 s VAL 251 Ca -0.00 -0.79 -0.21 0.00 0.00 0.00 0.00 61.98 60.98 1qy9 s VAL 251 Cb -0.15 -1.40 0.03 0.00 0.00 0.00 0.00 36.38 34.87 1qy9 s VAL 251 CO -0.01 0.46 0.68 -0.75 0.00 0.00 0.00 175.10 175.47 1qy9 s LYS 252 N 0.21 3.26 0.01 2.72 2.20 -0.66 -0.48 119.74 127.00 1qy9 s LYS 252 Ca -0.10 -0.44 -0.19 0.00 -0.36 0.00 0.00 55.97 54.89 1qy9 s LYS 252 Cb -0.14 -3.99 -0.06 0.00 -1.51 0.00 0.00 37.83 32.13 1qy9 s LYS 252 CO 0.04 -1.10 0.54 0.20 -0.36 0.00 0.00 175.35 174.67 1qy9 s GLY 253 N 2.22 2.58 0.04 5.54 0.00 0.68 -1.42 107.32 116.96 1qy9 s GLY 253 Ca 0.22 -0.04 0.08 0.00 0.00 0.00 0.00 44.72 44.99 1qy9 s GLY 253 CO 0.18 0.56 -0.23 0.30 0.00 0.00 0.00 173.10 173.91 1qy9 s HIS 254 N -0.53 2.42 -0.06 1.90 3.76 0.41 -1.33 115.29 121.86 1qy9 s HIS 254 Ca 0.28 -0.35 -0.26 0.00 -0.15 0.00 0.00 55.06 54.59 1qy9 s HIS 254 Cb -0.18 -1.42 0.06 0.00 1.11 0.00 0.00 32.58 32.15 1qy9 s HIS 254 CO 0.16 0.18 0.59 -1.14 -0.85 0.00 0.00 174.74 173.68 1qy9 s GLN 255 N -1.33 0.93 0.00 1.40 0.74 -1.02 -1.63 119.66 118.76 1qy9 s GLN 255 Ca 0.13 0.22 0.00 0.00 0.05 0.00 0.00 55.36 55.76 1qy9 s GLN 255 Cb -0.10 0.44 0.00 0.00 1.10 0.00 0.00 33.01 34.45 1qy9 s GLN 255 CO 0.03 -0.27 0.00 0.41 -0.55 0.00 0.00 175.29 174.91 1qy9 n GLY 256 N 1.19 0.41 0.20 2.59 0.00 -1.02 -0.64 105.19 107.92 1qy9 n GLY 256 Ca -0.19 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.80 1qy9 n GLY 256 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1qy9 h ARG 257 N 4.09 0.39 0.00 1.61 2.43 -1.88 -1.13 114.38 119.88 1qy9 h ARG 257 Ca 0.00 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 1qy9 h ARG 257 Cb 0.00 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1qy9 h ARG 257 CO 0.00 0.26 -0.12 0.00 -1.51 0.00 0.00 179.97 178.60 1qy9 h ALA 258 N 1.32 1.11 -0.00 2.80 0.00 -1.94 -1.04 119.26 121.50 1qy9 h ALA 258 Ca 0.24 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1qy9 h ALA 258 Cb 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1qy9 h ALA 258 CO -0.22 0.15 -0.08 1.28 0.00 0.00 0.00 179.25 180.37 1qy9 n LEU 259 N -3.39 0.43 -2.08 0.00 4.77 -0.75 -4.91 117.00 111.07 1qy9 n LEU 259 Ca -0.01 0.02 -0.16 0.00 -0.03 0.00 0.00 56.01 55.83 1qy9 n LEU 259 Cb 0.30 -0.17 0.02 0.00 -2.33 0.00 0.00 43.42 41.23 1qy9 n LEU 259 CO 0.30 0.08 -0.06 0.61 -1.33 0.00 0.00 177.39 176.98 1qy9 n GLY 260 N 1.25 -0.21 2.42 -0.72 0.00 -0.39 -4.94 105.19 102.59 1qy9 n GLY 260 Ca 0.15 -0.16 -0.17 0.00 0.00 0.00 0.00 46.02 45.84 1qy9 n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qy9 n ARG 261 N -2.91 1.43 -1.76 1.61 1.74 -0.50 -4.76 116.66 111.51 1qy9 n ARG 261 Ca -0.11 -3.59 -0.42 0.00 -0.77 0.00 0.00 57.85 52.96 1qy9 n ARG 261 Cb 0.60 -1.68 -0.02 0.00 -1.02 0.00 0.00 32.46 30.34 1qy9 n ARG 261 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1qy9 s ASP 262 N -2.80 6.36 0.00 0.55 1.11 -1.22 -3.07 116.67 117.61 1qy9 s ASP 262 Ca 0.38 2.95 0.00 0.00 0.18 0.00 0.00 52.55 56.06 1qy9 s ASP 262 Cb 0.37 -2.63 0.00 0.00 1.07 0.00 0.00 42.92 41.73 1qy9 s ASP 262 CO -0.06 -0.93 0.00 0.61 1.18 0.00 0.00 175.17 175.97 1qy9 n GLY 263 N 2.45 5.34 0.00 0.21 0.00 0.19 -1.19 105.19 112.20 1qy9 n GLY 263 Ca 0.09 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1qy9 n GLY 263 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1qy9 n ILE 265 N 0.00 0.00 -2.79 -0.61 3.06 -0.44 -2.44 119.36 116.15 1qy9 n ILE 265 Ca 0.00 0.00 -0.42 0.00 -2.50 0.00 0.00 62.75 59.83 1qy9 n ILE 265 Cb 0.00 0.00 -0.03 0.00 0.54 0.00 0.00 39.64 40.15 1qy9 n ILE 265 CO 0.00 0.00 0.00 -0.70 -2.50 0.00 0.00 176.55 173.35 1qy9 s GLU 266 N 0.00 4.42 -0.20 9.51 2.12 -0.63 -0.23 118.70 133.68 1qy9 s GLU 266 Ca 0.00 1.24 -0.03 0.00 0.36 0.00 0.00 54.97 56.54 1qy9 s GLU 266 Cb 0.00 -3.52 -0.01 0.00 0.26 0.00 0.00 34.13 30.85 1qy9 s GLU 266 CO 0.00 -0.22 -0.05 0.08 -0.54 0.00 0.00 175.26 174.53 1qy9 s VAL 267 N 1.72 3.46 -0.16 3.70 1.01 0.37 -0.87 120.40 129.63 1qy9 s VAL 267 Ca 0.45 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1qy9 s VAL 267 Cb -0.18 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.65 1qy9 s VAL 267 CO 0.18 0.45 -0.16 -0.89 0.00 0.00 0.00 175.10 174.68 1qy9 s THR 268 N 1.11 2.53 -0.18 3.92 2.01 0.09 -1.02 115.64 124.10 1qy9 s THR 268 Ca 0.01 -0.81 0.01 0.00 0.31 0.00 0.00 61.69 61.21 1qy9 s THR 268 Cb -0.15 -2.06 0.02 0.00 0.01 0.00 0.00 72.50 70.32 1qy9 s THR 268 CO -0.00 0.52 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.56 1qy9 s VAL 269 N 0.92 2.09 0.29 3.82 1.01 -0.19 -0.66 120.40 127.67 1qy9 s VAL 269 Ca -0.04 -0.96 -0.14 0.00 0.00 0.00 0.00 61.98 60.85 1qy9 s VAL 269 Cb -0.15 -1.89 -0.09 0.00 0.00 0.00 0.00 36.38 34.26 1qy9 s VAL 269 CO -0.02 0.52 0.70 0.42 0.00 0.00 0.00 175.10 176.71 1qy9 s THR 270 N 1.29 4.72 -0.07 3.92 -4.23 -0.25 -0.95 115.64 120.08 1qy9 s THR 270 Ca 0.05 0.88 0.03 0.00 -1.18 0.00 0.00 61.69 61.46 1qy9 s THR 270 Cb -0.13 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.08 1qy9 s THR 270 CO -0.13 -0.13 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.03 1qy9 s ILE 271 N -1.91 1.43 -0.04 2.99 1.01 0.69 -0.67 121.20 124.70 1qy9 s ILE 271 Ca 0.52 -0.68 0.02 0.00 0.00 0.00 0.00 60.65 60.51 1qy9 s ILE 271 Cb -0.11 -1.26 0.01 0.00 0.01 0.00 0.00 42.46 41.11 1qy9 s ILE 271 CO 0.18 0.42 -0.07 -0.60 0.00 0.00 0.00 174.94 174.87 1qy9 s ARG 272 N 0.38 0.95 -1.56 2.79 3.52 -0.33 -4.66 118.95 120.05 1qy9 s ARG 272 Ca -0.12 -0.22 -0.14 0.00 -0.13 0.00 0.00 55.73 55.12 1qy9 s ARG 272 Cb -0.15 -0.89 0.10 0.00 -1.56 0.00 0.00 34.95 32.44 1qy9 s ARG 272 CO 0.04 0.01 0.96 -0.25 -0.81 0.00 0.00 175.30 175.26 1qy9 n ASP 273 N 3.67 -4.59 -1.21 -2.12 8.00 -1.26 -1.55 116.55 117.48 1qy9 n ASP 273 Ca -0.22 -0.81 -0.16 0.00 0.71 0.00 0.00 54.79 54.31 1qy9 n ASP 273 Cb 0.53 -3.73 -0.07 0.00 -0.02 0.00 0.00 41.12 37.83 1qy9 n ASP 273 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1qy9 n ASN 274 N -2.81 -4.92 -4.38 -2.24 5.15 -1.26 -5.00 115.26 99.80 1qy9 n ASN 274 Ca 0.05 0.39 -0.26 0.00 -0.60 0.00 0.00 54.58 54.15 1qy9 n ASN 274 Cb 0.52 -3.82 -0.12 0.00 -0.53 0.00 0.00 39.78 35.83 1qy9 n ASN 274 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1qy9 s GLN 275 N -3.34 1.38 0.07 1.20 -1.52 -0.60 -4.61 119.66 112.24 1qy9 s GLN 275 Ca 0.00 -1.39 -0.31 0.00 -1.95 0.00 0.00 55.36 51.72 1qy9 s GLN 275 Cb 0.00 -1.71 -0.07 0.00 -0.22 0.00 0.00 33.01 31.01 1qy9 s GLN 275 CO 0.00 0.39 1.37 -1.25 -0.25 0.00 0.00 175.29 175.55 1qy9 s PRO 276 N -2.34 4.32 -0.18 2.91 0.04 -1.26 -1.18 135.00 137.30 1qy9 s PRO 276 Ca 0.15 2.01 -0.13 0.00 0.04 0.00 0.00 61.00 63.07 1qy9 s PRO 276 Cb -0.09 -3.36 -0.08 0.00 0.04 0.00 0.00 34.50 31.02 1qy9 s PRO 276 CO 0.07 -0.46 -0.30 -1.91 0.04 0.00 0.00 177.00 174.45 1qy9 n GLU 277 N 4.37 0.47 -4.18 4.56 2.13 0.15 -4.80 120.64 123.34 1qy9 n GLU 277 Ca 0.12 0.20 -0.18 0.00 0.66 0.00 0.00 57.16 57.95 1qy9 n GLU 277 Cb 0.43 -1.30 -0.15 0.00 0.27 0.00 0.00 31.44 30.69 1qy9 n GLU 277 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1qy9 s LYS 278 N -2.59 0.65 -0.12 5.31 2.20 -1.21 -4.57 119.74 119.41 1qy9 s LYS 278 Ca -0.28 -0.15 0.03 0.00 -0.36 0.00 0.00 55.97 55.21 1qy9 s LYS 278 Cb 0.08 -0.66 0.00 0.00 -1.51 0.00 0.00 37.83 35.75 1qy9 s LYS 278 CO 0.38 0.01 -0.23 0.08 -0.36 0.00 0.00 175.35 175.24 1qy9 s VAL 279 N 0.44 2.04 -0.05 4.02 1.01 -1.26 -1.09 120.40 125.52 1qy9 s VAL 279 Ca -0.05 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 60.99 1qy9 s VAL 279 Cb -0.09 -1.78 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 1qy9 s VAL 279 CO -0.00 0.55 -0.22 -0.89 0.00 0.00 0.00 175.10 174.54 1qy9 s THR 280 N 0.53 1.82 0.06 3.92 2.01 0.16 -0.72 115.64 123.42 1qy9 s THR 280 Ca -0.14 -0.95 0.07 0.00 0.31 0.00 0.00 61.69 60.98 1qy9 s THR 280 Cb -0.17 -1.54 -0.03 0.00 0.01 0.00 0.00 72.50 70.76 1qy9 s THR 280 CO 0.05 0.51 -0.16 0.27 -0.69 0.00 0.00 174.62 174.60 1qy9 s ILE 281 N -0.18 2.94 0.03 1.82 -4.36 -0.17 -0.73 121.20 120.55 1qy9 s ILE 281 Ca -0.01 -1.21 0.01 0.00 -0.26 0.00 0.00 60.65 59.18 1qy9 s ILE 281 Cb -0.12 -2.28 -0.02 0.00 1.25 0.00 0.00 42.46 41.29 1qy9 s ILE 281 CO 0.02 0.28 -0.06 -0.44 0.24 0.00 0.00 174.94 174.98 1qy9 s SER 282 N -1.63 0.63 0.17 4.36 0.01 -0.05 -0.25 113.70 116.94 1qy9 s SER 282 Ca 0.16 -0.46 -0.24 0.00 1.31 0.00 0.00 55.95 56.71 1qy9 s SER 282 Cb -0.11 0.04 0.06 0.00 0.21 0.00 0.00 66.02 66.22 1qy9 s SER 282 CO 0.07 -0.19 0.92 -0.83 0.41 0.00 0.00 173.24 173.62 1qy9 s GLY 283 N -1.33 -0.21 0.21 3.44 0.00 -0.44 -1.61 107.32 107.39 1qy9 s GLY 283 Ca -0.10 0.05 0.02 0.00 0.00 0.00 0.00 44.72 44.69 1qy9 s GLY 283 CO -0.00 -0.01 0.15 -0.37 0.00 0.00 0.00 173.10 172.87 1qy9 n THR 284 N -0.47 0.00 -3.90 0.90 5.66 -1.26 -0.92 114.28 114.29 1qy9 n THR 284 Ca -0.06 -0.82 -0.08 0.00 -3.05 0.00 0.00 64.05 60.04 1qy9 n THR 284 Cb 0.60 -0.30 -0.02 0.00 -1.55 0.00 0.00 70.33 69.06 1qy9 n THR 284 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1qy9 s ALA 285 N -2.30 -0.83 -0.05 1.79 0.00 -1.07 0.03 121.76 119.32 1qy9 s ALA 285 Ca 0.11 -0.56 -0.03 0.00 0.00 0.00 0.00 51.96 51.49 1qy9 s ALA 285 Cb -0.01 0.90 0.03 0.00 0.00 0.00 0.00 23.12 24.04 1qy9 s ALA 285 CO 0.07 -0.98 0.12 0.54 0.00 0.00 0.00 175.76 175.51 1qy9 s VAL 286 N -3.71 -0.03 -0.23 0.00 0.11 -0.30 -4.68 120.40 111.55 1qy9 s VAL 286 Ca 0.15 0.13 -0.20 0.00 -2.93 0.00 0.00 61.98 59.13 1qy9 s VAL 286 Cb -0.04 -0.19 -0.02 0.00 -1.53 0.00 0.00 36.38 34.59 1qy9 s VAL 286 CO 0.09 0.05 0.62 -0.63 -3.33 0.00 0.00 175.10 171.90 1qy9 s ILE 287 N 0.81 5.00 0.02 7.04 1.01 -1.26 -1.20 121.20 132.62 1qy9 s ILE 287 Ca -0.06 1.14 -0.17 0.00 0.00 0.00 0.00 60.65 61.56 1qy9 s ILE 287 Cb -0.08 -3.93 -0.35 0.00 0.01 0.00 0.00 42.46 38.10 1qy9 s ILE 287 CO -0.04 0.06 0.99 -0.07 0.00 0.00 0.00 174.94 175.88 1qy9 h LEU 288 N 8.66 0.81 -7.22 2.97 3.38 -1.41 -3.49 115.31 119.02 1qy9 h LEU 288 Ca -0.28 -0.92 0.18 0.00 0.09 0.00 0.00 57.88 56.94 1qy9 h LEU 288 Cb 1.13 -0.27 -0.13 0.00 0.09 0.00 0.00 40.66 41.48 1qy9 h LEU 288 CO 0.77 1.68 0.58 0.72 0.09 0.00 0.00 178.44 182.28 1qy9 s PHE 289 N -2.58 -0.21 0.11 1.13 -0.12 -1.23 -5.04 117.98 110.03 1qy9 s PHE 289 Ca -0.10 0.05 -0.13 0.00 -0.05 0.00 0.00 56.93 56.70 1qy9 s PHE 289 Cb 0.04 0.56 0.02 0.00 -0.63 0.00 0.00 43.02 43.01 1qy9 s PHE 289 CO 0.94 -0.54 0.31 -3.38 -0.05 0.00 0.00 175.22 172.49 1qy9 s HIS 290 N -2.98 -0.05 -0.16 3.49 -3.43 -1.26 -1.26 115.29 109.64 1qy9 s HIS 290 Ca 0.09 -0.30 -0.29 0.00 -0.80 0.00 0.00 55.06 53.76 1qy9 s HIS 290 Cb -0.00 0.12 0.10 0.00 -1.43 0.00 0.00 32.58 31.37 1qy9 s HIS 290 CO -0.05 -0.63 0.89 0.00 -2.00 0.00 0.00 174.74 172.96 1qy9 s ALA 291 N -3.76 -1.88 0.39 -1.38 0.00 -0.51 -5.00 121.76 109.63 1qy9 s ALA 291 Ca 0.03 1.60 -0.27 0.00 0.00 0.00 0.00 51.96 53.32 1qy9 s ALA 291 Cb 0.03 -0.66 -0.09 0.00 0.00 0.00 0.00 23.12 22.39 1qy9 s ALA 291 CO -0.11 -0.32 1.34 -1.21 0.00 0.00 0.00 175.76 175.46 1qy9 s GLU 292 N -0.78 4.06 0.24 0.00 2.02 -1.26 -0.61 118.70 122.36 1qy9 s GLU 292 Ca -0.03 2.24 -0.30 0.00 0.02 0.00 0.00 54.97 56.90 1qy9 s GLU 292 Cb -0.01 -2.85 -0.10 0.00 0.10 0.00 0.00 34.13 31.26 1qy9 s GLU 292 CO 0.03 -0.45 1.43 -1.58 0.02 0.00 0.00 175.26 174.71 1qy9 s TRP 293 N -1.21 3.05 -1.49 1.61 0.52 -1.08 -4.91 118.94 115.44 1qy9 s TRP 293 Ca 0.55 1.03 0.29 0.00 0.02 0.00 0.00 56.10 57.99 1qy9 s TRP 293 Cb -0.40 -3.80 1.27 0.00 -1.15 0.00 0.00 33.47 29.39 1qy9 s TRP 293 CO 0.52 -2.60 1.89 0.00 0.02 0.00 0.00 176.95 176.79 1qy9 n ALA 294 N 2.44 2.69 -2.51 0.98 0.00 -1.26 -4.86 120.51 118.00 1qy9 n ALA 294 Ca 0.07 -0.22 -0.25 0.00 0.00 0.00 0.00 53.44 53.04 1qy9 n ALA 294 Cb 0.40 -1.38 -0.10 0.00 0.00 0.00 0.00 19.45 18.38 1qy9 n ALA 294 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1qy9 s ILE 295 N -2.58 2.74 -0.03 0.00 -4.36 -1.26 -5.11 121.20 110.61 1qy9 s ILE 295 Ca 0.26 -2.10 -0.30 0.00 -0.26 0.00 0.00 60.65 58.26 1qy9 s ILE 295 Cb 0.20 -2.40 -0.03 0.00 1.25 0.00 0.00 42.46 41.48 1qy9 s ILE 295 CO 0.49 -0.28 0.98 -1.61 0.24 0.00 0.00 174.94 174.76 1qy9 s GLU 296 N -3.22 4.52 0.00 0.37 2.02 -1.26 -5.16 118.70 115.98 1qy9 s GLU 296 Ca 0.27 1.39 0.19 0.00 0.02 0.00 0.00 54.97 56.84 1qy9 s GLU 296 Cb -0.07 -3.48 0.15 0.00 0.10 0.00 0.00 34.13 30.83 1qy9 s GLU 296 CO 0.15 -0.11 1.10 1.28 0.02 0.00 0.00 175.26 177.70