#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qy9 s PRO 3 N 0.00 3.34 0.27 1.97 0.02 -1.26 -4.67 135.00 134.67 1qy9 s PRO 3 Ca 0.00 2.24 0.11 0.00 0.02 0.00 0.00 61.00 63.38 1qy9 s PRO 3 Cb 0.00 -2.38 -0.05 0.00 0.02 0.00 0.00 34.50 32.09 1qy9 s PRO 3 CO 0.00 -1.03 -0.15 -0.65 -0.33 0.00 0.00 177.00 174.84 1qy9 s GLN 4 N -2.76 1.84 -0.05 5.54 -0.21 0.17 -2.00 119.66 122.19 1qy9 s GLN 4 Ca 0.68 -1.64 0.03 0.00 0.02 0.00 0.00 55.36 54.44 1qy9 s GLN 4 Cb -0.40 -1.89 0.01 0.00 1.00 0.00 0.00 33.01 31.72 1qy9 s GLN 4 CO 0.49 0.35 -0.12 0.54 -2.12 0.00 0.00 175.29 174.42 1qy9 s VAL 5 N -2.38 1.11 -0.07 1.09 0.11 0.17 -2.41 120.40 118.03 1qy9 s VAL 5 Ca 0.30 -0.50 0.03 0.00 -2.93 0.00 0.00 61.98 58.87 1qy9 s VAL 5 Cb -0.06 -0.99 -0.02 0.00 -1.53 0.00 0.00 36.38 33.78 1qy9 s VAL 5 CO 0.16 0.34 -0.15 -0.31 -3.33 0.00 0.00 175.10 171.81 1qy9 s TYR 6 N 0.38 2.70 -0.28 1.54 1.51 0.51 -1.32 117.35 122.39 1qy9 s TYR 6 Ca -0.09 -0.30 -0.08 0.00 -1.01 0.00 0.00 57.07 55.60 1qy9 s TYR 6 Cb -0.13 -1.67 -0.01 0.00 -0.11 0.00 0.00 41.96 40.04 1qy9 s TYR 6 CO 0.02 0.07 0.09 -1.58 -1.11 0.00 0.00 175.55 173.05 1qy9 s HIS 7 N -0.46 3.13 -0.02 2.71 2.46 -0.54 -1.70 115.29 120.87 1qy9 s HIS 7 Ca 0.06 -0.72 0.06 0.00 0.47 0.00 0.00 55.06 54.93 1qy9 s HIS 7 Cb -0.12 -2.27 -0.01 0.00 -0.13 0.00 0.00 32.58 30.05 1qy9 s HIS 7 CO 0.02 -0.49 -0.20 0.08 -2.47 0.00 0.00 174.74 171.69 1qy9 s VAL 8 N 1.56 1.56 -0.27 0.89 1.01 -0.59 -0.82 120.40 123.74 1qy9 s VAL 8 Ca 0.04 -0.84 -0.09 0.00 0.00 0.00 0.00 61.98 61.10 1qy9 s VAL 8 Cb -0.16 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 1qy9 s VAL 8 CO 0.04 0.44 0.12 -1.81 0.00 0.00 0.00 175.10 173.88 1qy9 s ASP 9 N -0.39 5.42 0.15 3.32 1.01 -0.29 -0.69 116.67 125.20 1qy9 s ASP 9 Ca 0.06 -0.27 -0.02 0.00 0.71 0.00 0.00 52.55 53.03 1qy9 s ASP 9 Cb -0.08 -1.98 -0.05 0.00 1.01 0.00 0.00 42.92 41.82 1qy9 s ASP 9 CO -0.00 -0.09 0.35 0.00 0.21 0.00 0.00 175.17 175.64 1qy9 s ALA 10 N 1.64 3.86 -1.10 5.23 0.00 0.10 -1.11 121.76 130.37 1qy9 s ALA 10 Ca 0.06 -0.75 -0.00 0.00 0.00 0.00 0.00 51.96 51.27 1qy9 s ALA 10 Cb -0.16 -2.00 0.00 0.00 0.00 0.00 0.00 23.12 20.96 1qy9 s ALA 10 CO 0.06 0.59 0.03 1.19 0.00 0.00 0.00 175.76 177.63 1qy9 n PHE 11 N -0.24 -0.67 -3.42 0.00 3.72 0.95 -1.41 117.46 116.39 1qy9 n PHE 11 Ca -0.04 0.03 -0.12 0.00 -0.05 0.00 0.00 57.45 57.27 1qy9 n PHE 11 Cb 0.53 -2.89 -0.02 0.00 -0.94 0.00 0.00 39.48 36.16 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 -2.68 0.00 -0.52 4.37 -1.32 -1.19 -4.36 115.64 109.94 1qy9 s THR 12 Ca 0.02 -0.00 0.20 0.00 -1.21 0.00 0.00 61.69 60.69 1qy9 s THR 12 Cb -0.01 -1.00 -0.25 0.00 -1.51 0.00 0.00 72.50 69.73 1qy9 s THR 12 CO 0.02 -0.00 0.65 -1.20 -2.21 0.00 0.00 174.62 171.88 1qy9 n SER 13 N -0.36 0.70 -4.62 8.08 7.64 -1.26 -2.78 113.62 121.02 1qy9 n SER 13 Ca -0.17 -0.54 -0.39 0.00 1.01 0.00 0.00 58.87 58.78 1qy9 n SER 13 Cb 0.65 1.40 -0.08 0.00 -1.01 0.00 0.00 64.21 65.17 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 -3.08 4.06 0.41 1.43 -0.21 -1.26 -4.83 119.66 116.19 1qy9 s GLN 14 Ca 0.01 0.22 -0.25 0.00 0.02 0.00 0.00 55.36 55.36 1qy9 s GLN 14 Cb 0.14 -3.64 -0.11 0.00 1.00 0.00 0.00 33.01 30.40 1qy9 s GLN 14 CO 0.81 -0.30 1.06 -2.30 -2.12 0.00 0.00 175.29 172.45 1qy9 n PRO 15 N 5.36 1.46 -0.96 2.91 -0.02 -1.26 -2.30 135.00 140.19 1qy9 n PRO 15 Ca -0.06 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1qy9 n PRO 15 Cb 0.50 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 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 -0.39 0.00 -3.83 6.00 3.72 -1.26 -5.00 117.46 116.70 1qy9 n PHE 16 Ca 0.09 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.47 1qy9 n PHE 16 Cb 0.39 -0.58 -0.00 0.00 -0.94 0.00 0.00 39.48 38.34 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 -1.82 1.75 0.00 -1.08 5.12 -0.98 -4.75 116.66 114.91 1qy9 n ARG 17 Ca 0.00 -0.16 0.00 0.00 -1.93 0.00 0.00 57.85 55.76 1qy9 n ARG 17 Cb 0.12 0.03 0.00 0.00 -1.16 0.00 0.00 32.46 31.45 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 4.72 0.74 3.07 -0.13 0.00 -0.08 -4.64 105.19 108.87 1qy9 n GLY 18 Ca -0.01 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 44.99 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 3.74 0.37 1.61 3.84 -0.50 -4.76 114.94 115.25 1qy9 s ASN 19 Ca 0.00 -1.02 -0.23 0.00 0.21 0.00 0.00 52.86 51.83 1qy9 s ASN 19 Cb 0.00 -1.46 -0.10 0.00 -0.55 0.00 0.00 41.25 39.14 1qy9 s ASN 19 CO 0.00 -0.11 0.93 -0.94 -2.79 0.00 0.00 177.10 174.19 1qy9 s SER 20 N 1.23 7.10 0.01 -4.21 1.04 -1.26 -0.73 113.70 116.89 1qy9 s SER 20 Ca -0.02 1.72 -0.10 0.00 0.48 0.00 0.00 55.95 58.03 1qy9 s SER 20 Cb -0.17 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.42 1qy9 s SER 20 CO -0.09 -0.22 0.20 0.00 0.98 0.00 0.00 173.24 174.11 1qy9 s ALA 21 N -1.91 -0.44 0.06 5.32 0.00 0.13 -4.32 121.76 120.60 1qy9 s ALA 21 Ca 0.56 -0.09 -0.05 0.00 0.00 0.00 0.00 51.96 52.37 1qy9 s ALA 21 Cb -0.13 0.17 -0.05 0.00 0.00 0.00 0.00 23.12 23.10 1qy9 s ALA 21 CO 0.18 -0.28 0.30 0.20 0.00 0.00 0.00 175.76 176.17 1qy9 s GLY 22 N -1.63 2.25 -0.12 0.00 0.00 -0.98 -1.54 107.32 105.30 1qy9 s GLY 22 Ca -0.11 -0.59 -0.00 0.00 0.00 0.00 0.00 44.72 44.02 1qy9 s GLY 22 CO 0.00 -0.45 -0.07 0.14 0.00 0.00 0.00 173.10 172.72 1qy9 s VAL 23 N -1.44 1.03 -0.09 1.40 1.01 -0.69 -0.82 120.40 120.80 1qy9 s VAL 23 Ca 0.33 -0.32 0.04 0.00 0.00 0.00 0.00 61.98 62.03 1qy9 s VAL 23 Cb -0.13 -1.07 -0.01 0.00 0.00 0.00 0.00 36.38 35.18 1qy9 s VAL 23 CO 0.20 0.34 -0.22 -0.69 0.00 0.00 0.00 175.10 174.73 1qy9 s VAL 24 N 1.70 2.24 0.06 2.92 1.01 0.07 -0.36 120.40 128.05 1qy9 s VAL 24 Ca 0.04 -0.97 -0.26 0.00 0.00 0.00 0.00 61.98 60.79 1qy9 s VAL 24 Cb -0.13 -1.85 0.07 0.00 0.00 0.00 0.00 36.38 34.47 1qy9 s VAL 24 CO -0.08 0.56 0.66 0.72 0.00 0.00 0.00 175.10 176.96 1qy9 s PHE 25 N 0.11 -0.57 0.40 5.22 -0.12 -1.01 -1.44 117.98 120.57 1qy9 s PHE 25 Ca -0.11 0.63 -0.23 0.00 -0.05 0.00 0.00 56.93 57.17 1qy9 s PHE 25 Cb -0.16 0.50 -0.10 0.00 -0.63 0.00 0.00 43.02 42.63 1qy9 s PHE 25 CO 0.06 -0.73 0.96 -1.25 -0.05 0.00 0.00 175.22 174.22 1qy9 s PRO 26 N -2.69 4.29 -0.03 1.99 0.04 -1.26 0.42 135.00 137.76 1qy9 s PRO 26 Ca -0.03 1.23 0.13 0.00 0.04 0.00 0.00 61.00 62.37 1qy9 s PRO 26 Cb -0.01 -2.38 0.39 0.00 0.04 0.00 0.00 34.50 32.54 1qy9 s PRO 26 CO -0.04 0.02 1.33 0.00 0.04 0.00 0.00 177.00 178.34 1qy9 n ALA 27 N -0.27 2.34 0.23 8.56 0.00 -0.34 -4.63 120.51 126.41 1qy9 n ALA 27 Ca 0.06 -1.33 0.06 0.00 0.00 0.00 0.00 53.44 52.23 1qy9 n ALA 27 Cb 0.52 -0.55 0.53 0.00 0.00 0.00 0.00 19.45 19.95 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 2.36 0.01 -0.53 0.00 5.19 -1.98 -1.93 116.42 119.53 1qy9 h ASP 28 Ca 0.00 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1qy9 h ASP 28 Cb 0.88 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.39 1qy9 h ASP 28 CO 0.04 0.15 0.00 0.59 -3.12 0.00 0.00 179.24 176.90 1qy9 n ASN 29 N -4.37 2.87 -4.81 6.45 5.03 -1.26 -4.91 115.26 114.25 1qy9 n ASN 29 Ca -0.03 -2.01 -0.37 0.00 0.87 0.00 0.00 54.58 53.05 1qy9 n ASN 29 Cb 0.21 -0.36 -0.06 0.00 -1.02 0.00 0.00 39.78 38.55 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 -1.01 4.35 0.66 3.41 1.43 -0.73 -5.09 118.68 121.71 1qy9 s LEU 30 Ca 0.36 0.59 -0.11 0.00 -1.03 0.00 0.00 54.13 53.94 1qy9 s LEU 30 Cb 0.19 -2.30 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 1qy9 s LEU 30 CO 0.24 0.28 1.05 -0.94 0.23 0.00 0.00 176.35 177.20 1qy9 s SER 31 N -0.48 5.77 0.24 2.29 1.04 -1.26 -4.96 113.70 116.34 1qy9 s SER 31 Ca 0.17 1.49 -0.08 0.00 0.48 0.00 0.00 55.95 58.01 1qy9 s SER 31 Cb -0.13 -2.44 0.41 0.00 0.10 0.00 0.00 66.02 63.95 1qy9 s SER 31 CO 0.06 -1.17 1.62 -0.08 0.98 0.00 0.00 173.24 174.65 1qy9 h GLU 32 N -0.53 0.07 -0.28 4.02 4.81 -1.98 -2.05 114.58 118.64 1qy9 h GLU 32 Ca -0.44 -0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 58.67 1qy9 h GLU 32 Cb 1.20 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 1qy9 h GLU 32 CO 0.60 0.04 -0.31 0.00 -0.73 0.00 0.00 179.01 178.61 1qy9 h ALA 33 N 1.73 0.93 0.00 2.92 0.00 -2.05 -1.65 119.26 121.14 1qy9 h ALA 33 Ca 0.40 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1qy9 h ALA 33 Cb 0.69 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1qy9 h ALA 33 CO -0.70 0.62 0.00 1.04 0.00 0.00 0.00 179.25 180.20 1qy9 n GLN 34 N -4.08 0.20 0.00 0.00 6.02 -0.77 -1.40 117.38 117.35 1qy9 n GLN 34 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 1qy9 n GLN 34 Cb 0.46 -1.25 0.00 0.00 1.02 0.00 0.00 30.24 30.47 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 0.66 0.00 -0.22 -1.09 -0.06 -0.62 -0.91 117.38 115.13 1qy9 n GLN 36 Ca 0.00 0.00 -0.07 0.00 -2.00 0.00 0.00 57.00 54.93 1qy9 n GLN 36 Cb 0.07 0.00 0.03 0.00 -4.06 0.00 0.00 30.24 26.29 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 0.83 -0.41 1.69 3.38 -1.51 -1.48 115.31 117.81 1qy9 h LEU 37 Ca 0.00 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 1qy9 h LEU 37 Cb 0.00 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1qy9 h LEU 37 CO 0.00 0.75 0.15 0.40 0.09 0.00 0.00 178.44 179.82 1qy9 h ILE 38 N 0.86 1.21 -0.76 1.22 2.04 -1.30 -0.58 117.51 120.20 1qy9 h ILE 38 Ca 0.21 -0.67 -0.04 0.00 1.00 0.00 0.00 64.86 65.36 1qy9 h ILE 38 Cb 0.16 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 1qy9 h ILE 38 CO -0.02 0.24 0.31 0.00 0.00 0.00 0.00 178.15 178.68 1qy9 h ALA 39 N 0.99 0.99 -0.36 1.87 0.00 -1.78 -0.91 119.26 120.06 1qy9 h ALA 39 Ca 0.14 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1qy9 h ALA 39 Cb 0.23 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1qy9 h ALA 39 CO -0.01 0.61 0.22 -0.09 0.00 0.00 0.00 179.25 179.98 1qy9 h ARG 40 N 1.10 0.49 -0.64 0.00 2.43 -1.10 -1.89 114.38 114.76 1qy9 h ARG 40 Ca 0.25 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 1qy9 h ARG 40 Cb 0.20 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 1qy9 h ARG 40 CO -0.02 0.36 0.40 1.49 -1.51 0.00 0.00 179.97 180.69 1qy9 h GLU 41 N 0.47 0.86 -0.04 0.20 4.57 -0.69 -2.88 114.58 117.06 1qy9 h GLU 41 Ca 0.13 -0.07 -0.19 0.00 -1.18 0.00 0.00 59.36 58.05 1qy9 h GLU 41 Cb 0.00 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 1qy9 h GLU 41 CO -0.02 0.60 -0.78 -0.07 -1.18 0.00 0.00 179.01 177.56 1qy9 h LEU 42 N 0.87 0.39 0.00 1.64 3.38 -1.13 -3.48 115.31 116.99 1qy9 h LEU 42 Ca 0.23 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1qy9 h LEU 42 Cb -0.05 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1qy9 h LEU 42 CO -0.05 1.03 0.00 0.61 0.09 0.00 0.00 178.44 180.12 1qy9 n GLY 43 N 0.65 0.65 3.76 0.83 0.00 -0.72 -5.02 105.19 105.34 1qy9 n GLY 43 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.68 2.45 0.33 1.61 3.76 -1.26 -4.93 115.29 114.58 1qy9 s HIS 44 Ca 0.00 1.58 0.06 0.00 -0.15 0.00 0.00 55.06 56.55 1qy9 s HIS 44 Cb 0.00 -3.17 0.72 0.00 1.11 0.00 0.00 32.58 31.24 1qy9 s HIS 44 CO 0.00 -1.93 1.87 0.66 -0.85 0.00 0.00 174.74 174.49 1qy9 h SER 45 N -0.64 0.75 -4.17 1.40 4.64 -1.94 -3.37 113.55 110.22 1qy9 h SER 45 Ca -0.45 0.04 -0.17 0.00 -0.47 0.00 0.00 61.79 60.73 1qy9 h SER 45 Cb 1.25 -0.12 -0.24 0.00 -0.31 0.00 0.00 62.40 62.98 1qy9 h SER 45 CO 0.51 0.40 -0.50 -1.61 -0.87 0.00 0.00 176.83 174.76 1qy9 s GLU 46 N -5.77 0.30 -0.08 4.77 8.01 -1.26 -4.10 118.70 120.57 1qy9 s GLU 46 Ca -0.11 0.04 0.04 0.00 0.01 0.00 0.00 54.97 54.96 1qy9 s GLU 46 Cb 0.22 0.13 -0.01 0.00 -4.31 0.00 0.00 34.13 30.16 1qy9 s GLU 46 CO 0.79 -0.05 -0.22 0.99 0.01 0.00 0.00 175.26 176.78 1qy9 s THR 47 N -0.38 2.32 -0.15 3.63 2.01 -0.02 -2.32 115.64 120.73 1qy9 s THR 47 Ca -0.05 -0.96 -0.06 0.00 0.31 0.00 0.00 61.69 60.93 1qy9 s THR 47 Cb -0.03 -1.88 -0.04 0.00 0.01 0.00 0.00 72.50 70.56 1qy9 s THR 47 CO 0.01 0.56 0.07 0.00 -0.69 0.00 0.00 174.62 174.57 1qy9 s ALA 48 N -0.06 3.50 -0.16 7.40 0.00 -0.00 -1.33 121.76 131.11 1qy9 s ALA 48 Ca -0.06 -0.73 -0.01 0.00 0.00 0.00 0.00 51.96 51.16 1qy9 s ALA 48 Cb -0.15 -1.86 -0.01 0.00 0.00 0.00 0.00 23.12 21.11 1qy9 s ALA 48 CO 0.05 0.35 -0.12 -0.06 0.00 0.00 0.00 175.76 175.98 1qy9 s PHE 49 N -0.17 2.84 -0.17 0.00 0.40 -0.01 -0.75 117.98 120.13 1qy9 s PHE 49 Ca 0.08 -0.85 -0.10 0.00 -0.60 0.00 0.00 56.93 55.46 1qy9 s PHE 49 Cb -0.12 -1.92 -0.05 0.00 0.51 0.00 0.00 43.02 41.44 1qy9 s PHE 49 CO 0.01 -0.38 0.16 -0.51 0.70 0.00 0.00 175.22 175.20 1qy9 s LEU 50 N 0.77 4.27 0.05 -0.37 1.43 -0.52 -1.63 118.68 122.68 1qy9 s LEU 50 Ca -0.05 0.35 -0.01 0.00 -1.03 0.00 0.00 54.13 53.39 1qy9 s LEU 50 Cb -0.15 -2.13 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 1qy9 s LEU 50 CO 0.01 0.24 -0.03 -0.76 0.23 0.00 0.00 176.35 176.04 1qy9 s LEU 51 N -0.05 2.45 0.31 1.79 1.43 0.25 -1.20 118.68 123.67 1qy9 s LEU 51 Ca 0.11 -0.93 -0.29 0.00 -1.03 0.00 0.00 54.13 52.00 1qy9 s LEU 51 Cb -0.12 0.16 -0.13 0.00 0.03 0.00 0.00 46.19 46.13 1qy9 s LEU 51 CO 0.01 -0.54 1.24 1.57 0.23 0.00 0.00 176.35 178.86 1qy9 n HIS 52 N 0.32 2.02 -4.78 0.29 -0.00 -1.26 -1.55 115.22 110.25 1qy9 n HIS 52 Ca -0.15 0.57 -0.24 0.00 -0.00 0.00 0.00 57.72 57.90 1qy9 n HIS 52 Cb 0.60 -2.38 -0.15 0.00 -0.00 0.00 0.00 29.99 28.06 1qy9 n HIS 52 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 1qy9 s SER 53 N -0.26 1.99 0.20 0.26 1.04 -1.26 -4.40 113.70 111.27 1qy9 s SER 53 Ca 0.58 -0.32 0.26 0.00 0.48 0.00 0.00 55.95 56.95 1qy9 s SER 53 Cb -0.62 -0.22 0.68 0.00 0.10 0.00 0.00 66.02 65.96 1qy9 s SER 53 CO 0.60 0.20 1.66 0.44 0.98 0.00 0.00 173.24 177.12 1qy9 h ASP 54 N 5.65 0.00 0.00 7.02 3.32 -1.98 -3.37 116.42 127.06 1qy9 h ASP 54 Ca -0.37 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1qy9 h ASP 54 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 1qy9 h ASP 54 CO 0.48 0.02 0.00 -0.90 -1.72 0.00 0.00 179.24 177.12 1qy9 n ASP 55 N -2.28 1.42 -1.57 6.45 5.75 -1.26 -5.09 116.55 119.98 1qy9 n ASP 55 Ca 0.05 -1.65 -0.02 0.00 -0.01 0.00 0.00 54.79 53.16 1qy9 n ASP 55 Cb 0.44 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.54 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 -0.32 -0.57 0.09 -1.12 3.41 -1.26 -5.02 113.62 108.83 1qy9 n SER 56 Ca 0.00 -1.36 -0.05 0.00 -0.26 0.00 0.00 58.87 57.20 1qy9 n SER 56 Cb 0.27 0.95 0.08 0.00 -0.26 0.00 0.00 64.21 65.24 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 0.55 0.20 -3.77 4.04 3.32 -1.52 -3.42 116.42 115.82 1qy9 h ASP 57 Ca -0.09 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 56.81 1qy9 h ASP 57 Cb 0.34 -0.06 -0.22 0.00 0.22 0.00 0.00 39.33 39.62 1qy9 h ASP 57 CO 0.11 0.84 0.15 0.54 -1.72 0.00 0.00 179.24 179.16 1qy9 s VAL 58 N -3.50 0.00 -0.15 -1.35 0.11 -1.19 -4.70 120.40 109.62 1qy9 s VAL 58 Ca -0.03 0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 58.94 1qy9 s VAL 58 Cb 0.11 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 1qy9 s VAL 58 CO 0.80 0.00 0.12 -0.60 -3.33 0.00 0.00 175.10 172.09 1qy9 s ARG 59 N 0.54 3.71 -0.09 1.54 3.52 -0.60 -0.70 118.95 126.88 1qy9 s ARG 59 Ca -0.01 -0.20 0.03 0.00 -0.13 0.00 0.00 55.73 55.42 1qy9 s ARG 59 Cb -0.05 -3.24 0.01 0.00 -1.56 0.00 0.00 34.95 30.10 1qy9 s ARG 59 CO -0.03 0.57 -0.18 0.42 -0.81 0.00 0.00 175.30 175.27 1qy9 s ILE 60 N -0.42 1.60 -0.11 4.11 1.01 -0.53 -0.58 121.20 126.29 1qy9 s ILE 60 Ca 0.11 -0.74 -0.03 0.00 0.00 0.00 0.00 60.65 59.99 1qy9 s ILE 60 Cb -0.12 -1.42 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 1qy9 s ILE 60 CO 0.01 0.46 -0.00 -0.13 0.00 0.00 0.00 174.94 175.28 1qy9 s ARG 61 N 0.60 3.21 -0.11 2.79 0.52 -0.64 -4.45 118.95 120.87 1qy9 s ARG 61 Ca -0.15 -0.42 0.01 0.00 -0.52 0.00 0.00 55.73 54.65 1qy9 s ARG 61 Cb -0.16 -2.86 -0.02 0.00 0.52 0.00 0.00 34.95 32.43 1qy9 s ARG 61 CO 0.05 0.57 -0.15 0.71 0.02 0.00 0.00 175.30 176.50 1qy9 s TYR 62 N -0.52 2.75 -0.03 -0.53 1.51 -1.25 -0.83 117.35 118.45 1qy9 s TYR 62 Ca 0.09 -0.58 0.03 0.00 -1.01 0.00 0.00 57.07 55.59 1qy9 s TYR 62 Cb -0.12 -1.78 0.00 0.00 -0.11 0.00 0.00 41.96 39.96 1qy9 s TYR 62 CO 0.02 -0.15 -0.11 -0.06 -1.11 0.00 0.00 175.55 174.15 1qy9 s PHE 63 N 0.11 1.13 0.88 2.71 0.40 -0.44 -0.76 117.98 122.01 1qy9 s PHE 63 Ca -0.07 -0.30 -0.12 0.00 -0.60 0.00 0.00 56.93 55.84 1qy9 s PHE 63 Cb -0.15 -0.80 0.17 0.00 0.51 0.00 0.00 43.02 42.75 1qy9 s PHE 63 CO 0.05 -0.13 1.22 0.95 0.70 0.00 0.00 175.22 178.01 1qy9 s THR 64 N 0.23 2.05 0.34 0.64 -4.23 -0.07 -0.84 115.64 113.76 1qy9 s THR 64 Ca -0.04 -0.15 0.33 0.00 -1.18 0.00 0.00 61.69 60.65 1qy9 s THR 64 Cb -0.10 -2.90 0.33 0.00 1.34 0.00 0.00 72.50 71.17 1qy9 s THR 64 CO 0.01 0.00 2.00 -0.65 -0.54 0.00 0.00 174.62 175.44 1qy9 h PRO 65 N -1.29 0.00 0.00 3.99 0.11 -1.76 -3.26 132.00 129.80 1qy9 h PRO 65 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1qy9 h PRO 65 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1qy9 h PRO 65 CO 0.42 0.00 -0.98 0.25 -0.21 0.00 0.00 178.00 177.48 1qy9 n THR 66 N -2.71 0.00 -3.69 -1.15 -2.24 -1.26 -3.94 114.28 99.29 1qy9 n THR 66 Ca -0.02 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.63 1qy9 n THR 66 Cb 0.12 0.12 -0.07 0.00 -2.10 0.00 0.00 70.33 68.41 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 -1.96 0.05 0.29 2.28 0.11 -1.23 -5.13 120.40 114.81 1qy9 s VAL 67 Ca 0.00 -0.45 -0.29 0.00 -2.93 0.00 0.00 61.98 58.31 1qy9 s VAL 67 Cb 0.00 -0.87 -0.10 0.00 -1.53 0.00 0.00 36.38 33.89 1qy9 s VAL 67 CO 0.00 -0.25 1.11 -0.70 -3.33 0.00 0.00 175.10 171.93 1qy9 s GLU 68 N -2.08 4.60 0.23 1.54 2.12 -1.26 -0.89 118.70 122.96 1qy9 s GLU 68 Ca -0.08 1.81 0.09 0.00 0.36 0.00 0.00 54.97 57.15 1qy9 s GLU 68 Cb -0.02 -3.14 -0.05 0.00 0.26 0.00 0.00 34.13 31.18 1qy9 s GLU 68 CO 0.00 0.17 -0.17 0.14 -0.54 0.00 0.00 175.26 174.87 1qy9 s VAL 69 N -1.19 2.01 0.13 3.70 -7.23 0.06 -4.93 120.40 112.96 1qy9 s VAL 69 Ca 0.45 -2.27 -0.12 0.00 -1.81 0.00 0.00 61.98 58.24 1qy9 s VAL 69 Cb -0.32 -2.13 -0.08 0.00 0.56 0.00 0.00 36.38 34.42 1qy9 s VAL 69 CO 0.41 -0.51 1.43 -0.65 -0.31 0.00 0.00 175.10 175.47 1qy9 h PRO 70 N 2.50 0.87 -1.49 4.82 0.11 -1.97 -3.34 132.00 133.50 1qy9 h PRO 70 Ca -0.39 -0.51 0.20 0.00 0.11 0.00 0.00 66.00 65.41 1qy9 h PRO 70 Cb 1.23 0.04 -0.21 0.00 0.11 0.00 0.00 31.00 32.18 1qy9 h PRO 70 CO 0.61 1.15 0.76 -1.50 -0.21 0.00 0.00 178.00 178.80 1qy9 s ILE 71 N -4.24 0.00 -0.25 4.15 2.07 -1.26 -3.71 121.20 117.96 1qy9 s ILE 71 Ca -0.11 0.00 -0.10 0.00 -1.41 0.00 0.00 60.65 59.03 1qy9 s ILE 71 Cb 0.10 -1.00 0.10 0.00 0.13 0.00 0.00 42.46 41.79 1qy9 s ILE 71 CO 0.88 0.00 0.56 0.00 -1.91 0.00 0.00 174.94 174.46 1qy9 h GLY 73 N 7.78 -0.59 1.82 0.00 0.00 -1.99 0.11 103.07 110.19 1qy9 h GLY 73 Ca -0.22 0.36 -0.09 0.00 0.00 0.00 0.00 47.33 47.38 1qy9 h GLY 73 CO 0.14 -0.24 -0.33 1.12 0.00 0.00 0.00 176.54 177.22 1qy9 h HIS 74 N -0.53 0.24 -0.01 5.60 2.07 -1.97 -1.42 115.15 119.13 1qy9 h HIS 74 Ca 0.03 -0.05 -0.14 0.00 -2.85 0.00 0.00 60.37 57.36 1qy9 h HIS 74 Cb 0.56 -0.06 -0.02 0.00 2.57 0.00 0.00 27.41 30.46 1qy9 h HIS 74 CO -0.27 0.53 -0.65 0.00 -3.07 0.00 0.00 177.93 174.48 1qy9 h ALA 75 N 1.47 0.92 -0.31 6.11 0.00 -1.88 -1.34 119.26 124.23 1qy9 h ALA 75 Ca 0.02 -0.59 -0.06 0.00 0.00 0.00 0.00 54.91 54.28 1qy9 h ALA 75 Cb 0.69 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1qy9 h ALA 75 CO 0.05 0.80 -0.06 1.15 0.00 0.00 0.00 179.25 181.20 1qy9 h THR 76 N 0.02 1.28 -0.13 0.00 2.02 -0.51 0.14 112.91 115.73 1qy9 h THR 76 Ca -0.01 -1.08 0.01 0.00 0.77 0.00 0.00 66.41 66.11 1qy9 h THR 76 Cb 1.15 1.34 -0.02 0.00 -1.74 0.00 0.00 68.15 68.89 1qy9 h THR 76 CO 0.09 0.35 0.03 0.58 0.37 0.00 0.00 175.52 176.93 1qy9 h VAL 77 N 0.37 0.95 -0.54 3.16 2.07 -1.19 -1.72 116.25 119.35 1qy9 h VAL 77 Ca 0.08 -0.03 0.02 0.00 0.82 0.00 0.00 66.70 67.59 1qy9 h VAL 77 Cb 0.54 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 1qy9 h VAL 77 CO 0.03 0.02 0.33 0.00 0.02 0.00 0.00 177.57 177.97 1qy9 h ALA 78 N 1.09 0.69 -0.36 1.67 0.00 -1.13 -0.83 119.26 120.38 1qy9 h ALA 78 Ca 0.06 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1qy9 h ALA 78 Cb 0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1qy9 h ALA 78 CO -0.07 0.06 0.08 0.00 0.00 0.00 0.00 179.25 179.33 1qy9 h ALA 79 N 1.22 0.48 -0.01 0.00 0.00 -0.71 -1.39 119.26 118.85 1qy9 h ALA 79 Ca 0.21 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.77 1qy9 h ALA 79 Cb -0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1qy9 h ALA 79 CO -0.08 0.16 -0.72 0.45 0.00 0.00 0.00 179.25 179.06 1qy9 h HIS 80 N 0.44 0.11 -0.10 0.00 3.86 -1.26 0.10 115.15 118.29 1qy9 h HIS 80 Ca 0.11 -0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.27 1qy9 h HIS 80 Cb 0.31 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 28.76 1qy9 h HIS 80 CO 0.02 0.77 0.06 -0.92 0.86 0.00 0.00 177.93 178.72 1qy9 h TYR 81 N 0.05 0.14 -0.15 2.45 5.03 -1.01 0.63 116.97 124.11 1qy9 h TYR 81 Ca -0.01 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.28 1qy9 h TYR 81 Cb 1.27 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 39.50 1qy9 h TYR 81 CO 0.01 0.15 0.06 0.28 -1.32 0.00 0.00 178.16 177.34 1qy9 h VAL 82 N 0.09 1.16 -0.97 1.81 2.07 -1.07 -2.24 116.25 117.10 1qy9 h VAL 82 Ca 0.04 -0.50 0.02 0.00 0.82 0.00 0.00 66.70 67.07 1qy9 h VAL 82 Cb 0.06 1.22 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 1qy9 h VAL 82 CO -0.01 0.15 0.64 -0.09 0.02 0.00 0.00 177.57 178.29 1qy9 h ARG 83 N 0.08 1.25 -0.34 1.57 2.43 -0.94 0.26 114.38 118.70 1qy9 h ARG 83 Ca 0.05 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1qy9 h ARG 83 Cb 0.19 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 1qy9 h ARG 83 CO -0.00 0.83 0.14 0.00 -1.51 0.00 0.00 179.97 179.43 1qy9 h ALA 84 N 1.41 0.44 -0.13 2.80 0.00 -0.67 -0.76 119.26 122.35 1qy9 h ALA 84 Ca 0.36 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1qy9 h ALA 84 Cb -0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1qy9 h ALA 84 CO -0.09 0.03 0.06 0.87 0.00 0.00 0.00 179.25 180.12 1qy9 h LYS 85 N 0.40 0.19 -0.59 0.00 1.79 -0.97 -0.45 116.57 116.94 1qy9 h LYS 85 Ca 0.11 -0.03 -0.04 0.00 -2.18 0.00 0.00 60.65 58.52 1qy9 h LYS 85 Cb 0.17 -0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.76 1qy9 h LYS 85 CO -0.01 0.27 0.23 0.28 -1.08 0.00 0.00 179.45 179.14 1qy9 h VAL 86 N 0.07 1.23 0.00 0.50 2.07 -0.89 -3.11 116.25 116.12 1qy9 h VAL 86 Ca 0.04 -0.72 0.00 0.00 0.82 0.00 0.00 66.70 66.84 1qy9 h VAL 86 Cb 0.15 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1qy9 h VAL 86 CO -0.00 0.28 -0.67 -0.07 0.02 0.00 0.00 177.57 177.13 1qy9 h LEU 87 N 0.83 0.00 -1.58 2.57 3.38 -1.18 -3.48 115.31 115.84 1qy9 h LEU 87 Ca 0.20 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 1qy9 h LEU 87 Cb 0.21 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.01 1qy9 h LEU 87 CO -0.02 0.04 -0.23 0.61 0.09 0.00 0.00 178.44 178.93 1qy9 n GLY 88 N 1.22 0.29 3.85 0.83 0.00 -0.30 -5.05 105.19 106.04 1qy9 n GLY 88 Ca 0.02 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 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 -3.21 3.34 0.00 0.99 1.43 -0.51 -5.05 118.68 115.67 1qy9 s LEU 89 Ca 0.06 1.54 0.00 0.00 -1.03 0.00 0.00 54.13 54.70 1qy9 s LEU 89 Cb -0.03 -4.49 0.00 0.00 0.03 0.00 0.00 46.19 41.70 1qy9 s LEU 89 CO 0.22 -0.94 0.00 0.61 0.23 0.00 0.00 176.35 176.47 1qy9 n GLY 90 N -2.11 3.35 3.59 -3.19 0.00 -1.26 -4.92 105.19 100.65 1qy9 n GLY 90 Ca 0.07 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 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 0.13 6.33 0.02 1.61 0.01 -1.26 -4.29 114.94 117.49 1qy9 s ASN 91 Ca 0.00 0.43 -0.00 0.00 -0.71 0.00 0.00 52.86 52.58 1qy9 s ASN 91 Cb 0.00 -2.55 -0.02 0.00 0.41 0.00 0.00 41.25 39.09 1qy9 s ASN 91 CO 0.00 -1.51 -0.03 0.00 -1.51 0.00 0.00 177.10 174.05 1qy9 s THR 93 N -1.41 4.31 0.03 0.00 2.01 -1.26 -1.27 115.64 118.05 1qy9 s THR 93 Ca -0.15 -0.18 0.06 0.00 0.31 0.00 0.00 61.69 61.72 1qy9 s THR 93 Cb -0.10 -2.98 -0.03 0.00 0.01 0.00 0.00 72.50 69.40 1qy9 s THR 93 CO -0.01 0.39 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.53 1qy9 s ILE 94 N 1.17 3.03 -0.16 1.82 1.09 -0.27 -4.99 121.20 122.89 1qy9 s ILE 94 Ca 0.04 -1.07 -0.04 0.00 -1.10 0.00 0.00 60.65 58.47 1qy9 s ILE 94 Cb -0.14 -2.29 -0.03 0.00 -1.06 0.00 0.00 42.46 38.94 1qy9 s ILE 94 CO 0.03 0.35 -0.02 0.26 -0.10 0.00 0.00 174.94 175.46 1qy9 s TRP 95 N -0.95 3.06 0.20 3.97 0.52 -1.26 -0.73 118.94 123.75 1qy9 s TRP 95 Ca 0.15 -0.24 0.09 0.00 0.02 0.00 0.00 56.10 56.12 1qy9 s TRP 95 Cb -0.11 -1.97 -0.04 0.00 -1.15 0.00 0.00 33.47 30.20 1qy9 s TRP 95 CO 0.06 0.00 -0.06 1.14 0.02 0.00 0.00 176.95 178.11 1qy9 s GLN 96 N 0.34 2.17 -0.06 4.98 -2.07 -0.06 -1.30 119.66 123.65 1qy9 s GLN 96 Ca -0.03 -1.28 0.05 0.00 -1.82 0.00 0.00 55.36 52.28 1qy9 s GLN 96 Cb -0.14 -2.19 -0.01 0.00 -1.09 0.00 0.00 33.01 29.58 1qy9 s GLN 96 CO 0.03 0.42 -0.22 0.99 -1.32 0.00 0.00 175.29 175.19 1qy9 s THR 97 N -1.86 2.32 0.34 3.63 2.01 0.12 -0.56 115.64 121.64 1qy9 s THR 97 Ca 0.27 -0.97 0.01 0.00 0.31 0.00 0.00 61.69 61.30 1qy9 s THR 97 Cb -0.08 -1.86 -0.00 0.00 0.01 0.00 0.00 72.50 70.56 1qy9 s THR 97 CO 0.17 0.57 0.42 -1.54 -0.69 0.00 0.00 174.62 173.55 1qy9 n SER 98 N 2.88 -1.15 0.12 3.53 3.41 -0.18 -1.45 113.62 120.79 1qy9 n SER 98 Ca -0.17 -2.95 0.18 0.00 -0.26 0.00 0.00 58.87 55.67 1qy9 n SER 98 Cb 0.52 2.24 0.76 0.00 -0.26 0.00 0.00 64.21 67.47 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 -0.84 1.04 3.38 -1.81 -0.95 115.31 116.14 1qy9 h LEU 99 Ca -0.26 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.65 1qy9 h LEU 99 Cb 1.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 1qy9 h LEU 99 CO 0.35 0.00 -0.31 0.00 0.09 0.00 0.00 178.44 178.57 1qy9 h ALA 100 N 1.71 0.95 0.00 1.53 0.00 -1.95 -3.50 119.26 118.00 1qy9 h ALA 100 Ca 0.16 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1qy9 h ALA 100 Cb 0.76 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1qy9 h ALA 100 CO -0.00 0.39 0.00 0.41 0.00 0.00 0.00 179.25 180.05 1qy9 n GLY 101 N 0.38 0.79 3.64 0.00 0.00 -0.36 -5.06 105.19 104.58 1qy9 n GLY 101 Ca 0.00 -1.88 -0.36 0.00 0.00 0.00 0.00 46.02 43.78 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 -1.52 4.01 -0.02 1.61 2.20 -1.26 -1.01 119.74 123.76 1qy9 s LYS 102 Ca 0.00 -0.31 0.04 0.00 -0.36 0.00 0.00 55.97 55.34 1qy9 s LYS 102 Cb 0.00 -3.41 -0.01 0.00 -1.51 0.00 0.00 37.83 32.91 1qy9 s LYS 102 CO 0.00 0.12 -0.13 -1.01 -0.36 0.00 0.00 175.35 173.98 1qy9 s HIS 103 N 0.83 1.22 0.07 4.03 3.76 0.28 -4.98 115.29 120.51 1qy9 s HIS 103 Ca 0.06 -0.27 -0.26 0.00 -0.15 0.00 0.00 55.06 54.44 1qy9 s HIS 103 Cb -0.13 -0.81 -0.06 0.00 1.11 0.00 0.00 32.58 32.69 1qy9 s HIS 103 CO 0.02 -0.07 0.81 0.50 -0.85 0.00 0.00 174.74 175.16 1qy9 s ARG 104 N -0.12 4.55 -0.07 1.40 3.52 -1.26 -0.88 118.95 126.09 1qy9 s ARG 104 Ca 0.01 1.16 0.02 0.00 -0.13 0.00 0.00 55.73 56.80 1qy9 s ARG 104 Cb -0.07 -3.36 0.01 0.00 -1.56 0.00 0.00 34.95 29.97 1qy9 s ARG 104 CO 0.00 0.29 -0.13 0.08 -0.81 0.00 0.00 175.30 174.73 1qy9 s VAL 105 N -0.13 1.17 -0.20 7.11 1.01 0.09 -4.49 120.40 124.96 1qy9 s VAL 105 Ca 0.40 -0.50 -0.07 0.00 0.00 0.00 0.00 61.98 61.81 1qy9 s VAL 105 Cb -0.21 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 1qy9 s VAL 105 CO 0.25 0.36 0.07 -0.89 0.00 0.00 0.00 175.10 174.89 1qy9 s THR 106 N 0.65 4.66 -0.16 3.92 2.01 -0.57 -1.12 115.64 125.04 1qy9 s THR 106 Ca -0.15 -0.07 -0.03 0.00 0.31 0.00 0.00 61.69 61.75 1qy9 s THR 106 Cb -0.16 -3.12 -0.02 0.00 0.01 0.00 0.00 72.50 69.21 1qy9 s THR 106 CO 0.04 0.42 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.70 1qy9 s ILE 107 N 0.75 3.60 -0.12 1.82 1.01 -0.40 -0.51 121.20 127.36 1qy9 s ILE 107 Ca 0.04 -0.45 0.03 0.00 0.00 0.00 0.00 60.65 60.26 1qy9 s ILE 107 Cb -0.13 -2.58 0.00 0.00 0.01 0.00 0.00 42.46 39.76 1qy9 s ILE 107 CO 0.02 0.49 -0.22 -1.61 0.00 0.00 0.00 174.94 173.62 1qy9 s GLU 108 N 0.57 3.07 -0.31 2.79 2.02 -0.36 -1.95 118.70 124.53 1qy9 s GLU 108 Ca -0.04 -0.85 -0.12 0.00 0.02 0.00 0.00 54.97 53.98 1qy9 s GLU 108 Cb -0.15 -2.39 -0.03 0.00 0.10 0.00 0.00 34.13 31.66 1qy9 s GLU 108 CO 0.03 0.10 0.21 0.21 0.02 0.00 0.00 175.26 175.83 1qy9 s LYS 109 N 0.54 3.71 -0.09 1.61 2.20 -1.26 -1.22 119.74 125.23 1qy9 s LYS 109 Ca -0.13 -0.49 0.00 0.00 -0.36 0.00 0.00 55.97 54.99 1qy9 s LYS 109 Cb -0.17 -3.73 0.02 0.00 -1.51 0.00 0.00 37.83 32.44 1qy9 s LYS 109 CO 0.04 -0.32 -0.07 -1.58 -0.36 0.00 0.00 175.35 173.07 1qy9 s HIS 110 N 1.74 1.23 -1.19 4.03 2.46 -0.58 -4.87 115.29 118.12 1qy9 s HIS 110 Ca 0.06 -0.53 -0.04 0.00 0.47 0.00 0.00 55.06 55.03 1qy9 s HIS 110 Cb -0.17 -1.05 -0.02 0.00 -0.13 0.00 0.00 32.58 31.21 1qy9 s HIS 110 CO 0.11 -0.39 0.86 0.09 -2.47 0.00 0.00 174.74 172.93 1qy9 n ASN 111 N 4.66 -3.30 0.00 9.88 3.02 -1.26 -2.38 115.26 125.87 1qy9 n ASN 111 Ca -0.15 -0.76 0.00 0.00 -0.03 0.00 0.00 54.58 53.64 1qy9 n ASN 111 Cb 0.50 -4.59 0.00 0.00 -0.61 0.00 0.00 39.78 35.08 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 -3.08 -1.53 -4.39 6.41 9.92 -1.26 -4.95 116.55 117.67 1qy9 n ASP 112 Ca -0.21 0.00 -0.20 0.00 -0.53 0.00 0.00 54.79 53.85 1qy9 n ASP 112 Cb 0.65 -1.94 -0.10 0.00 -0.64 0.00 0.00 41.12 39.09 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 -2.23 2.34 0.06 -2.24 -1.08 -1.00 -5.15 116.67 107.37 1qy9 s ASP 113 Ca 0.00 -1.22 0.09 0.00 -0.52 0.00 0.00 52.55 50.90 1qy9 s ASP 113 Cb 0.00 -0.09 -0.03 0.00 -1.46 0.00 0.00 42.92 41.34 1qy9 s ASP 113 CO 0.00 -0.44 -0.25 -0.31 0.52 0.00 0.00 175.17 174.70 1qy9 s TYR 114 N -3.21 2.15 -0.05 -5.34 2.02 -1.26 -1.52 117.35 110.14 1qy9 s TYR 114 Ca 0.30 -0.40 0.06 0.00 -0.37 0.00 0.00 57.07 56.66 1qy9 s TYR 114 Cb 0.05 -1.25 -0.01 0.00 -0.40 0.00 0.00 41.96 40.34 1qy9 s TYR 114 CO 0.11 0.16 -0.24 1.03 -1.57 0.00 0.00 175.55 175.04 1qy9 s ARG 115 N -1.41 2.34 -0.13 -0.62 0.52 -0.36 -4.44 118.95 114.85 1qy9 s ARG 115 Ca 0.11 -0.87 -0.01 0.00 -0.52 0.00 0.00 55.73 54.44 1qy9 s ARG 115 Cb -0.10 -2.04 -0.02 0.00 0.52 0.00 0.00 34.95 33.31 1qy9 s ARG 115 CO 0.03 0.40 -0.10 0.42 0.02 0.00 0.00 175.30 176.07 1qy9 s ILE 116 N -0.23 3.37 -0.05 1.52 -1.09 0.13 -1.22 121.20 123.63 1qy9 s ILE 116 Ca -0.01 -0.55 0.06 0.00 -2.23 0.00 0.00 60.65 57.92 1qy9 s ILE 116 Cb -0.13 -2.43 -0.02 0.00 -1.58 0.00 0.00 42.46 38.31 1qy9 s ILE 116 CO 0.02 0.52 -0.24 -0.44 -1.23 0.00 0.00 174.94 173.58 1qy9 s SER 117 N 0.20 3.20 -0.02 3.58 0.01 0.34 -1.65 113.70 119.36 1qy9 s SER 117 Ca -0.06 -0.45 0.03 0.00 1.31 0.00 0.00 55.95 56.78 1qy9 s SER 117 Cb -0.15 -0.69 0.00 0.00 0.21 0.00 0.00 66.02 65.39 1qy9 s SER 117 CO 0.04 0.28 -0.10 -0.76 0.41 0.00 0.00 173.24 173.11 1qy9 s LEU 118 N -0.37 1.85 0.08 2.44 1.43 0.10 -1.51 118.68 122.70 1qy9 s LEU 118 Ca 0.03 -0.20 -0.22 0.00 -1.03 0.00 0.00 54.13 52.71 1qy9 s LEU 118 Cb -0.12 -0.58 -0.07 0.00 0.03 0.00 0.00 46.19 45.45 1qy9 s LEU 118 CO 0.02 0.09 0.66 -0.70 0.23 0.00 0.00 176.35 176.64 1qy9 s GLU 119 N 0.09 4.36 0.51 1.70 2.12 -1.26 -1.07 118.70 125.15 1qy9 s GLU 119 Ca -0.02 0.89 0.08 0.00 0.36 0.00 0.00 54.97 56.28 1qy9 s GLU 119 Cb -0.08 -3.28 0.08 0.00 0.26 0.00 0.00 34.13 31.11 1qy9 s GLU 119 CO 0.00 0.52 0.65 1.04 -0.54 0.00 0.00 175.26 176.93 1qy9 n GLN 120 N 2.04 0.67 -1.28 4.30 6.02 -0.34 -4.98 117.38 123.81 1qy9 n GLN 120 Ca -0.07 -2.84 -0.29 0.00 -0.01 0.00 0.00 57.00 53.79 1qy9 n GLN 120 Cb 0.50 -0.12 0.20 0.00 1.02 0.00 0.00 30.24 31.85 1qy9 n GLN 120 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1qy9 s GLY 121 N -4.27 1.60 0.17 1.08 0.00 -0.15 -4.70 107.32 101.06 1qy9 s GLY 121 Ca 0.50 -0.77 -0.31 0.00 0.00 0.00 0.00 44.72 44.13 1qy9 s GLY 121 CO 0.31 -0.02 1.54 -1.59 0.00 0.00 0.00 173.10 173.35 1qy9 s THR 122 N -3.15 2.65 0.35 0.90 2.01 -1.26 -4.61 115.64 112.52 1qy9 s THR 122 Ca 0.69 0.48 -0.29 0.00 0.31 0.00 0.00 61.69 62.88 1qy9 s THR 122 Cb -0.12 -3.31 -0.11 0.00 0.01 0.00 0.00 72.50 68.98 1qy9 s THR 122 CO 0.56 0.04 1.50 -2.16 -0.69 0.00 0.00 174.62 173.87 1qy9 s PRO 123 N 0.94 4.13 0.02 4.92 0.04 -1.26 -4.38 135.00 139.41 1qy9 s PRO 123 Ca 0.68 2.54 -0.07 0.00 0.04 0.00 0.00 61.00 64.20 1qy9 s PRO 123 Cb -0.43 -2.99 -0.00 0.00 0.04 0.00 0.00 34.50 31.11 1qy9 s PRO 123 CO 0.33 -0.53 0.12 0.20 0.04 0.00 0.00 177.00 177.16 1qy9 s GLY 124 N 0.02 0.09 -0.00 0.56 0.00 -0.36 -5.00 107.32 102.64 1qy9 s GLY 124 Ca 0.56 -0.31 0.02 0.00 0.00 0.00 0.00 44.72 44.98 1qy9 s GLY 124 CO 0.58 -0.45 -0.05 -1.36 0.00 0.00 0.00 173.10 171.81 1qy9 s PHE 125 N -1.96 0.45 0.33 1.90 0.08 -1.26 -1.05 117.98 116.48 1qy9 s PHE 125 Ca -0.10 -0.11 0.03 0.00 0.12 0.00 0.00 56.93 56.87 1qy9 s PHE 125 Cb -0.05 -0.29 -0.02 0.00 -0.57 0.00 0.00 43.02 42.09 1qy9 s PHE 125 CO -0.01 -0.01 0.51 -1.21 -0.10 0.00 0.00 175.22 174.39 1qy9 s GLU 126 N -0.20 3.35 0.47 0.44 2.02 -0.59 -5.02 118.70 119.16 1qy9 s GLU 126 Ca 0.01 -0.57 -0.24 0.00 0.02 0.00 0.00 54.97 54.19 1qy9 s GLU 126 Cb -0.02 -2.73 -0.08 0.00 0.10 0.00 0.00 34.13 31.40 1qy9 s GLU 126 CO -0.00 0.14 1.32 -2.30 0.02 0.00 0.00 175.26 174.44 1qy9 n PRO 127 N -1.72 1.92 -1.54 0.39 -0.02 -1.26 -4.48 135.00 128.29 1qy9 n PRO 127 Ca -0.04 0.69 -0.47 0.00 -2.02 0.00 0.00 63.50 61.65 1qy9 n PRO 127 Cb 0.57 -2.48 -0.03 0.00 -0.02 0.00 0.00 33.50 31.54 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 -0.30 0.96 -2.41 0.52 -0.02 -1.26 -4.69 135.00 127.80 1qy9 n PRO 128 Ca 0.07 0.34 -0.42 0.00 -2.02 0.00 0.00 63.50 61.47 1qy9 n PRO 128 Cb 0.42 -1.68 -0.03 0.00 -0.02 0.00 0.00 33.50 32.19 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 1.03 4.31 0.42 2.45 1.43 -0.37 -5.02 118.68 122.93 1qy9 s LEU 129 Ca 0.66 1.92 0.04 0.00 -1.03 0.00 0.00 54.13 55.71 1qy9 s LEU 129 Cb -0.82 -3.56 -0.02 0.00 0.03 0.00 0.00 46.19 41.82 1qy9 s LEU 129 CO 0.57 -0.57 0.12 -1.61 0.23 0.00 0.00 176.35 175.08 1qy9 s GLU 130 N 1.93 1.95 5.80 1.70 2.02 -1.26 -4.47 118.70 126.37 1qy9 s GLU 130 Ca 0.58 -2.20 0.00 0.00 0.02 0.00 0.00 54.97 53.37 1qy9 s GLU 130 Cb -0.27 -0.69 0.00 0.00 0.10 0.00 0.00 34.13 33.27 1qy9 s GLU 130 CO 0.25 -0.47 0.00 0.41 0.02 0.00 0.00 175.26 175.47 1qy9 n GLY 131 N -0.94 3.28 0.20 -1.39 0.00 -1.26 -2.68 105.19 102.40 1qy9 n GLY 131 Ca -0.07 -0.09 0.07 0.00 0.00 0.00 0.00 46.02 45.93 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 0.00 -0.10 1.61 5.08 -1.98 -1.63 114.58 117.56 1qy9 h GLU 132 Ca 0.00 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 1qy9 h GLU 132 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 1qy9 h GLU 132 CO 0.00 0.31 -0.57 1.15 -1.00 0.00 0.00 179.01 178.91 1qy9 h THR 133 N 0.00 1.36 -0.78 1.13 2.02 -1.90 -1.16 112.91 113.57 1qy9 h THR 133 Ca -0.00 -1.88 -0.03 0.00 0.77 0.00 0.00 66.41 65.26 1qy9 h THR 133 Cb 0.74 2.21 -0.04 0.00 -1.74 0.00 0.00 68.15 69.33 1qy9 h THR 133 CO 0.04 0.57 0.36 -0.09 0.37 0.00 0.00 175.52 176.77 1qy9 h ARG 134 N 0.16 1.14 -0.31 6.66 2.43 -1.31 -2.57 114.38 120.58 1qy9 h ARG 134 Ca -0.04 -0.18 -0.08 0.00 -0.81 0.00 0.00 59.98 58.87 1qy9 h ARG 134 Cb 1.22 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.55 1qy9 h ARG 134 CO 0.12 0.89 -0.15 0.00 -1.51 0.00 0.00 179.97 179.32 1qy9 h ALA 135 N 1.19 1.16 -0.22 2.80 0.00 -1.25 -2.70 119.26 120.24 1qy9 h ALA 135 Ca 0.27 -0.30 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 1qy9 h ALA 135 Cb 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1qy9 h ALA 135 CO -0.03 0.53 -0.62 0.00 0.00 0.00 0.00 179.25 179.13 1qy9 h ALA 136 N 1.35 0.48 -0.31 0.00 0.00 -0.99 -1.09 119.26 118.69 1qy9 h ALA 136 Ca 0.09 -0.54 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 1qy9 h ALA 136 Cb 0.55 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1qy9 h ALA 136 CO 0.04 0.69 0.05 0.82 0.00 0.00 0.00 179.25 180.85 1qy9 h ILE 137 N 0.56 1.23 -0.75 0.00 2.04 -1.42 -0.88 117.51 118.30 1qy9 h ILE 137 Ca -0.01 -0.81 0.04 0.00 1.00 0.00 0.00 64.86 65.08 1qy9 h ILE 137 Cb 1.22 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 38.42 1qy9 h ILE 137 CO 0.13 0.26 0.47 0.40 0.00 0.00 0.00 178.15 179.41 1qy9 h ILE 138 N 0.33 1.09 -0.17 -0.67 2.04 -1.41 -2.63 117.51 116.10 1qy9 h ILE 138 Ca 0.09 -0.31 -0.14 0.00 1.00 0.00 0.00 64.86 65.50 1qy9 h ILE 138 Cb 0.34 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1qy9 h ILE 138 CO 0.01 0.16 -0.50 -1.13 0.00 0.00 0.00 178.15 176.69 1qy9 h ASN 139 N 0.90 0.49 0.97 1.72 -1.24 -1.07 -1.35 115.58 115.99 1qy9 h ASN 139 Ca 0.31 -0.24 0.00 0.00 0.71 0.00 0.00 56.30 57.08 1qy9 h ASN 139 Cb 0.05 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 38.96 1qy9 h ASN 139 CO -0.12 0.90 0.00 0.00 -1.29 0.00 0.00 177.43 176.92 1qy9 h ALA 140 N 1.11 1.00 -0.02 1.57 0.00 -0.83 -0.95 119.26 121.14 1qy9 h ALA 140 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1qy9 h ALA 140 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1qy9 h ALA 140 CO 0.09 0.00 -0.26 1.28 0.00 0.00 0.00 179.25 180.36 1qy9 n LEU 141 N -2.97 1.78 -2.66 0.00 4.77 -1.02 -1.03 117.00 115.87 1qy9 n LEU 141 Ca 0.01 -0.60 -0.17 0.00 -0.03 0.00 0.00 56.01 55.22 1qy9 n LEU 141 Cb 0.29 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.40 1qy9 n LEU 141 CO 0.26 0.32 0.17 1.41 -1.33 0.00 0.00 177.39 178.22 1qy9 n HIS 142 N 0.02 -2.02 -4.50 -1.77 8.25 -0.36 -4.69 115.22 110.15 1qy9 n HIS 142 Ca 0.12 0.71 -0.29 0.00 -0.26 0.00 0.00 57.72 58.00 1qy9 n HIS 142 Cb 0.43 -3.82 -0.07 0.00 1.12 0.00 0.00 29.99 27.65 1qy9 n HIS 142 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1qy9 s LEU 143 N -5.40 2.63 0.44 2.41 1.43 -0.54 -5.03 118.68 114.62 1qy9 s LEU 143 Ca 0.41 -1.43 0.03 0.00 -1.03 0.00 0.00 54.13 52.11 1qy9 s LEU 143 Cb -0.18 -0.96 -0.03 0.00 0.03 0.00 0.00 46.19 45.05 1qy9 s LEU 143 CO 0.51 -0.74 0.06 0.42 0.23 0.00 0.00 176.35 176.82 1qy9 s THR 144 N -2.78 1.04 0.54 5.49 -4.23 -1.26 -4.19 115.64 110.25 1qy9 s THR 144 Ca 0.23 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.97 1qy9 s THR 144 Cb 0.03 -2.38 0.35 0.00 1.34 0.00 0.00 72.50 71.85 1qy9 s THR 144 CO 0.12 0.00 2.06 -0.33 -0.54 0.00 0.00 174.62 175.93 1qy9 h GLU 145 N 1.63 0.00 0.00 3.99 4.39 -1.96 -1.15 114.58 121.48 1qy9 h GLU 145 Ca -0.40 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.30 1qy9 h GLU 145 Cb 1.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 1qy9 h GLU 145 CO 0.68 0.00 0.00 0.22 -1.16 0.00 0.00 179.01 178.75 1qy9 h ASP 146 N 0.00 0.00 0.38 1.42 3.58 -2.03 -2.81 116.42 116.95 1qy9 h ASP 146 Ca 0.14 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.59 1qy9 h ASP 146 Cb 0.62 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.67 1qy9 h ASP 146 CO -0.00 0.00 -1.24 0.47 -2.88 0.00 0.00 179.24 175.58 1qy9 n ASP 147 N -2.60 0.54 -4.80 2.28 8.00 -0.43 -4.93 116.55 114.60 1qy9 n ASP 147 Ca -0.02 -0.15 -0.38 0.00 0.71 0.00 0.00 54.79 54.95 1qy9 n ASP 147 Cb 0.06 1.04 -0.06 0.00 -0.02 0.00 0.00 41.12 42.14 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 -3.28 4.56 0.00 0.53 -1.09 -1.06 -1.17 121.20 119.68 1qy9 s ILE 148 Ca 0.01 1.39 -0.32 0.00 -2.23 0.00 0.00 60.65 59.49 1qy9 s ILE 148 Cb 0.14 -3.96 -0.10 0.00 -1.58 0.00 0.00 42.46 36.96 1qy9 s ILE 148 CO 0.83 0.40 1.91 -0.11 -1.23 0.00 0.00 174.94 176.74 1qy9 n LEU 149 N 1.26 3.86 -4.65 2.97 7.94 -0.51 -4.63 117.00 123.24 1qy9 n LEU 149 Ca -0.06 0.94 -0.46 0.00 -1.11 0.00 0.00 56.01 55.33 1qy9 n LEU 149 Cb 0.50 -1.47 -0.03 0.00 0.53 0.00 0.00 43.42 42.95 1qy9 n LEU 149 CO 0.44 0.09 0.94 -2.65 -1.11 0.00 0.00 177.39 175.10 1qy9 n PRO 150 N 6.86 1.80 -1.00 1.96 -0.02 -1.26 -2.76 135.00 140.58 1qy9 n PRO 150 Ca 0.21 0.64 -0.00 0.00 -2.02 0.00 0.00 63.50 62.33 1qy9 n PRO 150 Cb 0.36 -2.26 -0.00 0.00 -0.02 0.00 0.00 33.50 31.58 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 2.17 0.35 3.41 -1.23 0.00 -1.26 -5.00 105.19 103.63 1qy9 n GLY 151 Ca 0.13 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.04 2.43 0.47 0.99 1.43 -1.11 -5.12 118.68 117.72 1qy9 s LEU 152 Ca 0.00 -0.46 -0.10 0.00 -1.03 0.00 0.00 54.13 52.55 1qy9 s LEU 152 Cb 0.00 -1.43 -0.05 0.00 0.03 0.00 0.00 46.19 44.73 1qy9 s LEU 152 CO 0.00 0.27 0.84 -2.16 0.23 0.00 0.00 176.35 175.53 1qy9 s PRO 153 N -1.21 3.71 -0.13 1.29 0.04 -1.26 -4.87 135.00 132.57 1qy9 s PRO 153 Ca 0.13 0.50 -0.19 0.00 0.04 0.00 0.00 61.00 61.48 1qy9 s PRO 153 Cb -0.10 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 1qy9 s PRO 153 CO 0.03 -0.19 0.51 0.42 0.04 0.00 0.00 177.00 177.81 1qy9 s ILE 154 N -2.62 5.16 -0.22 0.56 1.01 -1.26 -4.60 121.20 119.22 1qy9 s ILE 154 Ca 0.52 1.01 -0.27 0.00 0.00 0.00 0.00 60.65 61.91 1qy9 s ILE 154 Cb -0.10 -3.85 0.10 0.00 0.01 0.00 0.00 42.46 38.62 1qy9 s ILE 154 CO 0.38 0.29 0.90 -1.58 0.00 0.00 0.00 174.94 174.93 1qy9 s GLN 155 N 0.85 0.68 -0.01 2.79 0.74 -1.26 -1.24 119.66 122.21 1qy9 s GLN 155 Ca 0.27 0.56 -0.30 0.00 0.05 0.00 0.00 55.36 55.94 1qy9 s GLN 155 Cb -0.15 0.33 -0.03 0.00 1.10 0.00 0.00 33.01 34.25 1qy9 s GLN 155 CO 0.11 -0.13 1.07 0.08 -0.55 0.00 0.00 175.29 175.87 1qy9 s VAL 156 N -0.20 4.55 0.15 1.34 1.01 -1.26 -4.49 120.40 121.50 1qy9 s VAL 156 Ca -0.01 1.83 0.07 0.00 0.00 0.00 0.00 61.98 63.88 1qy9 s VAL 156 Cb -0.03 -4.18 -0.04 0.00 0.00 0.00 0.00 36.38 32.13 1qy9 s VAL 156 CO -0.01 0.10 -0.16 0.00 0.00 0.00 0.00 175.10 175.03 1qy9 s ALA 157 N 1.39 1.75 0.00 5.51 0.00 -0.09 -1.54 121.76 128.78 1qy9 s ALA 157 Ca 0.54 -1.41 -0.21 0.00 0.00 0.00 0.00 51.96 50.88 1qy9 s ALA 157 Cb -0.23 -0.12 0.04 0.00 0.00 0.00 0.00 23.12 22.81 1qy9 s ALA 157 CO 0.26 0.15 0.45 -0.08 0.00 0.00 0.00 175.76 176.54 1qy9 s THR 158 N -2.21 0.04 -0.07 0.00 -1.32 -0.21 -1.35 115.64 110.52 1qy9 s THR 158 Ca 0.13 -0.33 0.17 0.00 -1.21 0.00 0.00 61.69 60.45 1qy9 s THR 158 Cb -0.05 -0.85 0.35 0.00 -1.51 0.00 0.00 72.50 70.44 1qy9 s THR 158 CO 0.05 -0.18 1.15 0.35 -2.21 0.00 0.00 174.62 173.78 1qy9 n THR 159 N 0.85 0.79 0.00 5.08 -2.24 -1.26 -1.22 114.28 116.28 1qy9 n THR 159 Ca -0.20 -1.59 0.00 0.00 -2.27 0.00 0.00 64.05 60.00 1qy9 n THR 159 Cb 0.58 0.46 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 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 -0.21 3.24 2.80 3.38 0.00 -1.26 -0.97 105.19 112.15 1qy9 n GLY 160 Ca 0.10 -0.48 -0.29 0.00 0.00 0.00 0.00 46.02 45.34 1qy9 n GLY 160 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1qy9 s HIS 161 N 0.00 1.71 0.43 1.61 3.76 -1.26 -5.12 115.29 116.43 1qy9 s HIS 161 Ca 0.00 -1.47 -0.23 0.00 -0.15 0.00 0.00 55.06 53.21 1qy9 s HIS 161 Cb 0.00 -1.48 -0.08 0.00 1.11 0.00 0.00 32.58 32.13 1qy9 s HIS 161 CO 0.00 -0.76 1.10 -1.54 -0.85 0.00 0.00 174.74 172.69 1qy9 s SER 162 N 1.62 6.47 0.08 1.40 1.04 -1.26 -4.80 113.70 118.26 1qy9 s SER 162 Ca 0.02 2.14 0.02 0.00 0.48 0.00 0.00 55.95 58.61 1qy9 s SER 162 Cb -0.18 -2.59 -0.04 0.00 0.10 0.00 0.00 66.02 63.32 1qy9 s SER 162 CO -0.13 -0.70 -0.07 -0.54 0.98 0.00 0.00 173.24 172.78 1qy9 s LYS 163 N -2.65 0.76 0.00 4.02 -0.14 -0.46 -4.49 119.74 116.78 1qy9 s LYS 163 Ca 0.61 -1.16 0.00 0.00 -1.36 0.00 0.00 55.97 54.06 1qy9 s LYS 163 Cb -0.24 -0.28 0.00 0.00 -1.68 0.00 0.00 37.83 35.63 1qy9 s LYS 163 CO 0.30 0.02 0.00 0.28 -0.76 0.00 0.00 175.35 175.18 1qy9 n VAL 164 N 0.44 0.00 0.00 3.17 0.31 0.11 -0.91 118.33 121.45 1qy9 n VAL 164 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1qy9 n VAL 164 Cb 0.59 -1.77 0.00 0.00 -0.91 0.00 0.00 33.84 31.74 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 -0.38 0.00 -2.56 2.52 5.41 -0.94 -0.67 119.36 122.74 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 4.29 0.12 0.38 0.04 -1.26 -1.91 135.00 136.66 1qy9 s PRO 167 Ca 0.00 1.50 0.06 0.00 0.04 0.00 0.00 61.00 62.60 1qy9 s PRO 167 Cb 0.00 -3.65 -0.04 0.00 0.04 0.00 0.00 34.50 30.85 1qy9 s PRO 167 CO 0.00 -0.57 -0.02 -0.51 0.04 0.00 0.00 177.00 175.94 1qy9 s LEU 168 N 2.93 3.33 0.62 -3.56 1.43 0.05 -1.43 118.68 122.06 1qy9 s LEU 168 Ca 0.50 -0.29 -0.18 0.00 -1.03 0.00 0.00 54.13 53.13 1qy9 s LEU 168 Cb -0.19 -2.05 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 1qy9 s LEU 168 CO 0.13 0.15 1.19 -0.54 0.23 0.00 0.00 176.35 177.51 1qy9 s LYS 169 N -2.51 2.84 0.62 1.70 1.02 -0.32 -4.48 119.74 118.63 1qy9 s LYS 169 Ca 0.25 1.76 0.37 0.00 0.02 0.00 0.00 55.97 58.38 1qy9 s LYS 169 Cb -0.11 -1.92 2.08 0.00 -0.52 0.00 0.00 37.83 37.36 1qy9 s LYS 169 CO 0.17 -1.29 2.29 -1.00 -0.92 0.00 0.00 175.35 174.61 1qy9 h PRO 170 N 0.63 0.00 0.00 -1.68 0.13 -1.91 -2.29 132.00 126.88 1qy9 h PRO 170 Ca -0.50 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.60 1qy9 h PRO 170 Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 1qy9 h PRO 170 CO 0.54 0.01 -0.18 0.93 -0.23 0.00 0.00 178.00 179.08 1qy9 h GLU 171 N 0.00 0.00 -6.65 0.86 3.07 -1.95 -3.44 114.58 106.48 1qy9 h GLU 171 Ca -0.00 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 58.33 1qy9 h GLU 171 Cb 0.05 0.00 0.04 0.00 -0.84 0.00 0.00 28.75 28.00 1qy9 h GLU 171 CO 0.00 0.18 0.75 0.08 -1.40 0.00 0.00 179.01 178.62 1qy9 s VAL 172 N -3.64 2.96 -0.94 3.13 1.01 -0.86 -4.94 120.40 117.12 1qy9 s VAL 172 Ca 0.01 0.74 -0.22 0.00 0.00 0.00 0.00 61.98 62.52 1qy9 s VAL 172 Cb 0.10 -3.48 0.08 0.00 0.00 0.00 0.00 36.38 33.08 1qy9 s VAL 172 CO 0.62 0.09 1.28 -0.62 0.00 0.00 0.00 175.10 176.47 1qy9 s ASP 173 N 0.72 6.51 0.37 3.32 -1.08 -1.26 -4.86 116.67 120.39 1qy9 s ASP 173 Ca 0.62 -1.59 0.10 0.00 -0.52 0.00 0.00 52.55 51.17 1qy9 s ASP 173 Cb -0.40 -2.49 0.73 0.00 -1.46 0.00 0.00 42.92 39.30 1qy9 s ASP 173 CO 0.36 -1.35 1.86 -0.29 0.52 0.00 0.00 175.17 176.27 1qy9 h ILE 174 N 6.32 1.22 0.00 4.11 2.10 -1.93 -2.06 117.51 127.27 1qy9 h ILE 174 Ca 0.12 -1.05 -0.00 0.00 1.08 0.00 0.00 64.86 65.01 1qy9 h ILE 174 Cb 1.02 1.46 -0.00 0.00 -1.09 0.00 0.00 36.82 38.21 1qy9 h ILE 174 CO 1.28 0.31 -0.02 0.44 -1.08 0.00 0.00 178.15 179.08 1qy9 h ASP 175 N 0.13 0.00 1.25 2.19 5.19 -2.00 -2.71 116.42 120.47 1qy9 h ASP 175 Ca 0.02 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 1qy9 h ASP 175 Cb 0.53 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.04 1qy9 h ASP 175 CO 0.04 0.02 -0.26 0.00 -3.12 0.00 0.00 179.24 175.92 1qy9 h ALA 176 N 1.98 0.83 -2.10 3.45 0.00 -1.78 -3.47 119.26 118.17 1qy9 h ALA 176 Ca -0.00 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 1qy9 h ALA 176 Cb 0.36 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.21 1qy9 h ALA 176 CO 0.00 0.00 0.76 1.28 0.00 0.00 0.00 179.25 181.29 1qy9 n LEU 177 N -2.25 2.80 -3.46 0.00 4.77 -1.02 -4.93 117.00 112.91 1qy9 n LEU 177 Ca 0.04 1.08 -0.28 0.00 -0.03 0.00 0.00 56.01 56.82 1qy9 n LEU 177 Cb 0.44 -1.36 -0.11 0.00 -2.33 0.00 0.00 43.42 40.05 1qy9 n LEU 177 CO 0.33 -0.43 -0.31 -0.55 -1.33 0.00 0.00 177.39 175.10 1qy9 s SER 178 N 1.23 2.56 0.60 -1.43 0.15 -1.26 -5.11 113.70 110.44 1qy9 s SER 178 Ca 0.82 -2.48 -0.16 0.00 0.70 0.00 0.00 55.95 54.82 1qy9 s SER 178 Cb -0.75 -0.45 -0.03 0.00 -1.71 0.00 0.00 66.02 63.08 1qy9 s SER 178 CO 0.42 -0.26 1.09 -2.84 1.20 0.00 0.00 173.24 172.85 1qy9 s PRO 179 N 0.71 3.15 -0.67 5.44 0.02 -1.26 -4.90 135.00 137.48 1qy9 s PRO 179 Ca 0.22 1.37 -0.26 0.00 0.02 0.00 0.00 61.00 62.36 1qy9 s PRO 179 Cb -0.15 -2.00 -0.04 0.00 0.02 0.00 0.00 34.50 32.33 1qy9 s PRO 179 CO -0.05 -0.97 1.98 0.34 -0.33 0.00 0.00 177.00 177.97 1qy9 s ASP 180 N -2.45 5.06 0.38 2.53 -1.08 -0.19 -4.86 116.67 116.05 1qy9 s ASP 180 Ca 0.67 0.18 0.11 0.00 -0.52 0.00 0.00 52.55 52.99 1qy9 s ASP 180 Cb -0.19 -2.53 0.75 0.00 -1.46 0.00 0.00 42.92 39.48 1qy9 s ASP 180 CO 0.36 -2.61 1.87 -0.07 0.52 0.00 0.00 175.17 175.23 1qy9 h LEU 181 N 17.51 0.12 -0.24 -1.34 3.38 -1.92 -2.16 115.31 130.67 1qy9 h LEU 181 Ca -0.16 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.71 1qy9 h LEU 181 Cb 1.13 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1qy9 h LEU 181 CO 1.20 0.39 -0.10 0.78 0.09 0.00 0.00 178.44 180.79 1qy9 h ASN 182 N 0.11 0.50 -0.44 -0.43 2.35 -1.99 -1.80 115.58 113.88 1qy9 h ASN 182 Ca 0.02 -0.40 0.05 0.00 -0.55 0.00 0.00 56.30 55.42 1qy9 h ASN 182 Cb 0.53 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 38.71 1qy9 h ASN 182 CO 0.04 0.79 0.18 0.00 -1.65 0.00 0.00 177.43 176.78 1qy9 h ALA 183 N 0.73 0.53 -0.79 -0.83 0.00 -1.90 -0.82 119.26 116.19 1qy9 h ALA 183 Ca 0.06 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1qy9 h ALA 183 Cb 0.59 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 1qy9 h ALA 183 CO 0.03 -0.20 0.53 -0.07 0.00 0.00 0.00 179.25 179.53 1qy9 h LEU 184 N 0.36 0.91 -0.47 0.00 3.38 -1.39 -0.93 115.31 117.16 1qy9 h LEU 184 Ca 0.20 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 1qy9 h LEU 184 Cb 0.17 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1qy9 h LEU 184 CO -0.18 0.65 0.11 0.74 0.09 0.00 0.00 178.44 179.85 1qy9 h THR 185 N 1.07 1.24 -0.51 0.22 2.02 -0.67 -0.84 112.91 115.44 1qy9 h THR 185 Ca 0.29 -0.84 -0.06 0.00 0.77 0.00 0.00 66.41 66.57 1qy9 h THR 185 Cb -0.12 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 1qy9 h THR 185 CO -0.06 0.30 0.06 0.00 0.37 0.00 0.00 175.52 176.18 1qy9 h ALA 186 N 0.98 1.14 -0.32 6.16 0.00 -0.74 -2.62 119.26 123.86 1qy9 h ALA 186 Ca 0.15 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1qy9 h ALA 186 Cb 0.33 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1qy9 h ALA 186 CO 0.00 0.56 -0.36 0.82 0.00 0.00 0.00 179.25 180.28 1qy9 h ILE 187 N 0.77 1.28 -0.98 0.00 2.04 -1.01 -2.91 117.51 116.70 1qy9 h ILE 187 Ca 0.16 -1.52 0.03 0.00 1.00 0.00 0.00 64.86 64.53 1qy9 h ILE 187 Cb 0.38 1.42 -0.05 0.00 -0.74 0.00 0.00 36.82 37.83 1qy9 h ILE 187 CO 0.01 0.49 0.65 0.28 0.00 0.00 0.00 178.15 179.58 1qy9 h SER 188 N 0.61 1.09 -0.01 1.72 0.02 -0.85 -2.13 113.55 114.00 1qy9 h SER 188 Ca 0.06 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1qy9 h SER 188 Cb 0.89 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 63.17 1qy9 h SER 188 CO 0.08 0.77 0.00 0.11 -1.14 0.00 0.00 176.83 176.65 1qy9 h LYS 189 N 1.28 0.01 -0.02 3.45 1.57 -1.30 -2.32 116.57 119.23 1qy9 h LYS 189 Ca 0.38 -0.00 0.02 0.00 -1.87 0.00 0.00 60.65 59.18 1qy9 h LYS 189 Cb -0.05 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 1qy9 h LYS 189 CO -0.11 0.21 -0.13 0.87 -0.57 0.00 0.00 179.45 179.73 1qy9 h LYS 190 N -0.19 -0.19 -0.00 3.15 1.79 -1.32 -3.27 116.57 116.53 1qy9 h LYS 190 Ca 0.00 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1qy9 h LYS 190 Cb 0.20 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.90 1qy9 h LYS 190 CO -0.00 -0.13 -0.45 0.44 -1.08 0.00 0.00 179.45 178.24 1qy9 n ILE 191 N -5.26 0.00 -2.40 1.86 -5.35 -0.82 -4.96 119.36 102.43 1qy9 n ILE 191 Ca -0.05 -0.02 -0.06 0.00 -0.27 0.00 0.00 62.75 62.34 1qy9 n ILE 191 Cb 0.18 0.26 0.01 0.00 -1.74 0.00 0.00 39.64 38.35 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 0.29 2.94 3.28 0.00 -0.89 -5.05 105.19 107.23 1qy9 n GLY 192 Ca 0.07 -0.55 -0.13 0.00 0.00 0.00 0.00 46.02 45.41 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 4.02 3.77 -3.76 0.00 3.02 -1.26 -4.37 115.26 116.67 1qy9 n ASN 194 Ca -0.24 -2.00 -0.13 0.00 -0.03 0.00 0.00 54.58 52.18 1qy9 n ASN 194 Cb 0.53 -0.40 -0.11 0.00 -0.61 0.00 0.00 39.78 39.19 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 -1.19 -0.21 -0.11 7.41 0.00 -1.26 -4.41 107.32 107.56 1qy9 s GLY 195 Ca 0.45 0.87 0.02 0.00 0.00 0.00 0.00 44.72 46.06 1qy9 s GLY 195 CO 0.33 0.83 -0.17 -1.36 0.00 0.00 0.00 173.10 172.73 1qy9 s PHE 196 N 0.38 2.70 -0.59 1.90 0.40 -0.18 -0.71 117.98 121.89 1qy9 s PHE 196 Ca -0.02 -0.69 0.05 0.00 -0.60 0.00 0.00 56.93 55.67 1qy9 s PHE 196 Cb -0.04 -1.76 0.18 0.00 0.51 0.00 0.00 43.02 41.91 1qy9 s PHE 196 CO -0.02 -0.22 0.47 0.34 0.70 0.00 0.00 175.22 176.49 1qy9 n PHE 197 N 3.33 1.68 -1.93 0.36 7.35 0.15 -0.92 117.46 127.49 1qy9 n PHE 197 Ca -0.18 -3.92 -0.41 0.00 -0.76 0.00 0.00 57.45 52.17 1qy9 n PHE 197 Cb 0.53 -0.30 -0.02 0.00 0.35 0.00 0.00 39.48 40.03 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 -1.03 4.22 0.11 -7.13 0.04 -1.17 -2.21 135.00 127.82 1qy9 s PRO 198 Ca 0.29 2.40 -0.15 0.00 0.04 0.00 0.00 61.00 63.59 1qy9 s PRO 198 Cb 0.01 -3.07 0.03 0.00 0.04 0.00 0.00 34.50 31.51 1qy9 s PRO 198 CO -0.16 -0.48 0.35 -0.59 0.04 0.00 0.00 177.00 176.16 1qy9 s PHE 199 N -0.19 -0.13 0.12 0.56 -0.71 -0.80 -1.54 117.98 115.29 1qy9 s PHE 199 Ca 0.59 -0.18 -0.00 0.00 -1.04 0.00 0.00 56.93 56.30 1qy9 s PHE 199 Cb -0.44 0.18 -0.04 0.00 -1.21 0.00 0.00 43.02 41.51 1qy9 s PHE 199 CO 0.47 -0.65 0.02 1.14 -1.34 0.00 0.00 175.22 174.87 1qy9 s GLN 200 N -3.65 0.90 -0.15 1.99 -2.07 0.33 -0.77 119.66 116.24 1qy9 s GLN 200 Ca 0.02 -1.42 -0.04 0.00 -1.82 0.00 0.00 55.36 52.11 1qy9 s GLN 200 Cb 0.02 0.11 -0.03 0.00 -1.09 0.00 0.00 33.01 32.02 1qy9 s GLN 200 CO -0.11 -0.20 -0.02 0.42 -1.32 0.00 0.00 175.29 174.07 1qy9 s ILE 201 N -3.93 4.07 0.10 3.63 1.01 -1.26 -1.20 121.20 123.62 1qy9 s ILE 201 Ca 0.20 -0.30 -0.31 0.00 0.00 0.00 0.00 60.65 60.25 1qy9 s ILE 201 Cb 0.07 -2.79 -0.08 0.00 0.01 0.00 0.00 42.46 39.67 1qy9 s ILE 201 CO -0.00 0.50 1.51 -0.13 0.00 0.00 0.00 174.94 176.82 1qy9 s ARG 202 N 0.26 4.25 -0.13 2.79 0.52 -0.35 -4.67 118.95 121.63 1qy9 s ARG 202 Ca -0.02 2.21 -0.38 0.00 -0.52 0.00 0.00 55.73 57.02 1qy9 s ARG 202 Cb -0.14 -3.37 -0.16 0.00 0.52 0.00 0.00 34.95 31.81 1qy9 s ARG 202 CO 0.02 -0.59 1.62 -2.30 0.02 0.00 0.00 175.30 174.08 1qy9 n PRO 203 N 4.62 1.28 -1.02 3.54 -0.02 -1.26 -1.65 135.00 140.48 1qy9 n PRO 203 Ca 0.14 0.47 -0.01 0.00 -2.02 0.00 0.00 63.50 62.07 1qy9 n PRO 203 Cb 0.41 -2.15 -0.00 0.00 -0.02 0.00 0.00 33.50 31.73 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 3.65 0.43 3.11 -1.23 0.00 -1.26 -5.01 105.19 104.88 1qy9 n GLY 204 Ca 0.23 -0.11 -0.16 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.84 0.68 -1.49 1.61 1.02 -0.66 -5.05 119.74 115.02 1qy9 s LYS 205 Ca 0.00 -0.80 -0.09 0.00 0.02 0.00 0.00 55.97 55.10 1qy9 s LYS 205 Cb 0.00 -0.58 0.01 0.00 -0.52 0.00 0.00 37.83 36.73 1qy9 s LYS 205 CO 0.00 0.13 2.63 0.09 -0.92 0.00 0.00 175.35 177.27 1qy9 n ASN 206 N 1.54 7.71 -3.80 2.83 4.13 -1.26 -4.47 115.26 121.94 1qy9 n ASN 206 Ca -0.21 -2.81 -0.12 0.00 1.68 0.00 0.00 54.58 53.11 1qy9 n ASN 206 Cb 0.55 -1.51 -0.11 0.00 -1.54 0.00 0.00 39.78 37.17 1qy9 n ASN 206 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1qy9 s GLU 207 N 1.16 0.36 0.17 3.52 2.02 -1.26 -1.86 118.70 122.81 1qy9 s GLU 207 Ca 0.60 0.13 0.06 0.00 0.02 0.00 0.00 54.97 55.78 1qy9 s GLU 207 Cb 0.17 0.17 -0.04 0.00 0.10 0.00 0.00 34.13 34.52 1qy9 s GLU 207 CO -0.07 -0.07 -0.13 0.95 0.02 0.00 0.00 175.26 175.96 1qy9 s THR 208 N -0.34 1.50 -0.08 3.63 -4.23 -0.54 -1.21 115.64 114.37 1qy9 s THR 208 Ca -0.04 -2.05 0.03 0.00 -1.18 0.00 0.00 61.69 58.45 1qy9 s THR 208 Cb -0.03 -1.87 0.01 0.00 1.34 0.00 0.00 72.50 71.95 1qy9 s THR 208 CO 0.01 -0.58 -0.19 -1.81 -0.54 0.00 0.00 174.62 171.51 1qy9 s ASP 209 N -3.05 2.54 0.11 3.99 1.01 -0.34 -0.20 116.67 120.73 1qy9 s ASP 209 Ca 0.17 -0.45 -0.02 0.00 0.71 0.00 0.00 52.55 52.97 1qy9 s ASP 209 Cb -0.01 -1.15 -0.04 0.00 1.01 0.00 0.00 42.92 42.73 1qy9 s ASP 209 CO 0.04 0.11 0.05 -0.83 0.21 0.00 0.00 175.17 174.75 1qy9 s GLY 210 N 0.46 0.80 0.00 0.21 0.00 -0.47 -0.51 107.32 107.80 1qy9 s GLY 210 Ca -0.17 -1.35 0.00 0.00 0.00 0.00 0.00 44.72 43.20 1qy9 s GLY 210 CO 0.07 -1.31 0.00 0.54 0.00 0.00 0.00 173.10 172.40 1qy9 n ARG 211 N -0.04 0.44 0.00 2.90 1.74 -0.59 -3.99 116.66 117.12 1qy9 n ARG 211 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 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 -2.87 -1.55 3.72 -0.09 -3.06 117.46 113.60 1qy9 n PHE 213 Ca 0.00 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.27 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 1.29 0.27 4.37 3.41 -1.01 -1.02 113.62 120.94 1qy9 n SER 214 Ca 0.00 -2.86 0.10 0.00 -0.26 0.00 0.00 58.87 55.85 1qy9 n SER 214 Cb 0.00 -0.57 0.72 0.00 -0.26 0.00 0.00 64.21 64.11 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 2.99 0.00 0.00 4.33 0.13 -1.73 -2.60 132.00 135.12 1qy9 h PRO 215 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1qy9 h PRO 215 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1qy9 h PRO 215 CO 0.51 0.03 0.00 0.00 -0.23 0.00 0.00 178.00 178.31 1qy9 n ALA 216 N -2.45 1.39 -1.59 -0.56 0.00 -1.26 -2.18 120.51 113.86 1qy9 n ALA 216 Ca -0.03 -0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.44 1qy9 n ALA 216 Cb 0.12 -1.13 0.12 0.00 0.00 0.00 0.00 19.45 18.55 1qy9 n ALA 216 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1qy9 n ILE 217 N -1.48 1.43 -1.00 0.00 -5.35 -0.99 -5.00 119.36 106.97 1qy9 n ILE 217 Ca 0.02 -2.05 0.00 0.00 -0.27 0.00 0.00 62.75 60.45 1qy9 n ILE 217 Cb 0.09 0.05 0.00 0.00 -1.74 0.00 0.00 39.64 38.05 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 -0.83 0.54 2.99 3.28 0.00 -0.93 -5.00 105.19 105.24 1qy9 n GLY 218 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.22 2.33 0.13 -0.61 1.01 -1.17 -5.01 121.20 115.66 1qy9 s ILE 219 Ca 0.00 -2.63 -0.29 0.00 0.00 0.00 0.00 60.65 57.73 1qy9 s ILE 219 Cb 0.00 -2.69 -0.06 0.00 0.01 0.00 0.00 42.46 39.72 1qy9 s ILE 219 CO 0.00 -0.67 1.59 0.58 0.00 0.00 0.00 174.94 176.44 1qy9 h VAL 220 N 6.25 0.18 -3.33 2.92 2.07 -1.89 -2.68 116.25 119.77 1qy9 h VAL 220 Ca -0.05 0.00 -0.27 0.00 0.82 0.00 0.00 66.70 67.20 1qy9 h VAL 220 Cb 0.98 0.18 -0.33 0.00 -1.52 0.00 0.00 31.29 30.60 1qy9 h VAL 220 CO 0.57 0.00 -0.65 -0.70 0.02 0.00 0.00 177.57 176.81 1qy9 s GLU 221 N -5.92 0.04 -0.11 1.57 2.12 -1.26 -2.39 118.70 112.76 1qy9 s GLU 221 Ca -0.16 0.32 -0.13 0.00 0.36 0.00 0.00 54.97 55.36 1qy9 s GLU 221 Cb 0.09 -0.21 -0.05 0.00 0.26 0.00 0.00 34.13 34.22 1qy9 s GLU 221 CO 0.64 -0.18 0.31 0.34 -0.54 0.00 0.00 175.26 175.84 1qy9 s ASP 222 N 1.21 6.54 0.09 -1.70 2.15 -1.26 -5.02 116.67 118.68 1qy9 s ASP 222 Ca -0.08 0.64 -0.18 0.00 0.43 0.00 0.00 52.55 53.36 1qy9 s ASP 222 Cb -0.12 -2.19 -0.07 0.00 -0.30 0.00 0.00 42.92 40.24 1qy9 s ASP 222 CO -0.05 0.20 1.54 1.55 -0.17 0.00 0.00 175.17 178.24 1qy9 h PRO 223 N 5.88 0.48 -2.55 4.34 0.13 -1.91 -3.44 132.00 134.93 1qy9 h PRO 223 Ca -0.46 -0.15 -0.18 0.00 -0.87 0.00 0.00 66.00 64.34 1qy9 h PRO 223 Cb 1.19 -0.05 -0.31 0.00 0.13 0.00 0.00 31.00 31.97 1qy9 h PRO 223 CO 0.69 0.63 -0.48 0.08 -0.23 0.00 0.00 178.00 178.69 1qy9 s VAL 224 N -5.02 -0.51 -0.32 1.56 1.01 -1.26 -2.31 120.40 113.55 1qy9 s VAL 224 Ca -0.13 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.02 1qy9 s VAL 224 Cb 0.08 -0.60 0.10 0.00 0.00 0.00 0.00 36.38 35.95 1qy9 s VAL 224 CO 0.75 0.03 0.04 -0.89 0.00 0.00 0.00 175.10 175.03 1qy9 s THR 225 N 2.49 2.02 0.51 3.92 2.01 -1.26 -4.87 115.64 120.47 1qy9 s THR 225 Ca 0.03 -2.10 0.21 0.00 0.31 0.00 0.00 61.69 60.14 1qy9 s THR 225 Cb -0.13 -2.46 0.34 0.00 0.01 0.00 0.00 72.50 70.26 1qy9 s THR 225 CO -0.11 -0.55 2.05 1.23 -0.69 0.00 0.00 174.62 176.55 1qy9 h GLY 226 N 7.71 0.08 2.00 4.40 0.00 -1.98 -1.81 103.07 113.47 1qy9 h GLY 226 Ca -0.07 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1qy9 h GLY 226 CO 0.50 0.02 0.00 0.70 0.00 0.00 0.00 176.54 177.76 1qy9 n ASN 227 N -4.44 0.22 -0.12 0.19 5.03 -1.26 -1.73 115.26 113.15 1qy9 n ASN 227 Ca 0.05 0.54 -0.22 0.00 0.87 0.00 0.00 54.58 55.82 1qy9 n ASN 227 Cb 0.40 -0.59 -0.10 0.00 -1.02 0.00 0.00 39.78 38.47 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 -1.58 1.44 0.04 5.41 0.00 -0.75 -4.44 120.51 120.63 1qy9 n ALA 228 Ca 0.05 -0.99 -0.05 0.00 0.00 0.00 0.00 53.44 52.45 1qy9 n ALA 228 Cb 0.28 0.08 0.16 0.00 0.00 0.00 0.00 19.45 19.97 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 -0.50 0.41 0.46 0.00 2.35 -1.39 -3.23 115.58 113.68 1qy9 h ASN 229 Ca -0.58 -0.18 -0.02 0.00 -0.55 0.00 0.00 56.30 54.97 1qy9 h ASN 229 Cb 1.67 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 39.92 1qy9 h ASN 229 CO -0.25 0.78 -0.31 1.23 -1.65 0.00 0.00 177.43 177.24 1qy9 h GLY 230 N 1.16 -0.96 -3.87 2.83 0.00 -1.58 -1.69 103.07 98.95 1qy9 h GLY 230 Ca 0.03 0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.76 1qy9 h GLY 230 CO 0.07 -0.32 0.00 -1.05 0.00 0.00 0.00 176.54 175.24 1qy9 n PRO 231 N -4.25 0.00 0.00 4.80 -0.02 -1.22 -2.51 135.00 131.80 1qy9 n PRO 231 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 1qy9 n PRO 231 Cb 0.31 -1.30 0.00 0.00 -0.02 0.00 0.00 33.50 32.49 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 1.65 0.00 0.23 -1.23 0.00 -0.64 -0.62 105.19 104.58 1qy9 n GLY 233 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 0.67 -0.82 4.61 0.00 -1.78 -2.65 119.26 119.29 1qy9 h ALA 234 Ca 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.83 1qy9 h ALA 234 Cb 0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.54 1qy9 h ALA 234 CO 0.00 0.22 0.54 2.35 0.00 0.00 0.00 179.25 182.36 1qy9 h TRP 235 N 0.69 0.99 -0.64 0.00 7.01 -1.16 0.10 115.95 122.95 1qy9 h TRP 235 Ca 0.18 0.02 -0.08 0.00 2.11 0.00 0.00 58.89 61.12 1qy9 h TRP 235 Cb 0.09 -0.33 -0.03 0.00 -2.10 0.00 0.00 29.16 26.80 1qy9 h TRP 235 CO -0.01 0.59 0.08 -0.07 -2.79 0.00 0.00 178.44 176.24 1qy9 h LEU 236 N 1.04 1.02 -0.12 0.65 3.38 -1.73 -1.33 115.31 118.22 1qy9 h LEU 236 Ca 0.32 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1qy9 h LEU 236 Cb -0.00 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.47 1qy9 h LEU 236 CO -0.09 1.03 -0.06 0.58 0.09 0.00 0.00 178.44 179.99 1qy9 h VAL 237 N 0.99 1.32 -0.91 1.22 2.07 -1.17 -1.23 116.25 118.54 1qy9 h VAL 237 Ca 0.19 -1.09 0.15 0.00 0.82 0.00 0.00 66.70 66.78 1qy9 h VAL 237 Cb 0.45 1.79 -0.07 0.00 -1.52 0.00 0.00 31.29 31.95 1qy9 h VAL 237 CO 0.02 0.31 0.58 -0.74 0.02 0.00 0.00 177.57 177.76 1qy9 h HIS 238 N -0.11 0.83 -0.37 1.57 -0.00 -0.64 -2.02 115.15 114.41 1qy9 h HIS 238 Ca 0.03 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.42 1qy9 h HIS 238 Cb 0.52 -0.26 0.00 0.00 -0.00 0.00 0.00 27.41 27.67 1qy9 h HIS 238 CO 0.07 0.29 0.00 0.72 -0.00 0.00 0.00 177.93 179.01 1qy9 n HIS 239 N -4.58 1.28 -3.95 5.26 8.25 -0.53 -4.99 115.22 115.95 1qy9 n HIS 239 Ca 0.18 -0.81 -0.25 0.00 -0.26 0.00 0.00 57.72 56.58 1qy9 n HIS 239 Cb 0.49 -0.36 -0.02 0.00 1.12 0.00 0.00 29.99 31.22 1qy9 n HIS 239 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1qy9 n ASN 240 N -0.06 -0.28 -0.01 0.41 5.15 -0.76 -4.88 115.26 114.83 1qy9 n ASN 240 Ca 0.23 -1.01 -0.10 0.00 -0.60 0.00 0.00 54.58 53.10 1qy9 n ASN 240 Cb 0.96 -3.04 -0.14 0.00 -0.53 0.00 0.00 39.78 37.03 1qy9 n ASN 240 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1qy9 h VAL 241 N -1.84 0.90 -3.87 3.44 2.07 -1.53 -3.47 116.25 111.95 1qy9 h VAL 241 Ca -0.63 -2.72 -0.69 0.00 0.82 0.00 0.00 66.70 63.48 1qy9 h VAL 241 Cb 1.38 2.47 -0.21 0.00 -1.52 0.00 0.00 31.29 33.40 1qy9 h VAL 241 CO 0.62 0.57 -0.85 -0.76 0.02 0.00 0.00 177.57 177.18 1qy9 s LEU 242 N -6.26 2.44 0.59 2.57 1.43 -1.26 -5.12 118.68 113.06 1qy9 s LEU 242 Ca -0.06 -0.68 -0.18 0.00 -1.03 0.00 0.00 54.13 52.18 1qy9 s LEU 242 Cb 0.08 -1.33 -0.04 0.00 0.03 0.00 0.00 46.19 44.94 1qy9 s LEU 242 CO 0.82 0.18 1.12 -2.16 0.23 0.00 0.00 176.35 176.54 1qy9 s PRO 243 N -2.05 3.15 0.06 1.29 0.04 -1.26 -5.00 135.00 131.23 1qy9 s PRO 243 Ca 0.15 1.51 -0.27 0.00 0.04 0.00 0.00 61.00 62.44 1qy9 s PRO 243 Cb -0.10 -1.99 0.08 0.00 0.04 0.00 0.00 34.50 32.53 1qy9 s PRO 243 CO 0.07 -0.99 0.67 -3.38 0.04 0.00 0.00 177.00 173.41 1qy9 s HIS 244 N -2.00 -0.56 -0.39 0.56 -3.43 -1.26 -4.94 115.29 103.26 1qy9 s HIS 244 Ca 0.70 0.61 -0.08 0.00 -0.80 0.00 0.00 55.06 55.49 1qy9 s HIS 244 Cb -0.22 0.50 0.07 0.00 -1.43 0.00 0.00 32.58 31.50 1qy9 s HIS 244 CO 0.33 -0.72 0.21 0.34 -2.00 0.00 0.00 174.74 172.89 1qy9 s ASP 245 N -2.12 5.52 0.00 7.38 2.15 -1.26 -5.00 116.67 123.34 1qy9 s ASP 245 Ca -0.03 -1.41 0.00 0.00 0.43 0.00 0.00 52.55 51.54 1qy9 s ASP 245 Cb -0.01 -1.94 0.00 0.00 -0.30 0.00 0.00 42.92 40.67 1qy9 s ASP 245 CO -0.04 -0.47 0.00 0.61 -0.17 0.00 0.00 175.17 175.10 1qy9 n GLY 246 N 4.86 -0.49 2.23 2.66 0.00 -1.26 -4.30 105.19 108.90 1qy9 n GLY 246 Ca -0.10 -1.40 -0.30 0.00 0.00 0.00 0.00 46.02 44.22 1qy9 n GLY 246 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1qy9 n ASN 247 N 0.54 6.76 -3.79 1.61 3.02 -1.26 -4.87 115.26 117.27 1qy9 n ASN 247 Ca 0.00 -3.63 -0.13 0.00 -0.03 0.00 0.00 54.58 50.79 1qy9 n ASN 247 Cb 0.00 -0.96 -0.13 0.00 -0.61 0.00 0.00 39.78 38.08 1qy9 n ASN 247 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1qy9 s VAL 248 N -4.14 -0.01 -0.10 2.41 1.01 -1.26 -1.68 120.40 116.62 1qy9 s VAL 248 Ca 0.58 0.05 0.04 0.00 0.00 0.00 0.00 61.98 62.65 1qy9 s VAL 248 Cb 0.46 -0.26 0.00 0.00 0.00 0.00 0.00 36.38 36.58 1qy9 s VAL 248 CO 0.01 0.02 -0.22 -0.22 0.00 0.00 0.00 175.10 174.69 1qy9 s LEU 249 N 0.43 2.03 -0.12 3.92 2.96 -0.24 -4.29 118.68 123.38 1qy9 s LEU 249 Ca -0.03 -0.53 0.02 0.00 -0.22 0.00 0.00 54.13 53.36 1qy9 s LEU 249 Cb -0.04 -1.34 -0.01 0.00 0.50 0.00 0.00 46.19 45.30 1qy9 s LEU 249 CO -0.02 0.13 -0.18 -0.13 -1.32 0.00 0.00 176.35 174.84 1qy9 s ARG 250 N 0.46 3.24 -0.04 1.98 0.52 -1.26 -1.04 118.95 122.80 1qy9 s ARG 250 Ca -0.17 -0.77 0.03 0.00 -0.52 0.00 0.00 55.73 54.31 1qy9 s ARG 250 Cb -0.17 -2.50 0.00 0.00 0.52 0.00 0.00 34.95 32.80 1qy9 s ARG 250 CO 0.07 0.19 -0.13 0.08 0.02 0.00 0.00 175.30 175.53 1qy9 s VAL 251 N 0.36 1.10 -0.45 3.52 1.01 -0.48 -4.83 120.40 120.62 1qy9 s VAL 251 Ca -0.14 -0.52 -0.21 0.00 0.00 0.00 0.00 61.98 61.11 1qy9 s VAL 251 Cb -0.17 -0.97 0.03 0.00 0.00 0.00 0.00 36.38 35.27 1qy9 s VAL 251 CO 0.07 0.33 0.67 -0.54 0.00 0.00 0.00 175.10 175.63 1qy9 s LYS 252 N 0.22 3.27 -0.21 2.72 1.02 -0.78 -0.74 119.74 125.25 1qy9 s LYS 252 Ca -0.05 -0.41 -0.21 0.00 0.02 0.00 0.00 55.97 55.32 1qy9 s LYS 252 Cb -0.11 -3.97 -0.02 0.00 -0.52 0.00 0.00 37.83 33.20 1qy9 s LYS 252 CO 0.02 -1.07 0.62 0.20 -0.92 0.00 0.00 175.35 174.20 1qy9 s GLY 253 N 2.15 2.00 -0.00 -3.33 0.00 0.56 -1.46 107.32 107.23 1qy9 s GLY 253 Ca 0.23 -0.31 0.01 0.00 0.00 0.00 0.00 44.72 44.64 1qy9 s GLY 253 CO 0.18 1.32 0.03 0.30 0.00 0.00 0.00 173.10 174.93 1qy9 s HIS 254 N 2.01 3.14 -0.00 1.90 3.76 0.72 -1.09 115.29 125.73 1qy9 s HIS 254 Ca 0.28 0.12 -0.25 0.00 -0.15 0.00 0.00 55.06 55.06 1qy9 s HIS 254 Cb -0.16 -1.69 0.05 0.00 1.11 0.00 0.00 32.58 31.90 1qy9 s HIS 254 CO 0.10 0.49 0.55 -1.14 -0.85 0.00 0.00 174.74 173.89 1qy9 s GLN 255 N -1.62 0.98 0.00 1.40 0.74 -1.00 -1.37 119.66 118.79 1qy9 s GLN 255 Ca 0.21 -0.02 0.00 0.00 0.05 0.00 0.00 55.36 55.60 1qy9 s GLN 255 Cb -0.12 0.45 0.00 0.00 1.10 0.00 0.00 33.01 34.45 1qy9 s GLN 255 CO 0.11 -0.32 0.00 0.41 -0.55 0.00 0.00 175.29 174.94 1qy9 n GLY 256 N 0.77 0.68 0.19 2.59 0.00 -0.98 -1.08 105.19 107.37 1qy9 n GLY 256 Ca -0.19 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.75 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 4.34 0.60 0.00 1.61 2.43 -1.88 -0.58 114.38 120.90 1qy9 h ARG 257 Ca 0.00 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1qy9 h ARG 257 Cb 0.00 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1qy9 h ARG 257 CO 0.00 0.47 -0.06 0.00 -1.51 0.00 0.00 179.97 178.87 1qy9 h ALA 258 N 1.09 1.04 -0.00 2.80 0.00 -1.94 -1.93 119.26 120.32 1qy9 h ALA 258 Ca 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1qy9 h ALA 258 Cb 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1qy9 h ALA 258 CO -0.03 0.08 -0.14 1.28 0.00 0.00 0.00 179.25 180.45 1qy9 n LEU 259 N -3.22 0.39 -1.35 0.00 4.77 -0.93 -4.92 117.00 111.75 1qy9 n LEU 259 Ca -0.00 0.09 -0.12 0.00 -0.03 0.00 0.00 56.01 55.95 1qy9 n LEU 259 Cb 0.30 -0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 1qy9 n LEU 259 CO 0.28 0.08 -0.15 0.61 -1.33 0.00 0.00 177.39 176.88 1qy9 n GLY 260 N 1.34 -0.06 2.62 -0.72 0.00 -0.72 -4.95 105.19 102.70 1qy9 n GLY 260 Ca 0.12 -0.39 -0.12 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.17 1.78 -1.63 1.61 1.74 -0.27 -4.71 116.66 113.00 1qy9 n ARG 261 Ca -0.14 -3.58 -0.46 0.00 -0.77 0.00 0.00 57.85 52.90 1qy9 n ARG 261 Cb 0.60 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.48 1qy9 n ARG 261 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1qy9 n ASP 262 N -0.24 2.13 0.00 0.55 9.92 -1.18 -2.66 116.55 125.07 1qy9 n ASP 262 Ca 0.16 1.15 0.00 0.00 -0.53 0.00 0.00 54.79 55.57 1qy9 n ASP 262 Cb 0.79 -1.35 0.00 0.00 -0.64 0.00 0.00 41.12 39.92 1qy9 n ASP 262 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1qy9 n GLY 263 N 1.91 4.68 3.53 0.44 0.00 -0.24 -0.90 105.19 114.60 1qy9 n GLY 263 Ca 0.12 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.13 1qy9 n GLY 263 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qy9 s ILE 265 N -0.28 -0.14 -0.22 -0.61 1.01 -0.25 -2.38 121.20 118.34 1qy9 s ILE 265 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 60.65 60.41 1qy9 s ILE 265 Cb 0.00 -1.00 -0.01 0.00 0.01 0.00 0.00 42.46 41.46 1qy9 s ILE 265 CO 0.00 0.00 0.77 -1.61 0.00 0.00 0.00 174.94 174.10 1qy9 s GLU 266 N 1.66 4.21 -0.20 2.79 0.41 -0.63 -0.32 118.70 126.61 1qy9 s GLU 266 Ca -0.06 0.86 -0.06 0.00 -0.41 0.00 0.00 54.97 55.30 1qy9 s GLU 266 Cb -0.04 -3.62 -0.03 0.00 -1.78 0.00 0.00 34.13 28.67 1qy9 s GLU 266 CO -0.15 -0.41 0.02 0.08 -0.49 0.00 0.00 175.26 174.30 1qy9 s VAL 267 N 2.48 4.12 -0.16 2.63 1.01 0.08 -1.09 120.40 129.48 1qy9 s VAL 267 Ca 0.34 -0.26 -0.01 0.00 0.00 0.00 0.00 61.98 62.05 1qy9 s VAL 267 Cb -0.16 -2.86 -0.01 0.00 0.00 0.00 0.00 36.38 33.35 1qy9 s VAL 267 CO 0.09 0.43 -0.12 -0.89 0.00 0.00 0.00 175.10 174.61 1qy9 s THR 268 N 0.93 2.97 -0.18 3.92 2.01 -0.04 -1.38 115.64 123.86 1qy9 s THR 268 Ca 0.02 -0.67 -0.00 0.00 0.31 0.00 0.00 61.69 61.35 1qy9 s THR 268 Cb -0.14 -2.27 0.04 0.00 0.01 0.00 0.00 72.50 70.14 1qy9 s THR 268 CO 0.02 0.50 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.70 1qy9 s VAL 269 N 0.73 1.29 0.42 3.82 1.01 -0.21 -0.34 120.40 127.11 1qy9 s VAL 269 Ca -0.05 -0.80 -0.16 0.00 0.00 0.00 0.00 61.98 60.97 1qy9 s VAL 269 Cb -0.15 -1.45 -0.09 0.00 0.00 0.00 0.00 36.38 34.69 1qy9 s VAL 269 CO 0.02 0.10 0.87 0.42 0.00 0.00 0.00 175.10 176.51 1qy9 s THR 270 N 1.55 4.58 -0.03 3.92 -4.23 -0.24 -1.08 115.64 120.11 1qy9 s THR 270 Ca -0.01 1.10 0.05 0.00 -1.18 0.00 0.00 61.69 61.66 1qy9 s THR 270 Cb -0.16 -3.66 -0.01 0.00 1.34 0.00 0.00 72.50 70.01 1qy9 s THR 270 CO -0.08 -0.42 -0.19 -0.63 -0.54 0.00 0.00 174.62 172.76 1qy9 s ILE 271 N -2.28 1.56 -0.06 2.99 1.01 -0.68 -0.33 121.20 123.41 1qy9 s ILE 271 Ca 0.57 -0.82 -0.03 0.00 0.00 0.00 0.00 60.65 60.38 1qy9 s ILE 271 Cb -0.10 -1.32 0.04 0.00 0.01 0.00 0.00 42.46 41.09 1qy9 s ILE 271 CO 0.23 0.44 0.14 -0.60 0.00 0.00 0.00 174.94 175.15 1qy9 s ARG 272 N -0.20 0.07 -1.46 2.79 3.52 0.31 -4.85 118.95 119.14 1qy9 s ARG 272 Ca 0.01 0.38 -0.09 0.00 -0.13 0.00 0.00 55.73 55.90 1qy9 s ARG 272 Cb -0.10 -0.20 0.06 0.00 -1.56 0.00 0.00 34.95 33.15 1qy9 s ARG 272 CO 0.01 -0.18 0.89 -0.25 -0.81 0.00 0.00 175.30 174.96 1qy9 n ASP 273 N 4.35 -3.64 -1.93 -2.12 8.00 -1.26 -1.71 116.55 118.24 1qy9 n ASP 273 Ca -0.24 -0.79 -0.16 0.00 0.71 0.00 0.00 54.79 54.31 1qy9 n ASP 273 Cb 0.51 -3.95 -0.04 0.00 -0.02 0.00 0.00 41.12 37.63 1qy9 n ASP 273 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1qy9 n ASN 274 N -2.91 -4.45 -4.26 -2.24 3.02 -1.26 -4.98 115.26 98.18 1qy9 n ASN 274 Ca -0.07 0.25 -0.20 0.00 -0.03 0.00 0.00 54.58 54.54 1qy9 n ASN 274 Cb 0.58 -3.89 -0.11 0.00 -0.61 0.00 0.00 39.78 35.74 1qy9 n ASN 274 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1qy9 s GLN 275 N -4.17 1.08 0.17 3.52 -1.52 -0.69 -4.69 119.66 113.35 1qy9 s GLN 275 Ca 0.00 -1.25 -0.30 0.00 -1.95 0.00 0.00 55.36 51.86 1qy9 s GLN 275 Cb 0.00 -1.05 -0.08 0.00 -0.22 0.00 0.00 33.01 31.66 1qy9 s GLN 275 CO 0.00 0.21 1.30 -1.25 -0.25 0.00 0.00 175.29 175.30 1qy9 s PRO 276 N -2.54 4.39 -0.16 2.91 0.04 -1.26 -0.53 135.00 137.86 1qy9 s PRO 276 Ca 0.09 2.01 -0.13 0.00 0.04 0.00 0.00 61.00 63.01 1qy9 s PRO 276 Cb -0.06 -3.23 -0.06 0.00 0.04 0.00 0.00 34.50 31.19 1qy9 s PRO 276 CO 0.04 -0.27 -0.28 -1.91 0.04 0.00 0.00 177.00 174.62 1qy9 n GLU 277 N 3.02 0.44 -4.54 4.56 2.13 0.55 -4.80 120.64 122.01 1qy9 n GLU 277 Ca 0.07 0.18 -0.22 0.00 0.66 0.00 0.00 57.16 57.85 1qy9 n GLU 277 Cb 0.43 -1.26 -0.16 0.00 0.27 0.00 0.00 31.44 30.73 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 -2.62 1.24 -0.13 5.31 2.20 -1.22 -4.41 119.74 120.10 1qy9 s LYS 278 Ca -0.26 -0.41 0.00 0.00 -0.36 0.00 0.00 55.97 54.95 1qy9 s LYS 278 Cb 0.06 -1.12 -0.01 0.00 -1.51 0.00 0.00 37.83 35.25 1qy9 s LYS 278 CO 0.36 0.16 -0.14 0.08 -0.36 0.00 0.00 175.35 175.45 1qy9 s VAL 279 N 0.15 2.95 0.05 4.02 1.01 -1.26 -1.08 120.40 126.24 1qy9 s VAL 279 Ca -0.03 -0.69 0.09 0.00 0.00 0.00 0.00 61.98 61.34 1qy9 s VAL 279 Cb -0.10 -2.24 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 1qy9 s VAL 279 CO 0.01 0.52 -0.25 -0.89 0.00 0.00 0.00 175.10 174.50 1qy9 s THR 280 N 0.45 2.30 0.14 3.92 2.01 0.54 -1.20 115.64 123.79 1qy9 s THR 280 Ca -0.10 -1.37 0.10 0.00 0.31 0.00 0.00 61.69 60.63 1qy9 s THR 280 Cb -0.16 -1.92 -0.04 0.00 0.01 0.00 0.00 72.50 70.39 1qy9 s THR 280 CO 0.05 0.34 -0.24 0.27 -0.69 0.00 0.00 174.62 174.35 1qy9 s ILE 281 N -0.85 2.09 0.02 1.82 -4.36 -0.23 -0.86 121.20 118.82 1qy9 s ILE 281 Ca 0.13 -1.78 -0.01 0.00 -0.26 0.00 0.00 60.65 58.73 1qy9 s ILE 281 Cb -0.10 -1.89 -0.02 0.00 1.25 0.00 0.00 42.46 41.70 1qy9 s ILE 281 CO 0.03 -0.04 -0.02 -0.44 0.24 0.00 0.00 174.94 174.72 1qy9 s SER 282 N -2.22 0.23 0.21 4.36 0.01 -0.25 -0.72 113.70 115.32 1qy9 s SER 282 Ca 0.14 -0.49 -0.23 0.00 1.31 0.00 0.00 55.95 56.68 1qy9 s SER 282 Cb -0.09 0.11 0.06 0.00 0.21 0.00 0.00 66.02 66.31 1qy9 s SER 282 CO 0.06 -0.32 0.91 -0.83 0.41 0.00 0.00 173.24 173.47 1qy9 s GLY 283 N -1.50 -0.09 0.15 3.44 0.00 -0.66 -1.60 107.32 107.06 1qy9 s GLY 283 Ca -0.15 -0.12 0.01 0.00 0.00 0.00 0.00 44.72 44.45 1qy9 s GLY 283 CO -0.01 0.30 0.05 -0.37 0.00 0.00 0.00 173.10 173.06 1qy9 n THR 284 N -0.51 0.00 -3.91 0.90 5.66 -1.26 -0.69 114.28 114.46 1qy9 n THR 284 Ca -0.05 -0.66 -0.08 0.00 -3.05 0.00 0.00 64.05 60.20 1qy9 n THR 284 Cb 0.60 -0.07 -0.03 0.00 -1.55 0.00 0.00 70.33 69.28 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 -2.24 -0.69 -0.04 1.79 0.00 -1.12 -0.03 121.76 119.43 1qy9 s ALA 285 Ca 0.04 -0.64 -0.02 0.00 0.00 0.00 0.00 51.96 51.33 1qy9 s ALA 285 Cb -0.00 0.92 0.03 0.00 0.00 0.00 0.00 23.12 24.06 1qy9 s ALA 285 CO 0.02 -0.95 0.09 0.54 0.00 0.00 0.00 175.76 175.46 1qy9 s VAL 286 N -3.67 -0.04 -0.18 0.00 0.11 -0.27 -4.69 120.40 111.66 1qy9 s VAL 286 Ca 0.17 0.13 -0.24 0.00 -2.93 0.00 0.00 61.98 59.10 1qy9 s VAL 286 Cb -0.04 -0.15 -0.02 0.00 -1.53 0.00 0.00 36.38 34.65 1qy9 s VAL 286 CO 0.09 0.05 0.79 -0.63 -3.33 0.00 0.00 175.10 172.07 1qy9 s ILE 287 N 0.75 4.91 -0.01 7.04 1.01 -1.26 -1.14 121.20 132.50 1qy9 s ILE 287 Ca -0.06 1.53 -0.04 0.00 0.00 0.00 0.00 60.65 62.08 1qy9 s ILE 287 Cb -0.08 -4.09 -0.28 0.00 0.01 0.00 0.00 42.46 38.02 1qy9 s ILE 287 CO -0.03 0.04 0.82 -0.07 0.00 0.00 0.00 174.94 175.69 1qy9 h LEU 288 N 8.37 0.42 -7.02 2.97 3.38 -1.36 -3.49 115.31 118.58 1qy9 h LEU 288 Ca -0.29 -0.60 0.21 0.00 0.09 0.00 0.00 57.88 57.29 1qy9 h LEU 288 Cb 1.13 -0.14 -0.17 0.00 0.09 0.00 0.00 40.66 41.57 1qy9 h LEU 288 CO 0.83 1.50 0.71 0.72 0.09 0.00 0.00 178.44 182.29 1qy9 s PHE 289 N -2.61 -0.19 0.09 1.13 -0.12 -1.24 -5.04 117.98 110.01 1qy9 s PHE 289 Ca -0.10 0.11 -0.11 0.00 -0.05 0.00 0.00 56.93 56.78 1qy9 s PHE 289 Cb 0.07 0.52 0.01 0.00 -0.63 0.00 0.00 43.02 42.99 1qy9 s PHE 289 CO 0.85 -0.32 0.25 -3.38 -0.05 0.00 0.00 175.22 172.58 1qy9 s HIS 290 N -2.64 0.04 0.05 3.49 -3.43 -1.26 -1.47 115.29 110.07 1qy9 s HIS 290 Ca 0.08 -0.40 -0.27 0.00 -0.80 0.00 0.00 55.06 53.67 1qy9 s HIS 290 Cb -0.01 0.04 0.07 0.00 -1.43 0.00 0.00 32.58 31.25 1qy9 s HIS 290 CO -0.06 -0.58 0.64 0.00 -2.00 0.00 0.00 174.74 172.75 1qy9 s ALA 291 N -3.69 -1.68 0.28 -1.38 0.00 -0.44 -5.00 121.76 109.85 1qy9 s ALA 291 Ca 0.03 0.91 -0.29 0.00 0.00 0.00 0.00 51.96 52.61 1qy9 s ALA 291 Cb 0.03 0.44 -0.10 0.00 0.00 0.00 0.00 23.12 23.50 1qy9 s ALA 291 CO -0.10 -0.57 1.21 -1.21 0.00 0.00 0.00 175.76 175.09 1qy9 s GLU 292 N -2.45 4.49 0.28 0.00 2.02 -1.26 -0.65 118.70 121.13 1qy9 s GLU 292 Ca -0.05 1.98 -0.30 0.00 0.02 0.00 0.00 54.97 56.62 1qy9 s GLU 292 Cb -0.00 -3.16 -0.11 0.00 0.10 0.00 0.00 34.13 30.96 1qy9 s GLU 292 CO -0.01 -0.02 1.57 -1.58 0.02 0.00 0.00 175.26 175.24 1qy9 s TRP 293 N -0.87 2.80 -1.08 1.61 0.52 -0.85 -4.90 118.94 116.18 1qy9 s TRP 293 Ca 0.48 0.81 0.28 0.00 0.02 0.00 0.00 56.10 57.69 1qy9 s TRP 293 Cb -0.35 -4.03 0.97 0.00 -1.15 0.00 0.00 33.47 28.91 1qy9 s TRP 293 CO 0.44 -3.45 1.74 0.00 0.02 0.00 0.00 176.95 175.70 1qy9 n ALA 294 N 2.23 2.83 -2.60 0.98 0.00 -1.26 -4.88 120.51 117.81 1qy9 n ALA 294 Ca 0.08 -0.21 -0.23 0.00 0.00 0.00 0.00 53.44 53.08 1qy9 n ALA 294 Cb 0.38 -1.33 -0.06 0.00 0.00 0.00 0.00 19.45 18.44 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 -2.93 3.44 -0.01 0.00 -4.36 -1.26 -5.10 121.20 110.98 1qy9 s ILE 295 Ca 0.15 -1.67 -0.30 0.00 -0.26 0.00 0.00 60.65 58.57 1qy9 s ILE 295 Cb 0.19 -3.04 -0.03 0.00 1.25 0.00 0.00 42.46 40.83 1qy9 s ILE 295 CO 0.59 -0.26 0.98 -0.70 0.24 0.00 0.00 174.94 175.78 1qy9 s GLU 296 N -3.82 4.54 0.00 0.37 2.12 -1.26 -5.04 118.70 115.62 1qy9 s GLU 296 Ca 0.36 1.41 0.00 0.00 0.36 0.00 0.00 54.97 57.10 1qy9 s GLU 296 Cb -0.05 -3.47 0.00 0.00 0.26 0.00 0.00 34.13 30.87 1qy9 s GLU 296 CO 0.23 -0.08 0.37 1.28 -0.54 0.00 0.00 175.26 176.51