#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ur9 s ARG 4 N 0.00 4.27 0.25 -2.82 3.52 -1.26 -4.98 118.95 117.93 1ur9 s ARG 4 Ca 0.00 2.34 -0.30 0.00 -0.13 0.00 0.00 55.73 57.64 1ur9 s ARG 4 Cb 0.00 -3.04 -0.09 0.00 -1.56 0.00 0.00 34.95 30.26 1ur9 s ARG 4 CO 0.00 -0.32 0.98 0.15 -0.81 0.00 0.00 175.30 175.30 1ur9 s LYS 5 N -1.81 4.80 0.48 5.12 -0.14 -1.26 -4.98 119.74 121.94 1ur9 s LYS 5 Ca 0.51 1.56 -0.22 0.00 -1.36 0.00 0.00 55.97 56.46 1ur9 s LYS 5 Cb -0.42 -3.24 -0.07 0.00 -1.68 0.00 0.00 37.83 32.41 1ur9 s LYS 5 CO 0.56 0.44 1.11 0.00 -0.76 0.00 0.00 175.35 176.70 1ur9 s ALA 6 N -1.19 2.90 -0.32 5.17 0.00 -0.24 -4.90 121.76 123.17 1ur9 s ALA 6 Ca 0.42 0.81 -0.01 0.00 0.00 0.00 0.00 51.96 53.18 1ur9 s ALA 6 Cb -0.27 -3.34 0.11 0.00 0.00 0.00 0.00 23.12 19.62 1ur9 s ALA 6 CO 0.34 -0.55 0.13 0.08 0.00 0.00 0.00 175.76 175.75 1ur9 s VAL 7 N -1.70 0.61 -0.38 0.00 1.01 -1.25 -0.83 120.40 117.86 1ur9 s VAL 7 Ca 0.66 -1.36 -0.10 0.00 0.00 0.00 0.00 61.98 61.18 1ur9 s VAL 7 Cb -0.24 -1.47 0.04 0.00 0.00 0.00 0.00 36.38 34.72 1ur9 s VAL 7 CO 0.29 -0.74 0.21 -0.63 0.00 0.00 0.00 175.10 174.23 1ur9 s ILE 8 N 1.58 4.35 -0.34 2.22 1.01 0.21 -1.37 121.20 128.86 1ur9 s ILE 8 Ca 0.11 -1.07 -0.12 0.00 0.00 0.00 0.00 60.65 59.58 1ur9 s ILE 8 Cb -0.18 -3.50 -0.01 0.00 0.01 0.00 0.00 42.46 38.78 1ur9 s ILE 8 CO -0.24 -0.31 0.21 -0.83 0.00 0.00 0.00 174.94 173.77 1ur9 s GLY 9 N 1.70 1.93 0.52 6.18 0.00 -0.03 -0.41 107.32 117.21 1ur9 s GLY 9 Ca 0.02 -1.43 -0.20 0.00 0.00 0.00 0.00 44.72 43.10 1ur9 s GLY 9 CO 0.05 0.76 1.15 -0.19 0.00 0.00 0.00 173.10 174.87 1ur9 s TYR 10 N 1.67 2.69 -0.18 1.90 1.51 -0.52 -0.60 117.35 123.82 1ur9 s TYR 10 Ca 0.05 1.53 -0.03 0.00 -1.01 0.00 0.00 57.07 57.62 1ur9 s TYR 10 Cb -0.17 -3.35 0.06 0.00 -0.11 0.00 0.00 41.96 38.39 1ur9 s TYR 10 CO 0.09 -1.65 0.04 -0.47 -1.11 0.00 0.00 175.55 172.45 1ur9 s TYR 11 N -1.68 0.90 -0.19 2.71 5.04 -0.13 -0.41 117.35 123.59 1ur9 s TYR 11 Ca 0.71 -0.75 -0.06 0.00 -2.44 0.00 0.00 57.07 54.53 1ur9 s TYR 11 Cb -0.26 -0.97 -0.03 0.00 0.35 0.00 0.00 41.96 41.04 1ur9 s TYR 11 CO 0.30 -0.58 0.02 0.12 -1.34 0.00 0.00 175.55 174.08 1ur9 s PHE 12 N 1.90 3.13 -0.16 4.97 5.36 -1.26 -0.73 117.98 131.18 1ur9 s PHE 12 Ca -0.00 -0.19 -0.03 0.00 -0.96 0.00 0.00 56.93 55.75 1ur9 s PHE 12 Cb -0.17 -2.07 0.05 0.00 -0.34 0.00 0.00 43.02 40.50 1ur9 s PHE 12 CO -0.08 -0.04 0.03 -1.50 -1.46 0.00 0.00 175.22 172.18 1ur9 s ILE 13 N 0.64 0.42 0.75 3.12 2.07 -0.99 -4.84 121.20 122.37 1ur9 s ILE 13 Ca 0.01 -0.35 -0.15 0.00 -1.41 0.00 0.00 60.65 58.75 1ur9 s ILE 13 Cb -0.14 -0.86 0.05 0.00 0.13 0.00 0.00 42.46 41.64 1ur9 s ILE 13 CO 0.02 -0.10 1.24 -0.81 -1.91 0.00 0.00 174.94 173.38 1ur9 n PRO 14 N 5.10 0.53 -0.34 3.50 -0.04 -1.26 -4.61 135.00 137.89 1ur9 n PRO 14 Ca -0.08 0.25 0.17 0.00 -0.04 0.00 0.00 63.50 63.80 1ur9 n PRO 14 Cb 0.48 -2.48 0.39 0.00 -0.04 0.00 0.00 33.50 31.85 1ur9 n PRO 14 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1ur9 h THR 15 N -0.37 0.62 -0.65 0.52 2.02 -1.96 0.25 112.91 113.35 1ur9 h THR 15 Ca -0.48 -0.21 -0.07 0.00 0.77 0.00 0.00 66.41 66.42 1ur9 h THR 15 Cb 1.31 -0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 67.65 1ur9 h THR 15 CO 0.49 0.11 0.12 -0.55 0.37 0.00 0.00 175.52 176.06 1ur9 h ASN 16 N 0.61 0.99 0.31 4.18 7.08 -1.93 -0.82 115.58 126.00 1ur9 h ASN 16 Ca 0.59 -0.22 -0.08 0.00 -3.08 0.00 0.00 56.30 53.51 1ur9 h ASN 16 Cb 1.13 -0.26 -0.01 0.00 -2.08 0.00 0.00 38.32 37.09 1ur9 h ASN 16 CO -0.37 0.97 -0.37 1.56 -2.08 0.00 0.00 177.43 177.14 1ur9 h GLN 17 N 0.98 0.08 -0.28 4.14 4.20 -1.30 -0.20 115.11 122.74 1ur9 h GLN 17 Ca 0.20 -0.03 -0.12 0.00 0.06 0.00 0.00 58.65 58.76 1ur9 h GLN 17 Cb 0.39 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1ur9 h GLN 17 CO 0.01 0.44 -0.33 0.82 -0.67 0.00 0.00 178.83 179.10 1ur9 h ILE 18 N 0.07 1.29 0.00 2.54 1.08 -0.67 0.13 117.51 121.95 1ur9 h ILE 18 Ca 0.01 -1.45 -0.14 0.00 -0.39 0.00 0.00 64.86 62.89 1ur9 h ILE 18 Cb 0.68 1.43 -0.02 0.00 -3.07 0.00 0.00 36.82 35.85 1ur9 h ILE 18 CO 0.05 0.46 -0.65 0.78 -0.69 0.00 0.00 178.15 178.11 1ur9 h ASN 19 N 0.50 0.00 -0.14 1.72 2.35 -0.32 -3.25 115.58 116.44 1ur9 h ASN 19 Ca 0.06 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.74 1ur9 h ASN 19 Cb 0.81 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.14 1ur9 h ASN 19 CO 0.07 0.65 -0.30 0.59 -1.65 0.00 0.00 177.43 176.78 1ur9 n ASN 20 N -3.39 2.08 -4.63 5.81 4.13 -0.17 -5.04 115.26 114.06 1ur9 n ASN 20 Ca 0.01 -3.79 -0.52 0.00 1.68 0.00 0.00 54.58 51.95 1ur9 n ASN 20 Cb 0.74 -0.56 -0.06 0.00 -1.54 0.00 0.00 39.78 38.36 1ur9 n ASN 20 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ur9 n TYR 21 N -1.13 1.79 -3.74 3.10 9.36 0.02 -4.82 117.16 121.75 1ur9 n TYR 21 Ca 0.24 0.52 -0.12 0.00 3.32 0.00 0.00 57.90 61.86 1ur9 n TYR 21 Cb 0.82 -2.41 -0.12 0.00 -0.63 0.00 0.00 39.34 37.00 1ur9 n TYR 21 CO 0.00 0.00 0.00 -0.08 0.22 0.00 0.00 176.86 177.00 1ur9 s THR 22 N 1.42 -0.02 -2.06 2.97 -1.32 -1.26 -4.99 115.64 110.37 1ur9 s THR 22 Ca 0.87 0.08 0.29 0.00 -1.21 0.00 0.00 61.69 61.72 1ur9 s THR 22 Cb -0.92 -0.44 0.53 0.00 -1.51 0.00 0.00 72.50 70.16 1ur9 s THR 22 CO 0.50 0.03 1.82 -0.62 -2.21 0.00 0.00 174.62 174.14 1ur9 n GLU 23 N 3.76 1.15 -2.49 7.08 -0.58 -1.26 -4.37 120.64 123.93 1ur9 n GLU 23 Ca -0.20 -0.53 -0.21 0.00 -0.42 0.00 0.00 57.16 55.79 1ur9 n GLU 23 Cb 0.55 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 29.94 1ur9 n GLU 23 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1ur9 n THR 24 N -0.46 2.02 -3.04 2.62 -2.24 -1.26 -4.95 114.28 106.96 1ur9 n THR 24 Ca 0.17 -4.35 0.05 0.00 -2.27 0.00 0.00 64.05 57.65 1ur9 n THR 24 Cb 0.29 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 67.82 1ur9 n THR 24 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ur9 s ASP 25 N -3.46 -0.26 0.56 3.42 -1.08 -1.26 -5.03 116.67 109.57 1ur9 s ASP 25 Ca 0.43 -0.01 0.27 0.00 -0.52 0.00 0.00 52.55 52.72 1ur9 s ASP 25 Cb 0.41 0.94 1.50 0.00 -1.46 0.00 0.00 42.92 44.31 1ur9 s ASP 25 CO -0.11 -0.04 2.00 0.00 0.52 0.00 0.00 175.17 177.53 1ur9 h THR 26 N 4.06 0.55 0.00 1.71 1.03 -1.90 -0.59 112.91 117.77 1ur9 h THR 26 Ca -0.09 0.00 -0.06 0.00 -0.01 0.00 0.00 66.41 66.26 1ur9 h THR 26 Cb 1.19 0.73 -0.01 0.00 -1.07 0.00 0.00 68.15 68.99 1ur9 h THR 26 CO -0.12 0.00 -0.26 0.77 -0.01 0.00 0.00 175.52 175.90 1ur9 h SER 27 N 0.00 0.00 0.00 0.00 4.64 -1.95 -3.03 113.55 113.21 1ur9 h SER 27 Ca 0.19 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.24 1ur9 h SER 27 Cb 0.91 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.96 1ur9 h SER 27 CO -0.00 0.26 -1.64 0.52 -0.87 0.00 0.00 176.83 175.10 1ur9 n VAL 28 N -3.33 1.52 -3.78 0.95 0.31 -0.30 -4.82 118.33 108.89 1ur9 n VAL 28 Ca 0.01 -0.12 -0.30 0.00 -0.01 0.00 0.00 64.34 63.92 1ur9 n VAL 28 Cb 0.50 -2.05 -0.15 0.00 -0.91 0.00 0.00 33.84 31.23 1ur9 n VAL 28 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1ur9 s VAL 29 N -2.45 1.08 0.47 2.52 1.01 -0.79 -4.83 120.40 117.41 1ur9 s VAL 29 Ca -0.31 -1.51 0.15 0.00 0.00 0.00 0.00 61.98 60.31 1ur9 s VAL 29 Cb 0.09 -1.80 0.31 0.00 0.00 0.00 0.00 36.38 34.97 1ur9 s VAL 29 CO 0.50 -0.64 2.05 -0.65 0.00 0.00 0.00 175.10 176.36 1ur9 h PRO 30 N 8.02 0.26 -2.34 2.72 0.11 -1.75 -3.36 132.00 135.66 1ur9 h PRO 30 Ca -0.12 -0.02 -0.55 0.00 0.11 0.00 0.00 66.00 65.42 1ur9 h PRO 30 Cb 1.02 -0.06 -0.37 0.00 0.11 0.00 0.00 31.00 31.70 1ur9 h PRO 30 CO 0.47 0.17 -0.90 0.12 -0.21 0.00 0.00 178.00 177.65 1ur9 s PHE 31 N -5.26 0.77 0.83 0.65 5.36 -1.26 -4.87 117.98 114.20 1ur9 s PHE 31 Ca -0.07 -1.96 -0.12 0.00 -0.96 0.00 0.00 56.93 53.82 1ur9 s PHE 31 Cb 0.18 -0.82 0.09 0.00 -0.34 0.00 0.00 43.02 42.13 1ur9 s PHE 31 CO 0.72 -0.86 1.15 -1.25 -1.46 0.00 0.00 175.22 173.52 1ur9 s PRO 32 N 0.46 1.81 0.46 10.12 0.04 -1.26 -4.93 135.00 141.70 1ur9 s PRO 32 Ca 0.28 0.25 0.15 0.00 0.04 0.00 0.00 61.00 61.72 1ur9 s PRO 32 Cb -0.05 -1.92 1.10 0.00 0.04 0.00 0.00 34.50 33.67 1ur9 s PRO 32 CO -0.12 -1.73 2.01 0.28 0.04 0.00 0.00 177.00 177.48 1ur9 h VAL 33 N -1.16 0.91 0.00 -0.36 2.07 -1.96 -2.05 116.25 113.70 1ur9 h VAL 33 Ca -0.47 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 66.94 1ur9 h VAL 33 Cb 1.32 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1ur9 h VAL 33 CO 0.64 0.06 0.06 0.77 0.02 0.00 0.00 177.57 179.12 1ur9 h SER 34 N 0.31 0.00 0.30 0.57 4.64 -1.93 0.29 113.55 117.73 1ur9 h SER 34 Ca 0.23 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.51 1ur9 h SER 34 Cb 0.49 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1ur9 h SER 34 CO -0.05 0.00 -0.16 0.78 -0.87 0.00 0.00 176.83 176.53 1ur9 h ASN 35 N 0.00 0.00 -1.83 4.97 2.35 -1.74 -3.36 115.58 115.98 1ur9 h ASN 35 Ca 0.00 0.00 -0.68 0.00 -0.55 0.00 0.00 56.30 55.07 1ur9 h ASN 35 Cb 0.13 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 38.35 1ur9 h ASN 35 CO 0.00 0.16 1.33 -0.63 -1.65 0.00 0.00 177.43 176.64 1ur9 s ILE 36 N -4.34 4.55 0.96 2.81 1.01 0.10 -4.98 121.20 121.31 1ur9 s ILE 36 Ca -0.03 -1.76 -0.12 0.00 0.00 0.00 0.00 60.65 58.74 1ur9 s ILE 36 Cb 0.14 -4.94 0.17 0.00 0.01 0.00 0.00 42.46 37.84 1ur9 s ILE 36 CO 0.63 -1.71 1.10 0.42 0.00 0.00 0.00 174.94 175.38 1ur9 s THR 37 N 3.09 2.26 0.26 2.92 -4.23 -1.26 -4.67 115.64 114.01 1ur9 s THR 37 Ca 0.42 0.08 -0.02 0.00 -1.18 0.00 0.00 61.69 60.99 1ur9 s THR 37 Cb -0.02 -2.60 0.25 0.00 1.34 0.00 0.00 72.50 71.47 1ur9 s THR 37 CO -0.04 -0.11 1.82 -0.65 -0.54 0.00 0.00 174.62 175.10 1ur9 h PRO 38 N -1.75 0.87 -0.97 3.99 0.11 -1.95 0.10 132.00 132.39 1ur9 h PRO 38 Ca -0.53 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.53 1ur9 h PRO 38 Cb 1.32 -0.20 -0.05 0.00 0.11 0.00 0.00 31.00 32.18 1ur9 h PRO 38 CO 0.57 0.57 0.61 0.00 -0.21 0.00 0.00 178.00 179.55 1ur9 h ALA 39 N 1.50 1.24 -0.20 -0.75 0.00 -1.95 -1.40 119.26 117.70 1ur9 h ALA 39 Ca 0.45 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 55.07 1ur9 h ALA 39 Cb 0.43 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ur9 h ALA 39 CO -0.26 0.67 -0.65 0.87 0.00 0.00 0.00 179.25 179.88 1ur9 h LYS 40 N 1.34 0.74 0.00 0.00 1.57 -1.60 -2.80 116.57 115.82 1ur9 h LYS 40 Ca 0.35 -0.53 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 1ur9 h LYS 40 Cb -0.09 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 1ur9 h LYS 40 CO -0.07 1.15 -0.04 0.00 -0.57 0.00 0.00 179.45 179.93 1ur9 h ALA 41 N 0.72 1.71 0.00 3.86 0.00 -0.32 -0.71 119.26 124.52 1ur9 h ALA 41 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ur9 h ALA 41 Cb 1.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1ur9 h ALA 41 CO 0.13 0.05 0.00 0.87 0.00 0.00 0.00 179.25 180.30 1ur9 h LYS 42 N 0.00 0.00 0.00 0.00 1.57 -1.01 -3.16 116.57 113.97 1ur9 h LYS 42 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ur9 h LYS 42 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1ur9 h LYS 42 CO 0.00 0.00 -0.20 1.96 -0.57 0.00 0.00 179.45 180.64 1ur9 h GLN 43 N 0.00 0.00 -5.99 3.15 4.20 -1.00 -3.46 115.11 112.00 1ur9 h GLN 43 Ca 0.00 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 58.13 1ur9 h GLN 43 Cb 0.89 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.63 1ur9 h GLN 43 CO 0.00 0.00 -0.48 -0.51 -0.67 0.00 0.00 178.83 177.17 1ur9 s LEU 44 N -4.84 4.33 -0.04 1.46 1.43 -1.15 -4.71 118.68 115.16 1ur9 s LEU 44 Ca 0.08 0.21 0.06 0.00 -1.03 0.00 0.00 54.13 53.45 1ur9 s LEU 44 Cb 0.11 -2.92 -0.09 0.00 0.03 0.00 0.00 46.19 43.33 1ur9 s LEU 44 CO 0.65 0.10 0.07 0.35 0.23 0.00 0.00 176.35 177.76 1ur9 n THR 45 N -0.17 0.25 -3.79 5.49 -2.24 -0.47 -4.69 114.28 108.66 1ur9 n THR 45 Ca -0.06 -0.22 -0.13 0.00 -2.27 0.00 0.00 64.05 61.37 1ur9 n THR 45 Cb 0.53 -0.35 -0.11 0.00 -2.10 0.00 0.00 70.33 68.29 1ur9 n THR 45 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1ur9 s HIS 46 N -2.28 -0.24 -0.17 4.78 3.76 -0.99 -1.39 115.29 118.77 1ur9 s HIS 46 Ca -0.03 0.57 0.01 0.00 -0.15 0.00 0.00 55.06 55.46 1ur9 s HIS 46 Cb 0.03 0.08 0.02 0.00 1.11 0.00 0.00 32.58 33.82 1ur9 s HIS 46 CO 0.27 -0.15 -0.20 0.42 -0.85 0.00 0.00 174.74 174.23 1ur9 s ILE 47 N -0.04 2.02 -0.70 0.60 1.01 0.21 -0.85 121.20 123.44 1ur9 s ILE 47 Ca -0.02 -0.93 -0.17 0.00 0.00 0.00 0.00 60.65 59.54 1ur9 s ILE 47 Cb -0.02 -1.82 0.15 0.00 0.01 0.00 0.00 42.46 40.77 1ur9 s ILE 47 CO 0.01 0.54 0.75 0.20 0.00 0.00 0.00 174.94 176.43 1ur9 s ASN 48 N 1.18 6.42 0.15 3.58 0.01 0.23 -0.08 114.94 126.44 1ur9 s ASN 48 Ca 0.02 -1.96 -0.31 0.00 -0.71 0.00 0.00 52.86 49.90 1ur9 s ASN 48 Cb -0.14 -2.27 -0.10 0.00 0.41 0.00 0.00 41.25 39.15 1ur9 s ASN 48 CO -0.10 -0.90 1.63 0.12 -1.51 0.00 0.00 177.10 176.34 1ur9 s PHE 49 N 1.75 2.82 0.00 2.20 5.36 0.48 -0.96 117.98 129.64 1ur9 s PHE 49 Ca 0.15 0.46 0.04 0.00 -0.96 0.00 0.00 56.93 56.62 1ur9 s PHE 49 Cb -0.18 -3.99 -0.01 0.00 -0.34 0.00 0.00 43.02 38.50 1ur9 s PHE 49 CO -0.01 -3.77 -0.14 -1.12 -1.46 0.00 0.00 175.22 168.72 1ur9 s SER 50 N 1.57 1.59 0.09 6.13 0.01 0.09 -0.24 113.70 122.94 1ur9 s SER 50 Ca 0.73 -0.30 0.05 0.00 1.31 0.00 0.00 55.95 57.74 1ur9 s SER 50 Cb -0.44 -0.16 -0.03 0.00 0.21 0.00 0.00 66.02 65.60 1ur9 s SER 50 CO 0.32 0.13 -0.14 -0.36 0.41 0.00 0.00 173.24 173.60 1ur9 s PHE 51 N -0.45 1.27 0.47 2.43 0.08 -1.26 -2.36 117.98 118.16 1ur9 s PHE 51 Ca 0.04 -0.50 0.08 0.00 0.12 0.00 0.00 56.93 56.68 1ur9 s PHE 51 Cb -0.06 -0.70 0.03 0.00 -0.57 0.00 0.00 43.02 41.72 1ur9 s PHE 51 CO -0.00 0.08 0.57 -0.51 -0.10 0.00 0.00 175.22 175.26 1ur9 s LEU 52 N -1.98 3.35 0.00 -0.37 1.02 -0.44 -4.79 118.68 115.47 1ur9 s LEU 52 Ca 0.02 -0.70 0.00 0.00 0.02 0.00 0.00 54.13 53.47 1ur9 s LEU 52 Cb -0.08 -2.09 0.00 0.00 0.02 0.00 0.00 46.19 44.04 1ur9 s LEU 52 CO 0.02 -0.93 0.00 -0.67 0.02 0.00 0.00 176.35 174.79 1ur9 n ASP 53 N -1.88 0.20 -4.08 2.29 2.03 -0.12 -2.04 116.55 112.95 1ur9 n ASP 53 Ca 0.08 -0.77 -0.30 0.00 0.52 0.00 0.00 54.79 54.31 1ur9 n ASP 53 Cb 0.61 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.84 1ur9 n ASP 53 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1ur9 s ILE 54 N -1.65 1.72 0.53 5.18 1.01 -1.26 -1.19 121.20 125.54 1ur9 s ILE 54 Ca 0.00 -0.75 -0.05 0.00 0.00 0.00 0.00 60.65 59.85 1ur9 s ILE 54 Cb 0.00 -1.57 0.11 0.00 0.01 0.00 0.00 42.46 41.01 1ur9 s ILE 54 CO 0.00 0.48 0.72 -0.46 0.00 0.00 0.00 174.94 175.69 1ur9 n ASN 55 N 4.41 0.47 0.08 3.58 0.23 -0.40 -4.80 115.26 118.82 1ur9 n ASN 55 Ca -0.19 -1.51 0.11 0.00 -0.53 0.00 0.00 54.58 52.46 1ur9 n ASN 55 Cb 0.51 -0.51 0.44 0.00 -2.08 0.00 0.00 39.78 38.13 1ur9 n ASN 55 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1ur9 n SER 56 N -3.22 0.43 -0.27 0.53 3.41 -1.26 -1.15 113.62 112.09 1ur9 n SER 56 Ca 0.10 0.59 0.14 0.00 -0.26 0.00 0.00 58.87 59.44 1ur9 n SER 56 Cb 0.36 -0.69 0.66 0.00 -0.26 0.00 0.00 64.21 64.29 1ur9 n SER 56 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1ur9 n ASN 57 N -1.96 0.83 -2.34 4.04 3.02 -1.26 -4.91 115.26 112.69 1ur9 n ASN 57 Ca 0.04 -1.34 -0.17 0.00 -0.03 0.00 0.00 54.58 53.07 1ur9 n ASN 57 Cb 0.25 -0.01 0.03 0.00 -0.61 0.00 0.00 39.78 39.44 1ur9 n ASN 57 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1ur9 n LEU 58 N -0.33 -2.43 -4.40 3.41 4.77 -0.30 -5.02 117.00 112.70 1ur9 n LEU 58 Ca 0.20 -0.22 -0.21 0.00 -0.03 0.00 0.00 56.01 55.75 1ur9 n LEU 58 Cb 0.23 -2.37 -0.10 0.00 -2.33 0.00 0.00 43.42 38.86 1ur9 n LEU 58 CO 0.16 0.19 -0.45 -1.61 -1.33 0.00 0.00 177.39 174.35 1ur9 s GLU 59 N -5.43 1.49 0.19 3.23 2.02 -1.26 -4.40 118.70 114.54 1ur9 s GLU 59 Ca 0.24 -1.68 -0.31 0.00 0.02 0.00 0.00 54.97 53.25 1ur9 s GLU 59 Cb -0.10 -1.39 -0.09 0.00 0.10 0.00 0.00 34.13 32.65 1ur9 s GLU 59 CO 0.29 0.24 1.41 0.00 0.02 0.00 0.00 175.26 177.22 1ur9 s ALA 61 N 0.45 -1.67 0.67 0.00 0.00 -0.33 -4.87 121.76 116.02 1ur9 s ALA 61 Ca 0.61 0.79 -0.13 0.00 0.00 0.00 0.00 51.96 53.24 1ur9 s ALA 61 Cb -0.39 0.57 -0.00 0.00 0.00 0.00 0.00 23.12 23.29 1ur9 s ALA 61 CO 0.37 -0.63 1.06 -1.58 0.00 0.00 0.00 175.76 174.98 1ur9 s TRP 62 N -2.87 2.99 0.15 0.00 0.52 -1.26 -0.95 118.94 117.52 1ur9 s TRP 62 Ca -0.03 1.47 -0.31 0.00 0.02 0.00 0.00 56.10 57.25 1ur9 s TRP 62 Cb -0.01 -2.95 -0.11 0.00 -1.15 0.00 0.00 33.47 29.25 1ur9 s TRP 62 CO -0.05 -1.28 1.76 0.34 0.02 0.00 0.00 176.95 177.74 1ur9 s ASP 63 N -3.37 6.43 0.48 2.95 2.15 -1.26 -4.82 116.67 119.23 1ur9 s ASP 63 Ca 0.61 2.77 0.38 0.00 0.43 0.00 0.00 52.55 56.74 1ur9 s ASP 63 Cb -0.15 -2.58 1.57 0.00 -0.30 0.00 0.00 42.92 41.46 1ur9 s ASP 63 CO 0.49 -0.97 1.55 -2.65 -0.17 0.00 0.00 175.17 173.42 1ur9 n PRO 64 N 4.93 -0.02 0.00 4.34 -0.02 -1.26 0.16 135.00 143.13 1ur9 n PRO 64 Ca 0.17 1.19 0.16 0.00 -2.02 0.00 0.00 63.50 63.00 1ur9 n PRO 64 Cb 0.37 -2.47 0.91 0.00 -0.02 0.00 0.00 33.50 32.29 1ur9 n PRO 64 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ur9 n ALA 65 N -2.66 2.66 -2.71 3.55 0.00 -1.26 -4.81 120.51 115.28 1ur9 n ALA 65 Ca 0.42 -0.20 -0.42 0.00 0.00 0.00 0.00 53.44 53.24 1ur9 n ALA 65 Cb 1.71 -1.50 -0.03 0.00 0.00 0.00 0.00 19.45 19.63 1ur9 n ALA 65 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ur9 s THR 66 N -2.09 4.90 -0.40 0.00 2.01 0.43 -4.97 115.64 115.52 1ur9 s THR 66 Ca 0.45 1.90 -0.21 0.00 0.31 0.00 0.00 61.69 64.14 1ur9 s THR 66 Cb 0.22 -4.25 0.01 0.00 0.01 0.00 0.00 72.50 68.49 1ur9 s THR 66 CO 0.38 0.15 0.65 0.54 -0.69 0.00 0.00 174.62 175.65 1ur9 s ASN 67 N 0.99 6.38 0.25 3.53 2.20 -1.26 -4.95 114.94 122.07 1ur9 s ASN 67 Ca 0.48 -0.08 -0.08 0.00 -0.94 0.00 0.00 52.86 52.23 1ur9 s ASN 67 Cb -0.20 -2.33 0.42 0.00 -2.00 0.00 0.00 41.25 37.15 1ur9 s ASN 67 CO 0.23 -0.69 1.60 -0.78 -2.94 0.00 0.00 177.10 174.52 1ur9 h ASP 68 N 8.68 -0.59 -0.59 3.54 3.58 -1.96 -2.44 116.42 126.63 1ur9 h ASP 68 Ca -0.26 0.23 0.12 0.00 0.42 0.00 0.00 57.03 57.54 1ur9 h ASP 68 Cb 1.10 0.45 -0.11 0.00 1.72 0.00 0.00 39.33 42.49 1ur9 h ASP 68 CO 0.87 -0.25 -0.14 0.00 -2.88 0.00 0.00 179.24 176.84 1ur9 h ALA 69 N 1.80 0.40 -0.14 -0.78 0.00 -1.99 0.87 119.26 119.43 1ur9 h ALA 69 Ca 0.42 0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.56 1ur9 h ALA 69 Cb 0.71 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1ur9 h ALA 69 CO -0.79 -0.43 0.07 0.87 0.00 0.00 0.00 179.25 178.97 1ur9 h LYS 70 N 0.00 0.19 -0.15 0.00 1.79 -1.72 -1.98 116.57 114.70 1ur9 h LYS 70 Ca 0.29 -0.03 0.05 0.00 -2.18 0.00 0.00 60.65 58.78 1ur9 h LYS 70 Cb 0.44 -0.04 -0.06 0.00 -1.58 0.00 0.00 32.23 30.99 1ur9 h LYS 70 CO -0.61 0.23 -0.23 0.00 -1.08 0.00 0.00 179.45 177.76 1ur9 h ALA 71 N 0.96 -0.18 -0.59 3.86 0.00 -0.93 -0.85 119.26 121.52 1ur9 h ALA 71 Ca 0.05 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1ur9 h ALA 71 Cb 0.09 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1ur9 h ALA 71 CO -0.01 -0.68 0.31 0.00 0.00 0.00 0.00 179.25 178.87 1ur9 h ARG 72 N -0.28 0.82 -0.62 0.00 3.08 -0.81 0.01 114.38 116.57 1ur9 h ARG 72 Ca 0.11 -0.09 -0.05 0.00 0.07 0.00 0.00 59.98 60.01 1ur9 h ARG 72 Cb 0.44 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.30 1ur9 h ARG 72 CO -0.32 0.62 0.18 0.22 -1.07 0.00 0.00 179.97 179.61 1ur9 h ASP 73 N 0.83 0.89 -0.15 7.04 3.58 -0.54 0.96 116.42 129.03 1ur9 h ASP 73 Ca 0.21 -0.16 -0.09 0.00 0.42 0.00 0.00 57.03 57.41 1ur9 h ASP 73 Cb 0.05 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 40.87 1ur9 h ASP 73 CO -0.03 0.85 -0.25 0.58 -2.88 0.00 0.00 179.24 177.51 1ur9 h VAL 74 N 0.92 1.36 -0.58 2.25 2.07 -0.18 -1.95 116.25 120.15 1ur9 h VAL 74 Ca 0.20 -1.49 -0.03 0.00 0.82 0.00 0.00 66.70 66.21 1ur9 h VAL 74 Cb 0.29 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 32.00 1ur9 h VAL 74 CO -0.01 0.44 0.24 0.58 0.02 0.00 0.00 177.57 178.84 1ur9 h VAL 75 N 0.04 1.20 -0.40 2.57 2.07 -0.89 -2.45 116.25 118.39 1ur9 h VAL 75 Ca 0.01 -0.62 -0.12 0.00 0.82 0.00 0.00 66.70 66.79 1ur9 h VAL 75 Cb 0.82 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1ur9 h VAL 75 CO 0.06 0.25 -0.24 0.78 0.02 0.00 0.00 177.57 178.43 1ur9 h ASN 76 N 0.82 0.84 -0.47 0.57 2.35 -0.74 0.03 115.58 118.98 1ur9 h ASN 76 Ca 0.20 -0.31 -0.05 0.00 -0.55 0.00 0.00 56.30 55.58 1ur9 h ASN 76 Cb 0.15 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 1ur9 h ASN 76 CO -0.02 1.04 0.12 0.03 -1.65 0.00 0.00 177.43 176.95 1ur9 h ARG 77 N 0.71 0.81 0.01 0.81 3.08 -1.01 0.36 114.38 119.14 1ur9 h ARG 77 Ca 0.09 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 1ur9 h ARG 77 Cb 0.77 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.70 1ur9 h ARG 77 CO 0.06 0.73 -0.00 -0.07 -1.07 0.00 0.00 179.97 179.62 1ur9 h LEU 78 N 0.78 -0.01 -2.11 3.04 3.38 -1.09 -2.98 115.31 116.33 1ur9 h LEU 78 Ca 0.17 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 1ur9 h LEU 78 Cb 0.30 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1ur9 h LEU 78 CO -0.00 0.42 -0.06 0.71 0.09 0.00 0.00 178.44 179.60 1ur9 h THR 79 N -0.44 0.28 0.00 0.22 1.35 -0.82 -0.50 112.91 112.99 1ur9 h THR 79 Ca -0.00 -0.37 -0.04 0.00 -0.55 0.00 0.00 66.41 65.44 1ur9 h THR 79 Cb 0.43 1.29 -0.01 0.00 -1.73 0.00 0.00 68.15 68.13 1ur9 h THR 79 CO 0.00 0.06 -0.19 0.00 -0.25 0.00 0.00 175.52 175.14 1ur9 h ALA 80 N 1.94 1.19 0.00 6.62 0.00 -0.77 -2.38 119.26 125.86 1ur9 h ALA 80 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1ur9 h ALA 80 Cb 0.28 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ur9 h ALA 80 CO 0.01 0.24 0.00 -0.07 0.00 0.00 0.00 179.25 179.43 1ur9 h LEU 81 N 0.00 0.00 -1.89 0.00 3.38 -1.01 -2.46 115.31 113.32 1ur9 h LEU 81 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ur9 h LEU 81 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1ur9 h LEU 81 CO 0.02 0.00 0.00 0.11 0.09 0.00 0.00 178.44 178.66 1ur9 h LYS 82 N 0.00 0.00 0.00 1.13 1.57 -1.56 -0.10 116.57 117.61 1ur9 h LYS 82 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1ur9 h LYS 82 Cb 0.40 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 1ur9 h LYS 82 CO 0.00 0.00 -0.12 0.00 -0.57 0.00 0.00 179.45 178.76 1ur9 h ALA 83 N 2.04 1.71 -0.00 3.86 0.00 -1.64 -2.44 119.26 122.79 1ur9 h ALA 83 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1ur9 h ALA 83 Cb 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ur9 h ALA 83 CO 0.00 0.15 -0.47 0.72 0.00 0.00 0.00 179.25 179.65 1ur9 n HIS 84 N -4.27 0.00 -3.27 0.00 8.25 -0.05 -4.80 115.22 111.08 1ur9 n HIS 84 Ca -0.03 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.38 1ur9 n HIS 84 Cb 0.19 -0.17 -0.05 0.00 1.12 0.00 0.00 29.99 31.09 1ur9 n HIS 84 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1ur9 s ASN 85 N -2.81 -0.26 0.00 0.41 2.47 -0.92 -4.66 114.94 109.18 1ur9 s ASN 85 Ca 0.16 0.18 0.09 0.00 0.42 0.00 0.00 52.86 53.71 1ur9 s ASN 85 Cb 0.18 1.43 0.39 0.00 -1.45 0.00 0.00 41.25 41.80 1ur9 s ASN 85 CO 0.65 -0.31 1.26 -0.81 -3.72 0.00 0.00 177.10 174.17 1ur9 n PRO 86 N 5.38 0.03 0.00 0.43 -0.04 -1.25 -1.89 135.00 137.65 1ur9 n PRO 86 Ca -0.01 0.31 0.09 0.00 -0.04 0.00 0.00 63.50 63.86 1ur9 n PRO 86 Cb 0.50 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.38 1ur9 n PRO 86 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1ur9 n SER 87 N -1.45 1.16 -4.75 3.54 7.64 -1.26 -4.99 113.62 113.51 1ur9 n SER 87 Ca 0.03 -1.08 -0.41 0.00 1.01 0.00 0.00 58.87 58.41 1ur9 n SER 87 Cb 0.10 0.87 -0.03 0.00 -1.01 0.00 0.00 64.21 64.14 1ur9 n SER 87 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1ur9 s LEU 88 N -2.78 4.41 -0.07 -3.43 2.96 -0.79 -4.84 118.68 114.14 1ur9 s LEU 88 Ca 0.10 2.53 0.04 0.00 -0.22 0.00 0.00 54.13 56.58 1ur9 s LEU 88 Cb 0.15 -3.62 -0.00 0.00 0.50 0.00 0.00 46.19 43.22 1ur9 s LEU 88 CO 0.73 -0.57 -0.21 -0.13 -1.32 0.00 0.00 176.35 174.85 1ur9 s ARG 89 N -0.52 2.43 -0.57 1.98 0.52 -0.48 -4.93 118.95 117.37 1ur9 s ARG 89 Ca 0.56 -0.75 -0.11 0.00 -0.52 0.00 0.00 55.73 54.90 1ur9 s ARG 89 Cb -0.39 -1.96 0.14 0.00 0.52 0.00 0.00 34.95 33.27 1ur9 s ARG 89 CO 0.42 0.22 0.47 0.42 0.02 0.00 0.00 175.30 176.86 1ur9 s ILE 90 N 0.20 4.70 0.60 1.52 -1.09 -1.26 -0.62 121.20 125.24 1ur9 s ILE 90 Ca -0.11 -1.94 -0.04 0.00 -2.23 0.00 0.00 60.65 56.33 1ur9 s ILE 90 Cb -0.15 -4.03 0.02 0.00 -1.58 0.00 0.00 42.46 36.73 1ur9 s ILE 90 CO 0.05 -0.86 0.89 -0.04 -1.23 0.00 0.00 174.94 173.75 1ur9 s MET 91 N 1.08 2.71 0.02 2.79 -1.94 0.89 -0.45 119.30 124.40 1ur9 s MET 91 Ca 0.08 -0.22 0.07 0.00 -1.71 0.00 0.00 55.69 53.91 1ur9 s MET 91 Cb -0.24 -2.31 -0.02 0.00 2.01 0.00 0.00 34.83 34.27 1ur9 s MET 91 CO -0.01 -0.78 -0.21 -0.59 -0.01 0.00 0.00 175.02 173.41 1ur9 s PHE 92 N -2.97 1.84 -0.12 -0.03 -0.71 -1.01 -0.39 117.98 114.58 1ur9 s PHE 92 Ca 0.55 -0.36 -0.03 0.00 -1.04 0.00 0.00 56.93 56.05 1ur9 s PHE 92 Cb -0.10 -1.13 -0.03 0.00 -1.21 0.00 0.00 43.02 40.54 1ur9 s PHE 92 CO 0.43 0.04 -0.02 0.45 -1.34 0.00 0.00 175.22 174.79 1ur9 s SER 93 N -0.88 5.02 -0.23 1.98 0.15 0.66 -1.21 113.70 119.19 1ur9 s SER 93 Ca 0.08 0.01 -0.07 0.00 0.70 0.00 0.00 55.95 56.66 1ur9 s SER 93 Cb -0.08 -1.61 -0.03 0.00 -1.71 0.00 0.00 66.02 62.59 1ur9 s SER 93 CO 0.01 0.27 0.07 -0.63 1.20 0.00 0.00 173.24 174.16 1ur9 s ILE 94 N -0.25 4.46 0.00 6.45 1.01 0.21 -1.33 121.20 131.76 1ur9 s ILE 94 Ca 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.57 1ur9 s ILE 94 Cb -0.12 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.28 1ur9 s ILE 94 CO 0.02 0.37 0.00 0.61 0.00 0.00 0.00 174.94 175.94 1ur9 n GLY 95 N 4.55 0.18 0.00 6.18 0.00 -0.87 -0.57 105.19 114.66 1ur9 n GLY 95 Ca -0.16 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1ur9 n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ur9 n GLY 96 N 0.00 0.56 0.13 -0.02 0.00 0.10 -4.34 105.19 101.63 1ur9 n GLY 96 Ca 0.00 -1.98 -0.13 0.00 0.00 0.00 0.00 46.02 43.91 1ur9 n GLY 96 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1ur9 h TRP 97 N 0.00 -0.20 -0.03 1.61 2.91 -1.95 -2.26 115.95 116.04 1ur9 h TRP 97 Ca 0.00 -0.00 0.04 0.00 1.13 0.00 0.00 58.89 60.05 1ur9 h TRP 97 Cb 0.00 0.07 -0.05 0.00 -0.51 0.00 0.00 29.16 28.66 1ur9 h TRP 97 CO 0.00 0.18 -0.30 -0.92 -1.03 0.00 0.00 178.44 176.37 1ur9 h TYR 98 N -0.62 -0.82 -0.14 2.65 3.20 -1.97 -1.62 116.97 117.64 1ur9 h TYR 98 Ca -0.02 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 1ur9 h TYR 98 Cb 0.47 0.37 -0.00 0.00 1.54 0.00 0.00 36.73 39.10 1ur9 h TYR 98 CO 0.05 -0.39 -0.17 1.88 -1.64 0.00 0.00 178.16 177.89 1ur9 h TYR 99 N -0.43 0.44 -0.01 -3.82 0.05 -1.76 -2.99 116.97 108.45 1ur9 h TYR 99 Ca 0.07 -0.14 0.00 0.00 0.05 0.00 0.00 58.73 58.71 1ur9 h TYR 99 Cb 0.53 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.19 1ur9 h TYR 99 CO -0.34 0.77 -0.46 -1.13 -1.05 0.00 0.00 178.16 175.96 1ur9 n SER 100 N -4.53 1.90 -4.66 3.88 3.41 -0.85 -1.67 113.62 111.09 1ur9 n SER 100 Ca -0.06 -1.45 -0.30 0.00 -0.26 0.00 0.00 58.87 56.79 1ur9 n SER 100 Cb 0.38 0.49 0.17 0.00 -0.26 0.00 0.00 64.21 64.99 1ur9 n SER 100 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ur9 s ASN 101 N -2.34 2.86 0.51 4.04 2.20 -0.61 -4.20 114.94 117.39 1ur9 s ASN 101 Ca 0.17 1.82 0.36 0.00 -0.94 0.00 0.00 52.86 54.27 1ur9 s ASN 101 Cb 0.17 -2.41 1.51 0.00 -2.00 0.00 0.00 41.25 38.52 1ur9 s ASN 101 CO 0.54 -3.08 1.71 0.44 -2.94 0.00 0.00 177.10 173.77 1ur9 h ASP 102 N -1.85 0.11 -0.20 3.54 3.32 -1.91 0.44 116.42 119.87 1ur9 h ASP 102 Ca -0.49 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 56.54 1ur9 h ASP 102 Cb 1.28 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.82 1ur9 h ASP 102 CO 0.48 -0.02 -0.07 0.18 -1.72 0.00 0.00 179.24 178.09 1ur9 n LEU 103 N -4.28 3.50 -4.84 1.55 4.77 -1.26 -4.90 117.00 111.53 1ur9 n LEU 103 Ca 0.32 -3.35 -0.31 0.00 -0.03 0.00 0.00 56.01 52.63 1ur9 n LEU 103 Cb 1.42 -0.55 0.01 0.00 -2.33 0.00 0.00 43.42 41.98 1ur9 n LEU 103 CO 0.36 0.93 0.71 -0.83 -1.33 0.00 0.00 177.39 177.23 1ur9 s GLY 104 N -2.46 1.80 0.58 -0.72 0.00 0.15 -4.94 107.32 101.73 1ur9 s GLY 104 Ca 0.40 0.08 0.28 0.00 0.00 0.00 0.00 44.72 45.48 1ur9 s GLY 104 CO 0.03 0.37 2.05 -0.39 0.00 0.00 0.00 173.10 175.16 1ur9 h VAL 105 N -0.10 0.50 0.00 1.40 -1.51 -1.61 -2.29 116.25 112.64 1ur9 h VAL 105 Ca -0.45 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.02 1ur9 h VAL 105 Cb 1.20 0.78 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 1ur9 h VAL 105 CO 0.60 0.00 -0.01 -1.20 -1.23 0.00 0.00 177.57 175.72 1ur9 n SER 106 N -3.89 2.15 -0.21 4.19 7.64 -0.67 -4.87 113.62 117.97 1ur9 n SER 106 Ca 0.04 -2.71 -0.03 0.00 1.01 0.00 0.00 58.87 57.18 1ur9 n SER 106 Cb 0.42 -0.29 0.03 0.00 -1.01 0.00 0.00 64.21 63.36 1ur9 n SER 106 CO 0.00 0.00 0.00 -0.74 -3.01 0.00 0.00 175.04 171.29 1ur9 h HIS 107 N 0.00 -0.71 -0.73 1.43 6.17 -1.13 -1.95 115.15 118.24 1ur9 h HIS 107 Ca 0.00 0.07 0.16 0.00 0.71 0.00 0.00 60.37 61.31 1ur9 h HIS 107 Cb 0.86 0.40 -0.12 0.00 2.52 0.00 0.00 27.41 31.07 1ur9 h HIS 107 CO 0.00 -0.35 0.04 0.00 0.71 0.00 0.00 177.93 178.33 1ur9 h ALA 108 N 1.24 0.79 -0.88 5.26 0.00 -1.89 -1.11 119.26 122.66 1ur9 h ALA 108 Ca 0.26 0.22 0.11 0.00 0.00 0.00 0.00 54.91 55.50 1ur9 h ALA 108 Cb 0.53 0.37 -0.07 0.00 0.00 0.00 0.00 17.79 18.62 1ur9 h ALA 108 CO -0.68 -0.41 0.57 -0.91 0.00 0.00 0.00 179.25 177.83 1ur9 h ASN 109 N 0.13 0.76 -0.44 0.00 2.35 -1.66 0.22 115.58 116.95 1ur9 h ASN 109 Ca 0.40 0.03 -0.13 0.00 -0.55 0.00 0.00 56.30 56.04 1ur9 h ASN 109 Cb 0.69 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 1ur9 h ASN 109 CO -0.61 0.44 -0.24 1.88 -1.65 0.00 0.00 177.43 177.24 1ur9 h TYR 110 N 0.84 1.09 -0.35 1.19 -1.99 -1.24 0.54 116.97 117.05 1ur9 h TYR 110 Ca 0.42 -0.28 -0.15 0.00 2.00 0.00 0.00 58.73 60.72 1ur9 h TYR 110 Cb 0.47 -0.25 -0.01 0.00 2.00 0.00 0.00 36.73 38.94 1ur9 h TYR 110 CO -0.00 1.09 -0.37 0.28 -0.00 0.00 0.00 178.16 179.17 1ur9 h VAL 111 N 0.78 1.28 0.00 -2.88 2.07 -1.06 -3.17 116.25 113.27 1ur9 h VAL 111 Ca 0.09 -1.53 -0.11 0.00 0.82 0.00 0.00 66.70 65.97 1ur9 h VAL 111 Cb 0.82 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.98 1ur9 h VAL 111 CO 0.07 0.51 -0.54 0.78 0.02 0.00 0.00 177.57 178.41 1ur9 h ASN 112 N 0.67 0.00 -0.19 0.57 2.35 -0.47 -3.30 115.58 115.21 1ur9 h ASN 112 Ca 0.06 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 1ur9 h ASN 112 Cb 0.92 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.28 1ur9 h ASN 112 CO 0.08 0.54 0.02 0.00 -1.65 0.00 0.00 177.43 176.42 1ur9 h ALA 113 N 1.46 1.49 -0.45 -0.83 0.00 -0.86 -3.17 119.26 116.91 1ur9 h ALA 113 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1ur9 h ALA 113 Cb 1.40 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1ur9 h ALA 113 CO 0.07 0.37 0.00 1.33 0.00 0.00 0.00 179.25 181.02 1ur9 n VAL 114 N -4.32 0.69 -0.13 0.00 0.24 -1.23 -2.76 118.33 110.82 1ur9 n VAL 114 Ca 0.01 -0.84 -0.10 0.00 -2.04 0.00 0.00 64.34 61.36 1ur9 n VAL 114 Cb 0.21 0.79 -0.02 0.00 -1.47 0.00 0.00 33.84 33.35 1ur9 n VAL 114 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 1ur9 h LYS 115 N 3.86 0.64 -5.37 7.34 3.64 -1.63 -3.41 116.57 121.64 1ur9 h LYS 115 Ca 0.00 -0.19 -0.46 0.00 -1.27 0.00 0.00 60.65 58.73 1ur9 h LYS 115 Cb 0.91 -0.06 -0.14 0.00 -0.41 0.00 0.00 32.23 32.53 1ur9 h LYS 115 CO 0.00 0.73 -0.66 0.95 -2.27 0.00 0.00 179.45 178.20 1ur9 s THR 116 N -5.07 1.44 0.24 1.00 -4.23 -1.26 -4.97 115.64 102.79 1ur9 s THR 116 Ca -0.13 -2.08 -0.05 0.00 -1.18 0.00 0.00 61.69 58.25 1ur9 s THR 116 Cb 0.09 -2.48 0.22 0.00 1.34 0.00 0.00 72.50 71.67 1ur9 s THR 116 CO 0.78 -0.26 1.84 -0.65 -0.54 0.00 0.00 174.62 175.78 1ur9 h PRO 117 N 2.29 0.88 -0.54 3.99 0.11 -1.96 0.53 132.00 137.31 1ur9 h PRO 117 Ca -0.40 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 1ur9 h PRO 117 Cb 1.23 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 1ur9 h PRO 117 CO 0.67 0.58 0.03 0.00 -0.21 0.00 0.00 178.00 179.08 1ur9 h ALA 118 N 1.43 0.72 -0.34 -0.75 0.00 -1.97 0.45 119.26 118.80 1ur9 h ALA 118 Ca 0.39 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 1ur9 h ALA 118 Cb 0.25 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ur9 h ALA 118 CO -0.20 0.51 -0.31 0.66 0.00 0.00 0.00 179.25 179.90 1ur9 h SER 119 N 0.80 0.86 -0.02 0.00 4.64 -1.63 -0.26 113.55 117.94 1ur9 h SER 119 Ca 0.16 -0.46 -0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1ur9 h SER 119 Cb 0.48 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1ur9 h SER 119 CO 0.02 1.14 0.01 0.03 -0.87 0.00 0.00 176.83 177.16 1ur9 h ARG 120 N 0.59 0.04 -0.23 4.77 3.08 0.23 0.29 114.38 123.15 1ur9 h ARG 120 Ca 0.06 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.13 1ur9 h ARG 120 Cb 0.89 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.90 1ur9 h ARG 120 CO 0.08 0.23 0.04 0.00 -1.07 0.00 0.00 179.97 179.24 1ur9 h ALA 121 N 0.81 0.23 -0.62 0.04 0.00 -0.08 0.85 119.26 120.48 1ur9 h ALA 121 Ca 0.01 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ur9 h ALA 121 Cb 0.21 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1ur9 h ALA 121 CO -0.00 -0.39 0.27 -0.22 0.00 0.00 0.00 179.25 178.92 1ur9 h LYS 122 N 0.12 0.89 0.01 0.00 3.64 -0.92 -0.12 116.57 120.19 1ur9 h LYS 122 Ca 0.11 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1ur9 h LYS 122 Cb 0.11 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1ur9 h LYS 122 CO -0.15 0.71 -0.01 0.35 -2.27 0.00 0.00 179.45 178.08 1ur9 h PHE 123 N 0.88 -0.01 -0.80 1.91 3.57 0.54 -2.01 116.94 121.02 1ur9 h PHE 123 Ca 0.21 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.79 1ur9 h PHE 123 Cb 0.13 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.83 1ur9 h PHE 123 CO 0.01 0.64 0.52 0.00 -2.23 0.00 0.00 178.31 177.25 1ur9 h ALA 124 N 0.28 1.68 -0.29 2.41 0.00 0.79 -0.57 119.26 123.56 1ur9 h ALA 124 Ca -0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 1ur9 h ALA 124 Cb 0.66 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1ur9 h ALA 124 CO 0.00 0.18 -0.41 1.96 0.00 0.00 0.00 179.25 180.97 1ur9 h GLN 125 N 0.81 0.71 -0.00 0.00 4.20 -1.03 -2.63 115.11 117.18 1ur9 h GLN 125 Ca 0.36 -0.38 -0.06 0.00 0.06 0.00 0.00 58.65 58.63 1ur9 h GLN 125 Cb 0.33 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1ur9 h GLN 125 CO -0.13 0.99 -0.28 0.66 -0.67 0.00 0.00 178.83 179.40 1ur9 h SER 126 N 0.58 0.01 0.05 1.46 4.64 -0.40 -0.08 113.55 119.81 1ur9 h SER 126 Ca 0.04 -0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1ur9 h SER 126 Cb 0.96 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 1ur9 h SER 126 CO 0.09 0.29 -0.02 0.00 -0.87 0.00 0.00 176.83 176.32 1ur9 h VAL 128 N -0.24 1.26 -0.36 0.00 2.07 -1.18 -0.66 116.25 117.14 1ur9 h VAL 128 Ca -0.01 -0.98 0.07 0.00 0.82 0.00 0.00 66.70 66.61 1ur9 h VAL 128 Cb 0.22 1.25 -0.07 0.00 -1.52 0.00 0.00 31.29 31.17 1ur9 h VAL 128 CO 0.01 0.32 -0.07 0.03 0.02 0.00 0.00 177.57 177.88 1ur9 h ARG 129 N 0.38 0.02 -0.76 1.57 3.08 -0.94 0.17 114.38 117.90 1ur9 h ARG 129 Ca 0.09 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.14 1ur9 h ARG 129 Cb 0.46 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.47 1ur9 h ARG 129 CO 0.02 0.01 0.46 0.82 -1.07 0.00 0.00 179.97 180.21 1ur9 h ILE 130 N 0.02 1.21 0.26 2.04 1.08 -0.90 0.21 117.51 121.43 1ur9 h ILE 130 Ca 0.17 -0.46 0.00 0.00 -0.39 0.00 0.00 64.86 64.19 1ur9 h ILE 130 Cb 0.26 0.15 -0.02 0.00 -3.07 0.00 0.00 36.82 34.14 1ur9 h ILE 130 CO -0.35 0.22 -0.27 -0.03 -0.69 0.00 0.00 178.15 177.02 1ur9 h MET 131 N 1.03 -0.55 -0.51 2.37 4.05 0.32 -2.02 114.93 119.62 1ur9 h MET 131 Ca 0.27 0.04 -0.12 0.00 -0.28 0.00 0.00 59.70 59.61 1ur9 h MET 131 Cb -0.05 0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 30.86 1ur9 h MET 131 CO -0.05 -0.37 -0.13 0.87 0.23 0.00 0.00 176.91 177.46 1ur9 h LYS 132 N -0.57 0.99 -0.73 0.39 1.79 -0.57 0.03 116.57 117.90 1ur9 h LYS 132 Ca -0.01 -0.38 -0.01 0.00 -2.18 0.00 0.00 60.65 58.07 1ur9 h LYS 132 Cb 0.53 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.09 1ur9 h LYS 132 CO -0.07 1.06 0.40 0.22 -1.08 0.00 0.00 179.45 179.99 1ur9 h ASP 133 N 0.86 0.91 0.24 0.86 1.82 -0.50 -3.09 116.42 117.52 1ur9 h ASP 133 Ca 0.13 -0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.67 1ur9 h ASP 133 Cb 0.70 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 40.48 1ur9 h ASP 133 CO 0.05 0.75 -0.58 -1.22 -1.61 0.00 0.00 179.24 176.63 1ur9 n TYR 134 N -4.47 0.00 -0.43 0.28 4.02 -0.77 -4.98 117.16 110.82 1ur9 n TYR 134 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.95 1ur9 n TYR 134 Cb 0.09 -0.12 0.00 0.00 -0.02 0.00 0.00 39.34 39.29 1ur9 n TYR 134 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ur9 n GLY 135 N 1.46 0.75 3.81 2.72 0.00 -0.74 -4.80 105.19 108.38 1ur9 n GLY 135 Ca 0.07 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 1ur9 n GLY 135 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ur9 s PHE 136 N -2.00 3.01 -2.20 1.61 0.08 -0.08 -4.94 117.98 113.46 1ur9 s PHE 136 Ca 0.00 1.45 0.19 0.00 0.12 0.00 0.00 56.93 58.68 1ur9 s PHE 136 Cb 0.00 -2.92 0.12 0.00 -0.57 0.00 0.00 43.02 39.65 1ur9 s PHE 136 CO 0.00 -1.34 1.06 -0.25 -0.10 0.00 0.00 175.22 174.59 1ur9 n ASP 137 N -3.18 2.40 0.00 1.36 8.00 0.41 -4.65 116.55 120.89 1ur9 n ASP 137 Ca 0.08 -1.70 0.00 0.00 0.71 0.00 0.00 54.79 53.88 1ur9 n ASP 137 Cb 0.53 0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.73 1ur9 n ASP 137 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ur9 n GLY 138 N 1.09 -0.81 3.11 0.44 0.00 -1.26 -3.14 105.19 104.63 1ur9 n GLY 138 Ca 0.10 -1.02 -0.29 0.00 0.00 0.00 0.00 46.02 44.82 1ur9 n GLY 138 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ur9 s VAL 139 N -2.00 1.62 -0.08 1.61 1.01 -0.56 -2.42 120.40 119.59 1ur9 s VAL 139 Ca 0.00 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.28 1ur9 s VAL 139 Cb 0.00 -1.44 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 1ur9 s VAL 139 CO 0.00 0.46 -0.23 -0.62 0.00 0.00 0.00 175.10 174.72 1ur9 s ASP 140 N 0.68 3.25 -0.18 3.32 2.15 -0.35 -1.02 116.67 124.51 1ur9 s ASP 140 Ca -0.13 -0.49 -0.02 0.00 0.43 0.00 0.00 52.55 52.34 1ur9 s ASP 140 Cb -0.16 -1.14 -0.01 0.00 -0.30 0.00 0.00 42.92 41.30 1ur9 s ASP 140 CO 0.03 0.21 -0.07 -0.63 -0.17 0.00 0.00 175.17 174.54 1ur9 s ILE 141 N 0.05 3.30 -0.54 4.11 1.01 -0.37 -0.62 121.20 128.15 1ur9 s ILE 141 Ca -0.09 -0.54 0.06 0.00 0.00 0.00 0.00 60.65 60.08 1ur9 s ILE 141 Cb -0.15 -2.46 0.33 0.00 0.01 0.00 0.00 42.46 40.19 1ur9 s ILE 141 CO 0.06 0.47 0.89 -3.20 0.00 0.00 0.00 174.94 173.15 1ur9 n ASN 142 N 4.19 3.65 -4.61 3.58 4.05 0.27 -1.32 115.26 125.07 1ur9 n ASN 142 Ca -0.18 -3.52 -0.42 0.00 0.45 0.00 0.00 54.58 50.91 1ur9 n ASN 142 Cb 0.52 -0.58 -0.04 0.00 1.23 0.00 0.00 39.78 40.90 1ur9 n ASN 142 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 177.26 175.07 1ur9 s TRP 143 N -3.17 3.17 -0.60 1.20 -0.00 -1.26 0.03 118.94 118.32 1ur9 s TRP 143 Ca 0.46 0.83 -0.01 0.00 -0.00 0.00 0.00 56.10 57.38 1ur9 s TRP 143 Cb 0.28 -3.34 0.15 0.00 -0.00 0.00 0.00 33.47 30.56 1ur9 s TRP 143 CO -0.12 -0.64 0.40 -1.21 -0.00 0.00 0.00 176.95 175.38 1ur9 s GLU 144 N 3.11 2.42 0.08 5.86 2.02 -1.26 -4.15 118.70 126.78 1ur9 s GLU 144 Ca 0.34 -2.57 -0.09 0.00 0.02 0.00 0.00 54.97 52.67 1ur9 s GLU 144 Cb -0.14 -3.63 0.00 0.00 0.10 0.00 0.00 34.13 30.47 1ur9 s GLU 144 CO 0.14 -1.16 0.20 0.71 0.02 0.00 0.00 175.26 175.18 1ur9 s TYR 145 N -0.14 0.10 0.24 1.61 2.02 -1.26 -3.77 117.35 116.15 1ur9 s TYR 145 Ca 0.17 -0.47 -0.30 0.00 -0.37 0.00 0.00 57.07 56.11 1ur9 s TYR 145 Cb -0.22 -0.03 -0.10 0.00 -0.40 0.00 0.00 41.96 41.22 1ur9 s TYR 145 CO -0.03 -0.52 1.39 -1.25 -1.57 0.00 0.00 175.55 173.57 1ur9 s PRO 146 N -3.50 4.31 0.86 -1.71 0.04 -1.26 -4.89 135.00 128.84 1ur9 s PRO 146 Ca 0.02 2.23 -0.11 0.00 0.04 0.00 0.00 61.00 63.17 1ur9 s PRO 146 Cb 0.03 -3.13 0.11 0.00 0.04 0.00 0.00 34.50 31.55 1ur9 s PRO 146 CO -0.09 -0.35 1.09 -0.65 0.04 0.00 0.00 177.00 177.04 1ur9 s GLN 147 N -0.44 1.59 0.36 4.56 -1.52 -1.26 -4.72 119.66 118.22 1ur9 s GLN 147 Ca 0.58 0.78 0.09 0.00 -1.95 0.00 0.00 55.36 54.86 1ur9 s GLN 147 Cb -0.40 -1.85 0.83 0.00 -0.22 0.00 0.00 33.01 31.37 1ur9 s GLN 147 CO 0.43 -2.00 1.88 0.00 -0.25 0.00 0.00 175.29 175.34 1ur9 h ALA 148 N -1.37 1.85 0.00 6.09 0.00 -1.94 0.81 119.26 124.70 1ur9 h ALA 148 Ca -0.48 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1ur9 h ALA 148 Cb 1.28 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1ur9 h ALA 148 CO 0.56 -0.08 -0.06 0.00 0.00 0.00 0.00 179.25 179.67 1ur9 h ALA 149 N 1.60 1.01 -0.02 0.00 0.00 -1.91 -2.98 119.26 116.97 1ur9 h ALA 149 Ca 0.43 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1ur9 h ALA 149 Cb 0.70 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1ur9 h ALA 149 CO -0.19 0.07 -0.08 0.39 0.00 0.00 0.00 179.25 179.44 1ur9 n GLU 150 N -3.17 1.72 -0.13 0.00 1.02 0.25 -4.50 120.64 115.84 1ur9 n GLU 150 Ca 0.01 -1.21 -0.11 0.00 -0.02 0.00 0.00 57.16 55.83 1ur9 n GLU 150 Cb 0.35 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.27 1ur9 n GLU 150 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1ur9 h VAL 151 N 2.94 1.27 -1.00 2.62 2.07 -1.32 -2.24 116.25 120.59 1ur9 h VAL 151 Ca 0.00 -1.10 0.03 0.00 0.82 0.00 0.00 66.70 66.46 1ur9 h VAL 151 Cb 0.68 1.24 -0.06 0.00 -1.52 0.00 0.00 31.29 31.64 1ur9 h VAL 151 CO 0.00 0.36 0.66 0.44 0.02 0.00 0.00 177.57 179.05 1ur9 h ASP 152 N 0.49 1.11 -0.29 0.57 3.32 -1.80 0.22 116.42 120.03 1ur9 h ASP 152 Ca 0.10 -0.01 -0.16 0.00 0.02 0.00 0.00 57.03 56.97 1ur9 h ASP 152 Cb 0.55 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1ur9 h ASP 152 CO 0.03 0.77 -0.44 1.23 -1.72 0.00 0.00 179.24 179.11 1ur9 h GLY 153 N 1.29 0.93 0.99 2.75 0.00 -1.79 -0.97 103.07 106.27 1ur9 h GLY 153 Ca 0.39 -0.99 0.00 0.00 0.00 0.00 0.00 47.33 46.74 1ur9 h GLY 153 CO -0.12 0.89 0.15 -2.75 0.00 0.00 0.00 176.54 174.71 1ur9 h PHE 154 N 0.68 0.29 0.64 5.60 3.57 -0.67 -0.45 116.94 126.60 1ur9 h PHE 154 Ca 0.04 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 1ur9 h PHE 154 Cb 1.02 -0.10 0.01 0.00 2.79 0.00 0.00 35.95 39.67 1ur9 h PHE 154 CO 0.06 0.20 -0.31 0.82 -2.23 0.00 0.00 178.31 176.85 1ur9 h ILE 155 N 0.30 0.35 -0.82 1.41 2.04 -0.54 -1.36 117.51 118.88 1ur9 h ILE 155 Ca 0.08 -0.09 0.19 0.00 1.00 0.00 0.00 64.86 66.04 1ur9 h ILE 155 Cb -0.01 0.38 -0.05 0.00 -0.74 0.00 0.00 36.82 36.39 1ur9 h ILE 155 CO -0.02 0.01 0.56 0.00 0.00 0.00 0.00 178.15 178.70 1ur9 h ALA 156 N -0.59 2.29 -0.44 1.87 0.00 -1.11 0.82 119.26 122.10 1ur9 h ALA 156 Ca -0.09 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1ur9 h ALA 156 Cb 0.68 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1ur9 h ALA 156 CO 0.14 -0.53 -0.05 0.00 0.00 0.00 0.00 179.25 178.81 1ur9 h ALA 157 N 1.62 0.60 -0.04 0.00 0.00 -0.45 -1.89 119.26 119.11 1ur9 h ALA 157 Ca 0.41 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1ur9 h ALA 157 Cb 1.13 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1ur9 h ALA 157 CO -0.12 0.44 -0.31 -0.07 0.00 0.00 0.00 179.25 179.19 1ur9 h LEU 158 N 0.65 0.07 -0.63 0.00 3.38 0.19 -1.30 115.31 117.68 1ur9 h LEU 158 Ca 0.12 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 1ur9 h LEU 158 Cb 0.57 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1ur9 h LEU 158 CO 0.03 0.38 -0.09 1.56 0.09 0.00 0.00 178.44 180.42 1ur9 h GLN 159 N 0.07 0.99 -0.37 1.13 4.20 -0.80 -1.06 115.11 119.27 1ur9 h GLN 159 Ca 0.01 -0.35 -0.14 0.00 0.06 0.00 0.00 58.65 58.23 1ur9 h GLN 159 Cb 0.58 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 1ur9 h GLN 159 CO 0.04 1.02 -0.33 0.93 -0.67 0.00 0.00 178.83 179.83 1ur9 h GLU 160 N 0.89 0.87 -0.51 1.46 4.39 -0.75 -1.73 114.58 119.20 1ur9 h GLU 160 Ca 0.14 -0.44 -0.07 0.00 0.34 0.00 0.00 59.36 59.33 1ur9 h GLU 160 Cb 0.64 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.28 1ur9 h GLU 160 CO 0.04 1.09 0.03 0.82 -1.16 0.00 0.00 179.01 179.84 1ur9 h ILE 161 N 0.67 1.26 -0.63 3.13 2.04 -1.18 -1.30 117.51 121.50 1ur9 h ILE 161 Ca 0.06 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 64.90 1ur9 h ILE 161 Cb 0.91 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.89 1ur9 h ILE 161 CO 0.08 0.36 0.41 -0.09 0.00 0.00 0.00 178.15 178.91 1ur9 h ARG 162 N 0.74 0.84 -0.11 2.37 9.65 -1.06 0.22 114.38 127.02 1ur9 h ARG 162 Ca 0.15 -0.06 0.02 0.00 -1.10 0.00 0.00 59.98 58.98 1ur9 h ARG 162 Cb 0.47 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.85 1ur9 h ARG 162 CO 0.02 0.57 0.01 1.15 2.80 0.00 0.00 179.97 184.52 1ur9 h THR 163 N 0.86 0.94 -0.62 0.20 2.02 -1.09 -0.54 112.91 114.68 1ur9 h THR 163 Ca 0.23 -0.02 -0.07 0.00 0.77 0.00 0.00 66.41 67.32 1ur9 h THR 163 Cb -0.07 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 1ur9 h THR 163 CO -0.05 0.01 0.11 -0.07 0.37 0.00 0.00 175.52 175.89 1ur9 h LEU 164 N 0.06 0.97 -0.56 2.58 3.38 -0.61 -2.13 115.31 119.00 1ur9 h LEU 164 Ca 0.05 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 1ur9 h LEU 164 Cb 0.05 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1ur9 h LEU 164 CO -0.08 0.98 0.19 -0.07 0.09 0.00 0.00 178.44 179.55 1ur9 h LEU 165 N 0.92 0.80 -0.79 1.67 3.38 -0.38 0.49 115.31 121.40 1ur9 h LEU 165 Ca 0.19 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1ur9 h LEU 165 Cb 0.41 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 1ur9 h LEU 165 CO 0.01 0.79 0.40 0.78 0.09 0.00 0.00 178.44 180.50 1ur9 h ASN 166 N 0.78 1.02 -0.62 -0.43 4.21 -0.99 0.14 115.58 119.70 1ur9 h ASN 166 Ca 0.18 -0.12 -0.06 0.00 1.21 0.00 0.00 56.30 57.50 1ur9 h ASN 166 Cb 0.26 -0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 37.17 1ur9 h ASN 166 CO -0.01 0.86 0.14 1.56 -1.29 0.00 0.00 177.43 178.69 1ur9 h GLN 167 N 1.11 0.99 -0.32 0.81 4.20 -1.03 -2.89 115.11 117.98 1ur9 h GLN 167 Ca 0.27 -0.25 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 1ur9 h GLN 167 Cb 0.10 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 1ur9 h GLN 167 CO -0.04 0.91 -0.23 0.37 -0.67 0.00 0.00 178.83 179.17 1ur9 h GLN 168 N 0.91 0.63 -0.64 1.46 5.75 -0.12 -1.99 115.11 121.10 1ur9 h GLN 168 Ca 0.19 -0.24 0.04 0.00 -0.15 0.00 0.00 58.65 58.49 1ur9 h GLN 168 Cb 0.37 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.84 1ur9 h GLN 168 CO 0.00 0.81 0.38 1.15 -2.65 0.00 0.00 178.83 178.53 1ur9 h THR 169 N 0.55 1.05 -0.27 2.39 2.02 -0.54 -0.30 112.91 117.81 1ur9 h THR 169 Ca 0.08 -0.26 -0.06 0.00 0.77 0.00 0.00 66.41 66.94 1ur9 h THR 169 Cb 0.69 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1ur9 h THR 169 CO 0.05 0.14 -0.08 0.40 0.37 0.00 0.00 175.52 176.40 1ur9 h ILE 170 N 0.75 1.29 -0.17 3.11 2.04 -1.35 -0.07 117.51 123.11 1ur9 h ILE 170 Ca 0.27 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 65.01 1ur9 h ILE 170 Cb 0.06 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 1ur9 h ILE 170 CO -0.12 0.35 0.11 0.74 0.00 0.00 0.00 178.15 179.22 1ur9 h THR 171 N 0.28 1.05 -0.53 -0.27 2.02 -1.06 -2.47 112.91 111.93 1ur9 h THR 171 Ca 0.07 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1ur9 h THR 171 Cb 0.56 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1ur9 h THR 171 CO 0.03 0.05 0.00 0.47 0.37 0.00 0.00 175.52 176.43 1ur9 n ASP 172 N -4.51 3.54 -3.64 4.18 8.00 -0.15 -4.97 116.55 119.00 1ur9 n ASP 172 Ca -0.01 -1.99 -0.27 0.00 0.71 0.00 0.00 54.79 53.24 1ur9 n ASP 172 Cb 0.08 -0.34 0.04 0.00 -0.02 0.00 0.00 41.12 40.88 1ur9 n ASP 172 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ur9 n GLY 173 N 1.55 -0.52 2.14 0.44 0.00 -0.65 -4.88 105.19 103.27 1ur9 n GLY 173 Ca 0.21 0.19 -0.23 0.00 0.00 0.00 0.00 46.02 46.20 1ur9 n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ur9 n ARG 174 N -4.60 2.17 -0.01 1.61 5.12 -0.13 -4.55 116.66 116.27 1ur9 n ARG 174 Ca 0.01 -2.79 0.17 0.00 -1.93 0.00 0.00 57.85 53.30 1ur9 n ARG 174 Cb 0.55 -2.09 0.63 0.00 -1.16 0.00 0.00 32.46 30.38 1ur9 n ARG 174 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 1ur9 h GLN 175 N 0.95 0.13 0.00 5.56 7.50 -1.90 0.13 115.11 127.48 1ur9 h GLN 175 Ca 0.59 -0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.73 1ur9 h GLN 175 Cb 2.68 -0.03 0.00 0.00 0.05 0.00 0.00 27.48 30.18 1ur9 h GLN 175 CO 1.04 0.08 0.00 0.00 -1.50 0.00 0.00 178.83 178.45 1ur9 h ALA 176 N 1.74 1.00 -0.66 3.87 0.00 -1.97 -3.36 119.26 119.88 1ur9 h ALA 176 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.83 1ur9 h ALA 176 Cb 0.82 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.39 1ur9 h ALA 176 CO -0.03 0.00 -0.69 -0.11 0.00 0.00 0.00 179.25 178.42 1ur9 n LEU 177 N -3.04 -1.91 -4.68 0.00 7.94 -0.36 -5.08 117.00 109.86 1ur9 n LEU 177 Ca 0.04 -3.76 -0.39 0.00 -1.11 0.00 0.00 56.01 50.79 1ur9 n LEU 177 Cb 0.49 0.77 0.04 0.00 0.53 0.00 0.00 43.42 45.25 1ur9 n LEU 177 CO 0.33 2.02 0.76 -2.65 -1.11 0.00 0.00 177.39 176.74 1ur9 n PRO 178 N 1.58 1.35 -2.02 1.96 -0.02 0.32 -4.86 135.00 133.32 1ur9 n PRO 178 Ca 0.13 0.50 -0.39 0.00 -2.02 0.00 0.00 63.50 61.72 1ur9 n PRO 178 Cb 0.60 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1ur9 n PRO 178 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1ur9 s TYR 179 N -1.36 2.70 0.31 6.00 2.02 -1.26 -4.99 117.35 120.77 1ur9 s TYR 179 Ca 0.72 1.41 0.10 0.00 -0.37 0.00 0.00 57.07 58.93 1ur9 s TYR 179 Cb -0.44 -3.67 -0.06 0.00 -0.40 0.00 0.00 41.96 37.40 1ur9 s TYR 179 CO 0.50 -2.21 -0.12 -0.65 -1.57 0.00 0.00 175.55 171.50 1ur9 s GLN 180 N -2.46 1.72 -0.06 -0.62 -0.21 -1.19 -4.87 119.66 111.98 1ur9 s GLN 180 Ca 0.61 -1.85 0.01 0.00 0.02 0.00 0.00 55.36 54.14 1ur9 s GLN 180 Cb -0.37 -1.61 0.02 0.00 1.00 0.00 0.00 33.01 32.05 1ur9 s GLN 180 CO 0.47 0.18 -0.06 -1.17 -2.12 0.00 0.00 175.29 172.59 1ur9 s LEU 181 N -3.54 1.29 0.19 2.90 2.96 -1.26 -1.49 118.68 119.73 1ur9 s LEU 181 Ca 0.31 -0.18 -0.00 0.00 -0.22 0.00 0.00 54.13 54.04 1ur9 s LEU 181 Cb 0.01 -0.58 -0.04 0.00 0.50 0.00 0.00 46.19 46.07 1ur9 s LEU 181 CO 0.15 -0.06 0.09 0.42 -1.32 0.00 0.00 176.35 175.62 1ur9 s THR 182 N 1.09 0.27 0.06 3.68 -4.23 -0.19 -0.81 115.64 115.51 1ur9 s THR 182 Ca -0.08 -1.98 0.01 0.00 -1.18 0.00 0.00 61.69 58.46 1ur9 s THR 182 Cb -0.14 -2.37 -0.03 0.00 1.34 0.00 0.00 72.50 71.29 1ur9 s THR 182 CO -0.01 -0.18 -0.05 0.27 -0.54 0.00 0.00 174.62 174.11 1ur9 s ILE 183 N -3.96 0.42 -0.18 2.99 -4.36 -1.18 -1.24 121.20 113.70 1ur9 s ILE 183 Ca 0.33 -1.58 -0.15 0.00 -0.26 0.00 0.00 60.65 58.99 1ur9 s ILE 183 Cb 0.07 -1.22 -0.04 0.00 1.25 0.00 0.00 42.46 42.52 1ur9 s ILE 183 CO 0.09 -0.77 0.35 0.00 0.24 0.00 0.00 174.94 174.85 1ur9 s ALA 184 N -2.99 3.56 0.15 2.27 0.00 -0.44 -0.76 121.76 123.56 1ur9 s ALA 184 Ca 0.02 -0.48 0.07 0.00 0.00 0.00 0.00 51.96 51.57 1ur9 s ALA 184 Cb 0.01 -2.52 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 1ur9 s ALA 184 CO -0.05 -0.11 0.00 0.20 0.00 0.00 0.00 175.76 175.81 1ur9 s GLY 185 N 0.77 1.78 0.45 0.00 0.00 0.16 -4.76 107.32 105.71 1ur9 s GLY 185 Ca 0.18 -1.29 -0.25 0.00 0.00 0.00 0.00 44.72 43.36 1ur9 s GLY 185 CO 0.06 -1.29 1.34 0.00 0.00 0.00 0.00 173.10 173.21 1ur9 n ALA 186 N 0.09 1.61 0.22 3.20 0.00 -1.26 -0.34 120.51 124.02 1ur9 n ALA 186 Ca -0.10 0.24 0.07 0.00 0.00 0.00 0.00 53.44 53.65 1ur9 n ALA 186 Cb 0.54 -2.32 0.13 0.00 0.00 0.00 0.00 19.45 17.79 1ur9 n ALA 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ur9 n GLY 187 N 0.72 1.26 3.28 0.00 0.00 -1.18 -4.47 105.19 104.80 1ur9 n GLY 187 Ca 0.06 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.37 1ur9 n GLY 187 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ur9 s GLY 188 N -1.12 1.21 0.46 -0.02 0.00 -1.26 -4.57 107.32 102.02 1ur9 s GLY 188 Ca 0.23 -1.17 0.12 0.00 0.00 0.00 0.00 44.72 43.90 1ur9 s GLY 188 CO 0.20 -1.13 2.09 0.00 0.00 0.00 0.00 173.10 174.25 1ur9 h ALA 189 N 4.49 1.89 0.25 3.20 0.00 -1.94 -2.27 119.26 124.88 1ur9 h ALA 189 Ca -0.45 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1ur9 h ALA 189 Cb 1.17 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1ur9 h ALA 189 CO 0.42 0.08 -0.12 0.74 0.00 0.00 0.00 179.25 180.37 1ur9 h PHE 190 N 0.29 -0.31 0.00 0.00 -1.00 -1.95 -0.51 116.94 113.46 1ur9 h PHE 190 Ca 0.11 -0.01 -0.19 0.00 2.81 0.00 0.00 57.97 60.69 1ur9 h PHE 190 Cb 0.07 0.10 -0.03 0.00 3.61 0.00 0.00 35.95 39.70 1ur9 h PHE 190 CO -0.00 -0.17 -0.89 0.74 -1.61 0.00 0.00 178.31 176.38 1ur9 h PHE 191 N -0.38 0.00 -0.81 -0.55 0.04 -1.98 -3.18 116.94 110.08 1ur9 h PHE 191 Ca -0.03 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.73 1ur9 h PHE 191 Cb 0.29 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.40 1ur9 h PHE 191 CO -0.05 0.89 0.50 1.25 -0.60 0.00 0.00 178.31 180.30 1ur9 h LEU 192 N 0.00 0.96 -2.23 1.54 5.85 -1.30 -2.32 115.31 117.80 1ur9 h LEU 192 Ca -0.01 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1ur9 h LEU 192 Cb 1.59 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.38 1ur9 h LEU 192 CO 0.12 0.72 0.14 0.77 -0.34 0.00 0.00 178.44 179.85 1ur9 h SER 193 N 1.11 0.00 -0.46 1.25 4.64 -1.07 -0.03 113.55 118.99 1ur9 h SER 193 Ca 0.29 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.57 1ur9 h SER 193 Cb -0.07 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.00 1ur9 h SER 193 CO -0.06 0.00 0.13 0.03 -0.87 0.00 0.00 176.83 176.06 1ur9 h ARG 194 N 0.00 0.78 0.00 4.77 3.08 -1.58 -3.33 114.38 118.10 1ur9 h ARG 194 Ca 0.00 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.90 1ur9 h ARG 194 Cb 0.28 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.21 1ur9 h ARG 194 CO 0.00 0.70 0.00 2.48 -1.07 0.00 0.00 179.97 182.08 1ur9 n TYR 195 N -4.29 0.00 -0.35 3.04 0.18 -0.75 -3.65 117.16 111.35 1ur9 n TYR 195 Ca 0.04 -0.11 0.18 0.00 1.88 0.00 0.00 57.90 59.88 1ur9 n TYR 195 Cb 0.21 -0.01 0.39 0.00 -0.38 0.00 0.00 39.34 39.55 1ur9 n TYR 195 CO 0.00 0.00 0.00 -0.92 -2.08 0.00 0.00 176.86 173.86 1ur9 h TYR 196 N 0.00 1.01 0.00 -3.48 3.20 -1.14 -1.58 116.97 114.99 1ur9 h TYR 196 Ca 0.00 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 1ur9 h TYR 196 Cb 0.43 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 38.40 1ur9 h TYR 196 CO 0.00 0.06 -0.04 0.66 -1.64 0.00 0.00 178.16 177.20 1ur9 h SER 197 N 0.58 0.00 -0.51 -2.11 4.64 -1.87 -2.82 113.55 111.46 1ur9 h SER 197 Ca 0.65 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.63 1ur9 h SER 197 Cb 1.23 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 63.10 1ur9 h SER 197 CO -0.48 0.04 -0.26 0.29 -0.87 0.00 0.00 176.83 175.55 1ur9 n LYS 198 N -3.25 2.46 -0.32 4.77 5.02 -0.59 -4.76 118.16 121.49 1ur9 n LYS 198 Ca -0.01 -3.53 -0.04 0.00 -2.02 0.00 0.00 58.31 52.70 1ur9 n LYS 198 Cb 0.21 -1.99 0.09 0.00 -0.02 0.00 0.00 35.03 33.31 1ur9 n LYS 198 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1ur9 h LEU 199 N 1.49 1.12 -1.03 -0.35 3.38 -1.53 -1.87 115.31 116.51 1ur9 h LEU 199 Ca 0.29 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.15 1ur9 h LEU 199 Cb 1.44 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 41.85 1ur9 h LEU 199 CO 0.60 0.92 0.65 0.00 0.09 0.00 0.00 178.44 180.70 1ur9 h ALA 200 N 1.25 1.29 -0.09 1.53 0.00 -1.83 -0.51 119.26 120.91 1ur9 h ALA 200 Ca 0.30 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.98 1ur9 h ALA 200 Cb 0.08 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1ur9 h ALA 200 CO -0.04 0.65 -0.66 1.96 0.00 0.00 0.00 179.25 181.16 1ur9 h GLN 201 N 1.33 0.35 -0.19 0.00 4.20 -1.82 -2.18 115.11 116.80 1ur9 h GLN 201 Ca 0.36 -0.26 -0.17 0.00 0.06 0.00 0.00 58.65 58.64 1ur9 h GLN 201 Cb -0.15 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.67 1ur9 h GLN 201 CO -0.08 0.89 -0.57 0.82 -0.67 0.00 0.00 178.83 179.22 1ur9 h ILE 202 N 0.25 1.32 0.00 2.54 2.04 -0.89 -3.29 117.51 119.48 1ur9 h ILE 202 Ca -0.02 -1.82 -0.03 0.00 1.00 0.00 0.00 64.86 63.99 1ur9 h ILE 202 Cb 1.20 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 39.06 1ur9 h ILE 202 CO 0.11 0.57 -0.67 0.58 0.00 0.00 0.00 178.15 178.74 1ur9 h VAL 203 N 0.46 0.15 -0.56 1.67 2.07 -1.11 -3.38 116.25 115.56 1ur9 h VAL 203 Ca 0.00 -1.25 0.07 0.00 0.82 0.00 0.00 66.70 66.34 1ur9 h VAL 203 Cb 1.13 1.83 -0.06 0.00 -1.52 0.00 0.00 31.29 32.67 1ur9 h VAL 203 CO 0.11 0.09 0.25 0.00 0.02 0.00 0.00 177.57 178.03 1ur9 h ALA 204 N 1.88 0.72 0.00 1.67 0.00 -1.46 -1.40 119.26 120.66 1ur9 h ALA 204 Ca -0.02 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ur9 h ALA 204 Cb 1.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1ur9 h ALA 204 CO 0.01 -0.13 0.00 -0.35 0.00 0.00 0.00 179.25 178.78 1ur9 n PRO 205 N -4.93 0.94 -3.95 0.00 -0.04 -1.26 -4.88 135.00 120.88 1ur9 n PRO 205 Ca 0.06 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.24 1ur9 n PRO 205 Cb 0.20 -1.44 -0.04 0.00 -0.04 0.00 0.00 33.50 32.18 1ur9 n PRO 205 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1ur9 s LEU 206 N -1.88 4.28 0.02 1.53 1.43 -0.53 -4.76 118.68 118.76 1ur9 s LEU 206 Ca 0.40 0.18 -0.09 0.00 -1.03 0.00 0.00 54.13 53.59 1ur9 s LEU 206 Cb 0.18 -2.87 -0.31 0.00 0.03 0.00 0.00 46.19 43.22 1ur9 s LEU 206 CO 0.31 0.11 0.92 0.44 0.23 0.00 0.00 176.35 178.36 1ur9 h ASP 207 N 2.65 0.58 -5.02 2.29 3.32 -1.26 -3.48 116.42 115.51 1ur9 h ASP 207 Ca -0.47 -0.71 -0.08 0.00 0.02 0.00 0.00 57.03 55.79 1ur9 h ASP 207 Cb 1.18 -0.19 -0.18 0.00 0.22 0.00 0.00 39.33 40.36 1ur9 h ASP 207 CO 0.71 1.58 -0.08 -0.31 -1.72 0.00 0.00 179.24 179.42 1ur9 s TYR 208 N -2.61 -0.33 -0.23 4.55 2.02 -1.25 -4.63 117.35 114.86 1ur9 s TYR 208 Ca -0.09 0.40 -0.00 0.00 -0.37 0.00 0.00 57.07 57.00 1ur9 s TYR 208 Cb 0.06 0.24 0.03 0.00 -0.40 0.00 0.00 41.96 41.88 1ur9 s TYR 208 CO 0.89 -0.55 -0.10 -1.50 -1.57 0.00 0.00 175.55 172.72 1ur9 s ILE 209 N -2.04 2.59 -0.55 2.71 2.07 0.09 -3.11 121.20 122.97 1ur9 s ILE 209 Ca -0.08 -1.09 -0.24 0.00 -1.41 0.00 0.00 60.65 57.83 1ur9 s ILE 209 Cb -0.02 -2.30 0.04 0.00 0.13 0.00 0.00 42.46 40.32 1ur9 s ILE 209 CO 0.01 0.24 0.92 0.20 -1.91 0.00 0.00 174.94 174.40 1ur9 s ASN 210 N 1.28 6.32 -0.01 4.50 0.02 0.06 -1.31 114.94 125.81 1ur9 s ASN 210 Ca -0.00 -0.43 -0.30 0.00 -1.02 0.00 0.00 52.86 51.11 1ur9 s ASN 210 Cb -0.16 -2.42 -0.04 0.00 0.02 0.00 0.00 41.25 38.65 1ur9 s ASN 210 CO -0.06 -1.21 1.14 -0.76 0.02 0.00 0.00 177.10 176.23 1ur9 s LEU 211 N 3.85 4.33 -1.34 0.60 1.43 0.02 0.37 118.68 127.93 1ur9 s LEU 211 Ca 0.29 1.83 -0.11 0.00 -1.03 0.00 0.00 54.13 55.11 1ur9 s LEU 211 Cb -0.13 -3.57 0.12 0.00 0.03 0.00 0.00 46.19 42.64 1ur9 s LEU 211 CO 0.18 -0.47 1.97 0.23 0.23 0.00 0.00 176.35 178.49 1ur9 n MET 212 N 4.49 3.34 -1.50 1.70 2.81 0.53 -1.30 117.12 127.20 1ur9 n MET 212 Ca 0.09 -3.22 -0.40 0.00 -1.81 0.00 0.00 57.70 52.36 1ur9 n MET 212 Cb 0.47 -3.07 -0.02 0.00 -0.71 0.00 0.00 33.22 29.90 1ur9 n MET 212 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1ur9 n THR 213 N 4.06 4.29 -3.86 2.03 -2.24 -1.26 -3.13 114.28 114.17 1ur9 n THR 213 Ca 0.44 -2.93 -0.10 0.00 -2.27 0.00 0.00 64.05 59.19 1ur9 n THR 213 Cb 0.38 -2.54 0.01 0.00 -2.10 0.00 0.00 70.33 66.07 1ur9 n THR 213 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 1ur9 s TYR 214 N 1.87 0.25 -1.93 4.78 -0.85 -1.26 -4.64 117.35 115.58 1ur9 s TYR 214 Ca 0.63 -0.83 0.00 0.00 -0.52 0.00 0.00 57.07 56.35 1ur9 s TYR 214 Cb 0.17 0.66 0.00 0.00 0.38 0.00 0.00 41.96 43.17 1ur9 s TYR 214 CO -0.07 -1.46 0.00 -0.25 -1.52 0.00 0.00 175.55 172.25 1ur9 n ASP 215 N -1.30 -5.68 -0.10 -0.18 9.92 -1.13 -4.83 116.55 113.24 1ur9 n ASP 215 Ca -0.06 0.20 0.15 0.00 -0.53 0.00 0.00 54.79 54.54 1ur9 n ASP 215 Cb 0.60 -4.84 0.73 0.00 -0.64 0.00 0.00 41.12 36.97 1ur9 n ASP 215 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1ur9 n LEU 216 N -2.75 0.37 -3.86 0.64 4.77 -0.40 -4.78 117.00 110.99 1ur9 n LEU 216 Ca -0.23 -0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.64 1ur9 n LEU 216 Cb 0.68 -0.13 -0.09 0.00 -2.33 0.00 0.00 43.42 41.55 1ur9 n LEU 216 CO 0.30 0.06 -0.13 0.00 -1.33 0.00 0.00 177.39 176.29 1ur9 s ALA 217 N -2.30 -0.33 0.00 -1.18 0.00 -1.26 -4.84 121.76 111.86 1ur9 s ALA 217 Ca 0.35 -0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.05 1ur9 s ALA 217 Cb 0.21 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.55 1ur9 s ALA 217 CO 0.43 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.29 1ur9 n GLY 218 N 0.92 0.99 0.29 0.00 0.00 -1.26 -4.69 105.19 101.44 1ur9 n GLY 218 Ca -0.20 -0.74 0.11 0.00 0.00 0.00 0.00 46.02 45.19 1ur9 n GLY 218 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ur9 h PRO 219 N 0.00 0.00 -0.00 1.61 0.11 -1.90 0.80 132.00 132.62 1ur9 h PRO 219 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1ur9 h PRO 219 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1ur9 h PRO 219 CO 0.00 0.00 -0.01 -2.67 -0.21 0.00 0.00 178.00 175.11 1ur9 n TRP 220 N -2.62 0.00 -4.08 0.65 2.14 -1.26 -4.37 117.44 107.90 1ur9 n TRP 220 Ca -0.01 0.00 -0.28 0.00 2.07 0.00 0.00 57.50 59.28 1ur9 n TRP 220 Cb 0.46 -0.23 -0.06 0.00 -0.81 0.00 0.00 31.31 30.68 1ur9 n TRP 220 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 1ur9 s GLU 221 N -2.46 2.87 0.13 -2.67 0.41 0.27 -5.04 118.70 112.21 1ur9 s GLU 221 Ca 0.32 -0.82 -0.18 0.00 -0.41 0.00 0.00 54.97 53.88 1ur9 s GLU 221 Cb 0.21 -2.66 -0.03 0.00 -1.78 0.00 0.00 34.13 29.86 1ur9 s GLU 221 CO 0.45 0.51 1.79 1.57 -0.49 0.00 0.00 175.26 179.09 1ur9 h LYS 222 N 2.74 0.38 -6.48 1.61 2.10 -1.86 -3.44 116.57 111.62 1ur9 h LYS 222 Ca -0.47 -0.02 -0.67 0.00 -2.00 0.00 0.00 60.65 57.49 1ur9 h LYS 222 Cb 1.19 -0.08 -0.16 0.00 -0.90 0.00 0.00 32.23 32.27 1ur9 h LYS 222 CO 0.64 0.26 -0.73 0.14 -2.00 0.00 0.00 179.45 177.76 1ur9 s VAL 223 N -6.15 3.45 0.61 0.07 -7.23 -1.26 -4.20 120.40 105.70 1ur9 s VAL 223 Ca -0.13 -1.14 -0.19 0.00 -1.81 0.00 0.00 61.98 58.71 1ur9 s VAL 223 Cb 0.09 -2.59 -0.03 0.00 0.56 0.00 0.00 36.38 34.42 1ur9 s VAL 223 CO 0.71 0.18 1.25 0.42 -0.31 0.00 0.00 175.10 177.35 1ur9 s THR 224 N -1.17 2.36 0.11 5.32 -4.23 -0.42 -4.84 115.64 112.77 1ur9 s THR 224 Ca 0.21 0.23 -0.26 0.00 -1.18 0.00 0.00 61.69 60.69 1ur9 s THR 224 Cb -0.11 -3.09 0.08 0.00 1.34 0.00 0.00 72.50 70.71 1ur9 s THR 224 CO 0.13 -0.05 0.87 0.21 -0.54 0.00 0.00 174.62 175.24 1ur9 s ASN 225 N -1.47 -0.30 0.22 3.99 3.04 -1.26 -1.84 114.94 117.32 1ur9 s ASN 225 Ca 0.79 -0.22 -0.30 0.00 0.04 0.00 0.00 52.86 53.17 1ur9 s ASN 225 Cb -0.34 0.48 -0.09 0.00 -1.54 0.00 0.00 41.25 39.77 1ur9 s ASN 225 CO 0.36 -0.84 1.15 -1.00 -3.04 0.00 0.00 177.10 173.73 1ur9 s HIS 226 N -3.33 3.49 -1.13 0.43 3.76 -1.26 -4.75 115.29 112.51 1ur9 s HIS 226 Ca 0.08 1.56 0.27 0.00 -0.15 0.00 0.00 55.06 56.81 1ur9 s HIS 226 Cb -0.02 -3.36 0.82 0.00 1.11 0.00 0.00 32.58 31.13 1ur9 s HIS 226 CO -0.03 -0.89 1.63 0.00 -0.85 0.00 0.00 174.74 174.60 1ur9 n GLN 227 N 1.92 0.14 -2.70 1.40 10.64 -1.26 -4.16 117.38 123.35 1ur9 n GLN 227 Ca 0.02 -0.06 -0.06 0.00 -1.83 0.00 0.00 57.00 55.07 1ur9 n GLN 227 Cb 0.45 -1.50 0.08 0.00 -0.86 0.00 0.00 30.24 28.41 1ur9 n GLN 227 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ur9 n ALA 228 N -1.38 2.47 -1.86 2.61 0.00 -1.26 -1.28 120.51 119.81 1ur9 n ALA 228 Ca 0.07 -2.11 -0.42 0.00 0.00 0.00 0.00 53.44 50.99 1ur9 n ALA 228 Cb 0.33 -0.93 -0.02 0.00 0.00 0.00 0.00 19.45 18.83 1ur9 n ALA 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ur9 s ALA 229 N -1.60 3.69 -0.02 0.00 0.00 -1.26 -4.75 121.76 117.83 1ur9 s ALA 229 Ca 0.22 1.40 -0.26 0.00 0.00 0.00 0.00 51.96 53.33 1ur9 s ALA 229 Cb 0.42 -3.59 -0.20 0.00 0.00 0.00 0.00 23.12 19.74 1ur9 s ALA 229 CO -0.04 -0.81 1.26 1.25 0.00 0.00 0.00 175.76 177.42 1ur9 h LEU 230 N 5.41 -0.03 -9.43 0.00 5.85 -1.59 0.20 115.31 115.71 1ur9 h LEU 230 Ca -0.45 -0.45 -0.55 0.00 0.84 0.00 0.00 57.88 57.27 1ur9 h LEU 230 Cb 1.21 0.01 -0.13 0.00 0.37 0.00 0.00 40.66 42.12 1ur9 h LEU 230 CO 0.81 0.44 -0.61 -0.36 -0.34 0.00 0.00 178.44 178.38 1ur9 s PHE 231 N -4.29 2.23 0.39 1.25 0.08 -1.24 -1.52 117.98 114.87 1ur9 s PHE 231 Ca -0.16 -0.80 -0.09 0.00 0.12 0.00 0.00 56.93 56.01 1ur9 s PHE 231 Cb 0.02 -1.51 -0.06 0.00 -0.57 0.00 0.00 43.02 40.90 1ur9 s PHE 231 CO 0.65 0.25 0.72 0.20 -0.10 0.00 0.00 175.22 176.94 1ur9 s GLY 232 N -3.59 1.87 -0.18 4.36 0.00 0.23 -3.99 107.32 106.01 1ur9 s GLY 232 Ca 0.35 -0.32 -0.00 0.00 0.00 0.00 0.00 44.72 44.75 1ur9 s GLY 232 CO 0.16 -0.15 -0.15 -0.35 0.00 0.00 0.00 173.10 172.61 1ur9 s ASP 233 N -3.26 3.56 0.57 1.64 -1.08 -1.26 0.68 116.67 117.51 1ur9 s ASP 233 Ca 0.49 -0.54 0.27 0.00 -0.52 0.00 0.00 52.55 52.25 1ur9 s ASP 233 Cb -0.10 -1.57 1.56 0.00 -1.46 0.00 0.00 42.92 41.35 1ur9 s ASP 233 CO 0.32 0.02 2.06 0.00 0.52 0.00 0.00 175.17 178.09 1ur9 h ALA 234 N 7.83 1.99 0.00 3.66 0.00 -1.98 0.79 119.26 131.56 1ur9 h ALA 234 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1ur9 h ALA 234 Cb 1.16 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1ur9 h ALA 234 CO 0.61 -0.38 -0.08 0.00 0.00 0.00 0.00 179.25 179.40 1ur9 n ALA 235 N -2.41 2.53 -1.97 0.00 0.00 -1.26 -4.89 120.51 112.51 1ur9 n ALA 235 Ca 0.03 -0.14 -0.25 0.00 0.00 0.00 0.00 53.44 53.08 1ur9 n ALA 235 Cb 0.39 -1.41 0.12 0.00 0.00 0.00 0.00 19.45 18.55 1ur9 n ALA 235 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ur9 s GLY 236 N -3.01 1.76 0.71 0.00 0.00 0.27 -4.95 107.32 102.11 1ur9 s GLY 236 Ca 0.13 -1.50 -0.13 0.00 0.00 0.00 0.00 44.72 43.22 1ur9 s GLY 236 CO 0.56 -0.93 1.09 2.56 0.00 0.00 0.00 173.10 176.38 1ur9 s PRO 237 N -5.29 2.59 0.17 2.90 0.04 -1.26 -4.99 135.00 129.16 1ur9 s PRO 237 Ca 0.67 1.24 0.07 0.00 0.04 0.00 0.00 61.00 63.02 1ur9 s PRO 237 Cb -0.06 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 1ur9 s PRO 237 CO 0.46 -1.40 -0.14 0.95 0.04 0.00 0.00 177.00 176.91 1ur9 s THR 238 N -2.66 1.58 0.18 1.26 -4.23 -1.26 -4.71 115.64 105.80 1ur9 s THR 238 Ca 0.63 -2.05 0.05 0.00 -1.18 0.00 0.00 61.69 59.14 1ur9 s THR 238 Cb -0.18 -1.89 -0.05 0.00 1.34 0.00 0.00 72.50 71.72 1ur9 s THR 238 CO 0.49 -0.55 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.58 1ur9 s PHE 239 N -2.75 1.43 0.21 3.99 0.40 -0.19 -4.86 117.98 116.21 1ur9 s PHE 239 Ca 0.18 -0.77 -0.30 0.00 -0.60 0.00 0.00 56.93 55.43 1ur9 s PHE 239 Cb -0.02 -0.75 -0.09 0.00 0.51 0.00 0.00 43.02 42.67 1ur9 s PHE 239 CO 0.05 0.10 1.43 -0.47 0.70 0.00 0.00 175.22 177.03 1ur9 s TYR 240 N -3.29 3.11 -0.98 0.36 6.14 -1.26 -1.16 117.35 120.26 1ur9 s TYR 240 Ca 0.21 0.99 -0.20 0.00 0.64 0.00 0.00 57.07 58.70 1ur9 s TYR 240 Cb 0.03 -3.78 0.10 0.00 0.42 0.00 0.00 41.96 38.73 1ur9 s TYR 240 CO 0.04 -2.60 1.28 1.21 0.64 0.00 0.00 175.55 176.12 1ur9 s ASN 241 N 0.59 6.60 0.58 4.32 3.84 -1.26 -4.85 114.94 124.76 1ur9 s ASN 241 Ca 0.61 -1.85 0.28 0.00 0.21 0.00 0.00 52.86 52.11 1ur9 s ASN 241 Cb -0.40 -2.47 1.56 0.00 -0.55 0.00 0.00 41.25 39.39 1ur9 s ASN 241 CO 0.38 -1.23 2.03 0.00 -2.79 0.00 0.00 177.10 175.49 1ur9 h ALA 242 N 9.13 2.00 0.00 1.71 0.00 -1.91 -2.14 119.26 128.05 1ur9 h ALA 242 Ca 0.19 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1ur9 h ALA 242 Cb 1.01 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1ur9 h ALA 242 CO 1.25 -0.45 -0.11 -0.07 0.00 0.00 0.00 179.25 179.87 1ur9 h LEU 243 N 0.00 0.00 -0.77 0.00 3.38 -1.89 -1.99 115.31 114.04 1ur9 h LEU 243 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1ur9 h LEU 243 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1ur9 h LEU 243 CO -0.00 0.11 0.00 -2.11 0.09 0.00 0.00 178.44 176.53 1ur9 n ARG 244 N -3.62 0.11 0.00 1.13 1.85 -0.81 -1.47 116.66 113.85 1ur9 n ARG 244 Ca -0.02 0.50 0.10 0.00 -1.00 0.00 0.00 57.85 57.44 1ur9 n ARG 244 Cb 0.23 -1.79 0.08 0.00 -1.05 0.00 0.00 32.46 29.94 1ur9 n ARG 244 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1ur9 n GLU 245 N -2.01 1.82 -1.61 2.89 -0.58 -0.75 -5.00 120.64 115.40 1ur9 n GLU 245 Ca 0.00 -1.69 -0.35 0.00 -0.42 0.00 0.00 57.16 54.71 1ur9 n GLU 245 Cb 0.10 -1.39 0.07 0.00 -0.57 0.00 0.00 31.44 29.65 1ur9 n GLU 245 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ur9 s ALA 246 N -1.72 2.26 -1.37 0.62 0.00 -0.54 -4.87 121.76 116.14 1ur9 s ALA 246 Ca 0.24 0.90 -0.15 0.00 0.00 0.00 0.00 51.96 52.94 1ur9 s ALA 246 Cb 0.17 -3.46 0.07 0.00 0.00 0.00 0.00 23.12 19.91 1ur9 s ALA 246 CO 0.26 -1.64 1.97 -1.71 0.00 0.00 0.00 175.76 174.64 1ur9 n ASN 247 N -2.39 4.46 -0.05 0.00 5.15 -1.26 -4.53 115.26 116.64 1ur9 n ASN 247 Ca 0.13 -2.91 -0.08 0.00 -0.60 0.00 0.00 54.58 51.12 1ur9 n ASN 247 Cb 0.50 -1.66 -0.14 0.00 -0.53 0.00 0.00 39.78 37.94 1ur9 n ASN 247 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1ur9 n LEU 248 N 6.56 0.55 0.00 1.20 4.77 -1.26 -4.83 117.00 123.99 1ur9 n LEU 248 Ca 0.49 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.72 1ur9 n LEU 248 Cb 0.41 0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.78 1ur9 n LEU 248 CO 0.83 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.90 1ur9 n GLY 249 N 1.61 0.50 3.87 -0.72 0.00 -1.26 -5.04 105.19 104.15 1ur9 n GLY 249 Ca -0.22 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.00 1ur9 n GLY 249 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ur9 s TRP 250 N -2.00 3.47 0.72 1.61 0.51 -1.26 -5.08 118.94 116.92 1ur9 s TRP 250 Ca 0.00 1.10 -0.11 0.00 -2.12 0.00 0.00 56.10 54.97 1ur9 s TRP 250 Cb 0.00 -2.50 0.02 0.00 -0.81 0.00 0.00 33.47 30.19 1ur9 s TRP 250 CO 0.00 -0.17 1.08 -1.54 -0.51 0.00 0.00 176.95 175.81 1ur9 s SER 251 N -3.20 5.21 0.22 2.95 1.04 -1.26 -4.77 113.70 113.89 1ur9 s SER 251 Ca 0.52 1.35 -0.09 0.00 0.48 0.00 0.00 55.95 58.21 1ur9 s SER 251 Cb -0.10 -2.18 0.34 0.00 0.10 0.00 0.00 66.02 64.18 1ur9 s SER 251 CO 0.32 -1.52 1.67 -0.25 0.98 0.00 0.00 173.24 174.45 1ur9 h TRP 252 N -0.77 0.08 -0.58 5.02 7.01 -1.99 -0.13 115.95 124.59 1ur9 h TRP 252 Ca -0.45 0.04 0.01 0.00 2.11 0.00 0.00 58.89 60.61 1ur9 h TRP 252 Cb 1.24 0.06 -0.03 0.00 -2.10 0.00 0.00 29.16 28.33 1ur9 h TRP 252 CO 0.54 -0.12 0.37 0.93 -2.79 0.00 0.00 178.44 177.37 1ur9 h GLU 253 N 0.18 0.73 -0.27 2.65 4.39 -1.99 0.52 114.58 120.78 1ur9 h GLU 253 Ca 0.35 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.97 1ur9 h GLU 253 Cb 0.57 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1ur9 h GLU 253 CO -0.51 0.48 0.06 0.93 -1.16 0.00 0.00 179.01 178.81 1ur9 h GLU 254 N 0.75 0.45 -0.42 2.33 5.08 -1.65 -1.22 114.58 119.90 1ur9 h GLU 254 Ca 0.22 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1ur9 h GLU 254 Cb -0.04 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 1ur9 h GLU 254 CO -0.07 0.55 0.21 -0.07 -1.00 0.00 0.00 179.01 178.63 1ur9 h LEU 255 N 0.27 0.54 -0.64 1.33 3.38 -0.86 -2.24 115.31 117.09 1ur9 h LEU 255 Ca 0.08 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1ur9 h LEU 255 Cb 0.31 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1ur9 h LEU 255 CO 0.00 0.51 0.27 0.74 0.09 0.00 0.00 178.44 180.05 1ur9 h THR 256 N 0.53 1.23 -0.03 0.22 2.02 -0.77 0.16 112.91 116.27 1ur9 h THR 256 Ca 0.14 -0.71 -0.10 0.00 0.77 0.00 0.00 66.41 66.51 1ur9 h THR 256 Cb 0.11 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 1ur9 h THR 256 CO -0.02 0.28 -0.46 0.03 0.37 0.00 0.00 175.52 175.72 1ur9 h ARG 257 N 0.90 0.06 0.05 6.66 3.08 -1.16 -3.21 114.38 120.77 1ur9 h ARG 257 Ca 0.22 -0.03 -0.30 0.00 0.07 0.00 0.00 59.98 59.93 1ur9 h ARG 257 Cb 0.19 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 1ur9 h ARG 257 CO -0.02 0.52 -1.66 0.00 -1.07 0.00 0.00 179.97 177.73 1ur9 h ALA 258 N 1.48 0.55 -2.18 0.04 0.00 -1.20 -0.14 119.26 117.81 1ur9 h ALA 258 Ca 0.00 -1.32 -0.59 0.00 0.00 0.00 0.00 54.91 53.00 1ur9 h ALA 258 Cb 0.84 0.43 -0.42 0.00 0.00 0.00 0.00 17.79 18.64 1ur9 h ALA 258 CO 0.06 1.40 -0.67 1.19 0.00 0.00 0.00 179.25 181.23 1ur9 n PHE 259 N -3.25 3.17 -1.67 0.00 3.72 0.54 -4.10 117.46 115.86 1ur9 n PHE 259 Ca -0.18 -4.06 -0.38 0.00 -0.05 0.00 0.00 57.45 52.78 1ur9 n PHE 259 Cb 1.04 -0.52 0.05 0.00 -0.94 0.00 0.00 39.48 39.10 1ur9 n PHE 259 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1ur9 n PRO 260 N 0.72 1.25 -3.70 -1.08 -0.04 -1.23 -4.79 135.00 126.13 1ur9 n PRO 260 Ca 0.29 0.47 -0.12 0.00 -0.04 0.00 0.00 63.50 64.10 1ur9 n PRO 260 Cb 0.43 -2.33 -0.10 0.00 -0.04 0.00 0.00 33.50 31.46 1ur9 n PRO 260 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ur9 s SER 261 N -1.08 -0.53 1.04 3.54 0.15 -1.26 -4.31 113.70 111.25 1ur9 s SER 261 Ca 0.73 0.95 -0.14 0.00 0.70 0.00 0.00 55.95 58.19 1ur9 s SER 261 Cb -0.43 0.90 0.21 0.00 -1.71 0.00 0.00 66.02 64.98 1ur9 s SER 261 CO 0.48 -0.18 1.12 -2.16 1.20 0.00 0.00 173.24 173.70 1ur9 s PRO 262 N 0.82 0.12 0.20 5.44 0.04 -1.26 -4.97 135.00 135.39 1ur9 s PRO 262 Ca -0.05 0.27 -0.06 0.00 0.04 0.00 0.00 61.00 61.20 1ur9 s PRO 262 Cb -0.05 -1.72 -0.02 0.00 0.04 0.00 0.00 34.50 32.74 1ur9 s PRO 262 CO -0.06 -2.89 0.26 -0.59 0.04 0.00 0.00 177.00 173.76 1ur9 s PHE 263 N -3.08 0.72 -0.19 0.56 -0.71 -0.31 -4.86 117.98 110.11 1ur9 s PHE 263 Ca 0.67 -1.03 -0.21 0.00 -1.04 0.00 0.00 56.93 55.32 1ur9 s PHE 263 Cb -0.15 -0.22 -0.03 0.00 -1.21 0.00 0.00 43.02 41.41 1ur9 s PHE 263 CO 0.56 -0.74 0.62 -1.12 -1.34 0.00 0.00 175.22 173.19 1ur9 s SER 264 N -3.06 6.68 -0.80 1.98 0.01 -1.26 -1.02 113.70 116.23 1ur9 s SER 264 Ca 0.27 0.82 -0.26 0.00 1.31 0.00 0.00 55.95 58.10 1ur9 s SER 264 Cb 0.04 -2.34 0.02 0.00 0.21 0.00 0.00 66.02 63.95 1ur9 s SER 264 CO 0.07 -0.25 1.50 -0.22 0.41 0.00 0.00 173.24 174.75 1ur9 s LEU 265 N 1.81 3.27 0.34 2.44 2.96 -1.26 -4.72 118.68 123.52 1ur9 s LEU 265 Ca 0.28 -0.56 0.03 0.00 -0.22 0.00 0.00 54.13 53.66 1ur9 s LEU 265 Cb -0.16 -2.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.93 1ur9 s LEU 265 CO 0.10 -1.95 0.11 0.42 -1.32 0.00 0.00 176.35 173.71 1ur9 s THR 266 N 6.61 0.71 0.12 3.68 -4.23 -1.26 -4.72 115.64 116.55 1ur9 s THR 266 Ca 0.47 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.83 1ur9 s THR 266 Cb -0.07 -2.56 -0.03 0.00 1.34 0.00 0.00 72.50 71.18 1ur9 s THR 266 CO 0.08 0.00 1.55 0.58 -0.54 0.00 0.00 174.62 176.30 1ur9 h VAL 267 N 2.07 1.26 -0.73 2.29 2.07 -0.64 -2.59 116.25 119.97 1ur9 h VAL 267 Ca -0.37 -1.02 0.07 0.00 0.82 0.00 0.00 66.70 66.19 1ur9 h VAL 267 Cb 1.26 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 32.15 1ur9 h VAL 267 CO 0.60 0.34 0.41 -0.78 0.02 0.00 0.00 177.57 178.17 1ur9 h ASP 268 N 0.49 0.61 -0.48 0.57 3.58 -1.49 -1.57 116.42 118.14 1ur9 h ASP 268 Ca 0.10 0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.60 1ur9 h ASP 268 Cb 0.49 -0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.42 1ur9 h ASP 268 CO 0.02 0.39 0.30 0.00 -2.88 0.00 0.00 179.24 177.07 1ur9 h ALA 269 N 1.38 0.61 -0.55 -0.78 0.00 -1.73 -1.02 119.26 117.16 1ur9 h ALA 269 Ca 0.33 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 1ur9 h ALA 269 Cb 0.22 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1ur9 h ALA 269 CO -0.20 0.01 0.14 0.00 0.00 0.00 0.00 179.25 179.20 1ur9 h ALA 270 N 1.20 0.72 0.29 0.00 0.00 -1.04 0.43 119.26 120.85 1ur9 h ALA 270 Ca 0.19 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1ur9 h ALA 270 Cb -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1ur9 h ALA 270 CO -0.07 0.41 -0.14 0.28 0.00 0.00 0.00 179.25 179.73 1ur9 h VAL 271 N 0.77 0.73 -0.67 0.00 2.07 -1.00 -2.38 116.25 115.77 1ur9 h VAL 271 Ca 0.17 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.67 1ur9 h VAL 271 Cb 0.32 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 1ur9 h VAL 271 CO -0.00 0.01 0.42 1.56 0.02 0.00 0.00 177.57 179.58 1ur9 h GLN 272 N -0.41 0.81 -0.62 1.57 1.08 -1.10 -0.54 115.11 115.90 1ur9 h GLN 272 Ca -0.04 -0.05 0.11 0.00 -1.45 0.00 0.00 58.65 57.22 1ur9 h GLN 272 Cb 0.31 -0.18 -0.04 0.00 -0.05 0.00 0.00 27.48 27.52 1ur9 h GLN 272 CO 0.06 0.54 0.42 1.96 -0.95 0.00 0.00 178.83 180.86 1ur9 h GLN 273 N 0.84 0.36 0.08 1.46 4.20 -0.73 0.47 115.11 121.79 1ur9 h GLN 273 Ca 0.26 -0.02 -0.27 0.00 0.06 0.00 0.00 58.65 58.68 1ur9 h GLN 273 Cb -0.01 -0.08 0.03 0.00 0.30 0.00 0.00 27.48 27.72 1ur9 h GLN 273 CO -0.09 0.24 -1.12 0.45 -0.67 0.00 0.00 178.83 177.63 1ur9 h HIS 274 N 0.37 0.97 0.00 2.96 3.86 -0.82 -3.26 115.15 119.22 1ur9 h HIS 274 Ca 0.29 -0.59 -0.04 0.00 -1.16 0.00 0.00 60.37 58.88 1ur9 h HIS 274 Cb 0.65 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 29.02 1ur9 h HIS 274 CO -0.00 1.43 -0.19 -0.07 0.86 0.00 0.00 177.93 179.96 1ur9 h LEU 275 N 0.23 0.00 -2.41 2.43 3.38 -0.17 -2.50 115.31 116.28 1ur9 h LEU 275 Ca -0.16 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 1ur9 h LEU 275 Cb 1.80 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.55 1ur9 h LEU 275 CO 0.22 0.19 -0.01 0.24 0.09 0.00 0.00 178.44 179.16 1ur9 h MET 276 N 0.00 0.00 -6.27 1.13 2.86 -0.98 -3.31 114.93 108.36 1ur9 h MET 276 Ca -0.00 0.00 -0.55 0.00 -2.06 0.00 0.00 59.70 57.09 1ur9 h MET 276 Cb 0.39 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 1ur9 h MET 276 CO 0.02 0.01 0.08 -1.64 1.06 0.00 0.00 176.91 176.45 1ur9 s MET 277 N -4.03 4.41 0.45 1.72 -1.94 -0.94 0.12 119.30 119.09 1ur9 s MET 277 Ca -0.03 0.93 -0.24 0.00 -1.71 0.00 0.00 55.69 54.65 1ur9 s MET 277 Cb 0.12 -3.32 -0.08 0.00 2.01 0.00 0.00 34.83 33.57 1ur9 s MET 277 CO 0.47 0.43 1.24 -1.21 -0.01 0.00 0.00 175.02 175.94 1ur9 s GLU 278 N -0.49 3.76 0.00 2.03 2.02 -1.26 -2.97 118.70 121.79 1ur9 s GLU 278 Ca 0.34 1.99 0.00 0.00 0.02 0.00 0.00 54.97 57.32 1ur9 s GLU 278 Cb -0.20 -2.54 0.00 0.00 0.10 0.00 0.00 34.13 31.49 1ur9 s GLU 278 CO 0.21 -0.61 0.00 0.41 0.02 0.00 0.00 175.26 175.30 1ur9 n GLY 279 N 0.60 0.68 3.03 -1.39 0.00 -1.26 -4.48 105.19 102.37 1ur9 n GLY 279 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1ur9 n GLY 279 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ur9 s VAL 280 N -2.49 2.98 0.20 1.61 1.01 -1.16 -4.66 120.40 117.89 1ur9 s VAL 280 Ca 0.00 -2.82 -0.30 0.00 0.00 0.00 0.00 61.98 58.86 1ur9 s VAL 280 Cb 0.00 -3.04 -0.09 0.00 0.00 0.00 0.00 36.38 33.26 1ur9 s VAL 280 CO 0.00 -0.77 1.27 -2.16 0.00 0.00 0.00 175.10 173.44 1ur9 s PRO 281 N 0.24 4.43 0.37 2.72 0.04 -1.26 -4.74 135.00 136.79 1ur9 s PRO 281 Ca 0.14 2.00 0.10 0.00 0.04 0.00 0.00 61.00 63.28 1ur9 s PRO 281 Cb -0.22 -3.20 0.85 0.00 0.04 0.00 0.00 34.50 31.96 1ur9 s PRO 281 CO -0.03 -0.19 1.88 0.66 0.04 0.00 0.00 177.00 179.36 1ur9 h SER 282 N 5.20 0.62 0.42 6.66 4.64 -1.90 -1.09 113.55 128.10 1ur9 h SER 282 Ca -0.45 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1ur9 h SER 282 Cb 1.21 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1ur9 h SER 282 CO 0.76 0.32 0.00 0.00 -0.87 0.00 0.00 176.83 177.04 1ur9 h ALA 283 N 1.60 1.00 0.00 5.18 0.00 -1.86 -1.70 119.26 123.48 1ur9 h ALA 283 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1ur9 h ALA 283 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1ur9 h ALA 283 CO -0.18 0.00 -0.74 1.63 0.00 0.00 0.00 179.25 179.96 1ur9 n LYS 284 N -2.51 0.06 -2.82 0.00 5.02 -0.41 -3.18 118.16 114.32 1ur9 n LYS 284 Ca -0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.88 1ur9 n LYS 284 Cb 0.15 -1.52 -0.03 0.00 -0.02 0.00 0.00 35.03 33.60 1ur9 n LYS 284 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ur9 s ILE 285 N -3.04 4.89 -0.12 -0.18 1.01 -0.65 -0.73 121.20 122.37 1ur9 s ILE 285 Ca 0.09 1.81 0.02 0.00 0.00 0.00 0.00 60.65 62.57 1ur9 s ILE 285 Cb 0.16 -4.21 -0.00 0.00 0.01 0.00 0.00 42.46 38.42 1ur9 s ILE 285 CO 0.77 0.11 -0.19 -0.69 0.00 0.00 0.00 174.94 174.93 1ur9 s VAL 286 N 1.51 2.47 -0.15 2.92 1.01 -0.42 -0.38 120.40 127.35 1ur9 s VAL 286 Ca 0.44 -0.86 -0.22 0.00 0.00 0.00 0.00 61.98 61.35 1ur9 s VAL 286 Cb -0.18 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1ur9 s VAL 286 CO 0.19 0.54 0.65 -0.32 0.00 0.00 0.00 175.10 176.16 1ur9 s MET 287 N 0.48 4.29 0.33 2.72 1.75 -0.49 -0.80 119.30 127.58 1ur9 s MET 287 Ca -0.13 0.70 -0.11 0.00 -1.25 0.00 0.00 55.69 54.90 1ur9 s MET 287 Cb -0.17 -3.53 -0.07 0.00 2.84 0.00 0.00 34.83 33.90 1ur9 s MET 287 CO 0.05 -0.13 0.70 0.20 -0.65 0.00 0.00 175.02 175.19 1ur9 s GLY 288 N 1.03 2.14 0.05 2.11 0.00 -0.42 -0.61 107.32 111.61 1ur9 s GLY 288 Ca 0.32 -0.16 0.01 0.00 0.00 0.00 0.00 44.72 44.89 1ur9 s GLY 288 CO 0.12 0.02 -0.05 -1.34 0.00 0.00 0.00 173.10 171.85 1ur9 s VAL 289 N -2.10 0.39 -0.03 1.40 -7.23 0.67 -4.17 120.40 109.34 1ur9 s VAL 289 Ca 0.51 -1.27 -0.11 0.00 -1.81 0.00 0.00 61.98 59.30 1ur9 s VAL 289 Cb -0.10 -0.80 -0.05 0.00 0.56 0.00 0.00 36.38 35.98 1ur9 s VAL 289 CO 0.24 -0.58 0.32 -2.16 -0.31 0.00 0.00 175.10 172.61 1ur9 s PRO 290 N -2.23 3.74 -0.20 4.82 0.04 -1.26 -1.99 135.00 137.92 1ur9 s PRO 290 Ca -0.06 0.19 0.15 0.00 0.04 0.00 0.00 61.00 61.33 1ur9 s PRO 290 Cb -0.05 -3.18 0.76 0.00 0.04 0.00 0.00 34.50 32.07 1ur9 s PRO 290 CO -0.02 0.70 1.68 1.19 0.04 0.00 0.00 177.00 180.59 1ur9 n PHE 291 N 1.73 1.79 -4.15 0.56 3.01 -0.11 -4.50 117.46 115.79 1ur9 n PHE 291 Ca -0.15 -0.72 -0.10 0.00 1.01 0.00 0.00 57.45 57.49 1ur9 n PHE 291 Cb 0.53 -0.42 -0.10 0.00 -0.01 0.00 0.00 39.48 39.48 1ur9 n PHE 291 CO 0.00 0.00 0.00 1.52 1.01 0.00 0.00 176.76 179.29 1ur9 s TYR 292 N -2.54 0.85 0.27 1.38 1.13 -1.26 -0.79 117.35 116.40 1ur9 s TYR 292 Ca 0.52 -1.20 0.11 0.00 -1.41 0.00 0.00 57.07 55.10 1ur9 s TYR 292 Cb 0.38 -0.49 -0.05 0.00 -1.10 0.00 0.00 41.96 40.71 1ur9 s TYR 292 CO 0.17 -0.48 -0.16 0.20 -2.51 0.00 0.00 175.55 172.78 1ur9 s GLY 293 N -3.04 1.83 -0.11 5.49 0.00 0.71 -4.50 107.32 107.70 1ur9 s GLY 293 Ca 0.22 -1.82 0.01 0.00 0.00 0.00 0.00 44.72 43.13 1ur9 s GLY 293 CO 0.01 -1.91 -0.14 0.50 0.00 0.00 0.00 173.10 171.56 1ur9 s ARG 294 N -3.53 3.15 -0.01 2.90 0.52 -0.23 -2.25 118.95 119.51 1ur9 s ARG 294 Ca 0.30 -0.70 0.02 0.00 -0.52 0.00 0.00 55.73 54.82 1ur9 s ARG 294 Cb -0.05 -2.55 -0.04 0.00 0.52 0.00 0.00 34.95 32.84 1ur9 s ARG 294 CO 0.16 0.31 -0.02 0.00 0.02 0.00 0.00 175.30 175.77 1ur9 s ALA 295 N 0.09 3.21 0.10 2.13 0.00 0.66 -1.32 121.76 126.64 1ur9 s ALA 295 Ca -0.06 -0.96 0.07 0.00 0.00 0.00 0.00 51.96 51.01 1ur9 s ALA 295 Cb -0.15 -1.30 -0.03 0.00 0.00 0.00 0.00 23.12 21.64 1ur9 s ALA 295 CO 0.05 0.63 -0.18 -0.06 0.00 0.00 0.00 175.76 176.20 1ur9 s PHE 296 N -1.05 1.58 0.26 0.00 0.40 0.08 -4.62 117.98 114.63 1ur9 s PHE 296 Ca 0.18 -0.45 0.07 0.00 -0.60 0.00 0.00 56.93 56.13 1ur9 s PHE 296 Cb -0.11 -0.86 -0.05 0.00 0.51 0.00 0.00 43.02 42.51 1ur9 s PHE 296 CO 0.09 0.17 -0.08 -1.59 0.70 0.00 0.00 175.22 174.51 1ur9 s LYS 297 N -2.03 1.48 -0.51 0.44 -2.85 -1.26 -1.85 119.74 113.16 1ur9 s LYS 297 Ca 0.05 -1.73 0.00 0.00 -1.00 0.00 0.00 55.97 53.30 1ur9 s LYS 297 Cb -0.09 -1.10 0.00 0.00 -2.06 0.00 0.00 37.83 34.58 1ur9 s LYS 297 CO 0.04 0.06 0.00 0.41 0.10 0.00 0.00 175.35 175.96 1ur9 n GLY 298 N -0.52 0.28 3.85 0.59 0.00 -0.79 -0.63 105.19 107.97 1ur9 n GLY 298 Ca -0.06 -0.68 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 1ur9 n GLY 298 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ur9 s VAL 299 N -2.27 4.73 0.05 1.61 -7.23 -0.72 -4.14 120.40 112.44 1ur9 s VAL 299 Ca 0.00 0.86 -0.21 0.00 -1.81 0.00 0.00 61.98 60.83 1ur9 s VAL 299 Cb 0.00 -3.63 -0.06 0.00 0.56 0.00 0.00 36.38 33.24 1ur9 s VAL 299 CO 0.00 -0.12 0.61 -0.44 -0.31 0.00 0.00 175.10 174.84 1ur9 s SER 300 N -2.23 7.07 1.01 4.85 0.01 -1.26 -4.72 113.70 118.43 1ur9 s SER 300 Ca 0.51 1.27 -0.16 0.00 1.31 0.00 0.00 55.95 58.89 1ur9 s SER 300 Cb -0.11 -2.38 0.20 0.00 0.21 0.00 0.00 66.02 63.94 1ur9 s SER 300 CO 0.18 0.20 1.19 -0.83 0.41 0.00 0.00 173.24 174.39 1ur9 s GLY 301 N -0.74 1.64 0.00 3.44 0.00 -1.26 -4.07 107.32 106.33 1ur9 s GLY 301 Ca 0.31 -0.87 0.00 0.00 0.00 0.00 0.00 44.72 44.16 1ur9 s GLY 301 CO 0.19 -0.15 0.00 0.61 0.00 0.00 0.00 173.10 173.75 1ur9 n GLY 302 N -2.36 3.78 2.78 0.20 0.00 -1.26 -4.88 105.19 103.45 1ur9 n GLY 302 Ca 0.11 -0.96 -0.02 0.00 0.00 0.00 0.00 46.02 45.16 1ur9 n GLY 302 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ur9 n ASN 303 N 0.00 1.07 -0.14 1.61 5.15 -1.26 -4.96 115.26 116.73 1ur9 n ASN 303 Ca 0.00 -2.18 -0.02 0.00 -0.60 0.00 0.00 54.58 51.79 1ur9 n ASN 303 Cb 0.00 -0.30 -0.01 0.00 -0.53 0.00 0.00 39.78 38.94 1ur9 n ASN 303 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ur9 n GLY 304 N -0.62 0.44 0.31 8.20 0.00 -1.26 -2.18 105.19 110.08 1ur9 n GLY 304 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1ur9 n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ur9 n GLY 305 N -1.39 0.41 3.75 -0.02 0.00 -1.26 -4.51 105.19 102.18 1ur9 n GLY 305 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1ur9 n GLY 305 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ur9 s GLN 306 N -0.90 4.59 -1.41 1.61 -0.21 -0.93 -3.90 119.66 118.52 1ur9 s GLN 306 Ca 0.00 1.81 -0.10 0.00 0.02 0.00 0.00 55.36 57.09 1ur9 s GLN 306 Cb 0.00 -3.22 0.03 0.00 1.00 0.00 0.00 33.01 30.83 1ur9 s GLN 306 CO 0.00 0.10 1.13 0.66 -2.12 0.00 0.00 175.29 175.07 1ur9 n TYR 307 N 1.73 -2.74 -4.26 0.91 4.01 -0.77 -4.71 117.16 111.33 1ur9 n TYR 307 Ca 0.01 0.99 -0.27 0.00 -0.16 0.00 0.00 57.90 58.47 1ur9 n TYR 307 Cb 0.45 -4.75 -0.09 0.00 -0.31 0.00 0.00 39.34 34.64 1ur9 n TYR 307 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1ur9 s SER 308 N -3.31 4.39 0.92 7.72 0.15 -1.25 -4.73 113.70 117.58 1ur9 s SER 308 Ca 0.61 -0.52 -0.11 0.00 0.70 0.00 0.00 55.95 56.63 1ur9 s SER 308 Cb -0.28 -0.80 0.14 0.00 -1.71 0.00 0.00 66.02 63.37 1ur9 s SER 308 CO 0.76 0.11 1.09 -0.94 1.20 0.00 0.00 173.24 175.45 1ur9 s SER 309 N -2.79 3.26 0.32 5.45 1.04 -1.26 -1.31 113.70 118.40 1ur9 s SER 309 Ca 0.25 1.57 -0.12 0.00 0.48 0.00 0.00 55.95 58.13 1ur9 s SER 309 Cb -0.09 -2.23 0.02 0.00 0.10 0.00 0.00 66.02 63.81 1ur9 s SER 309 CO 0.16 -2.79 0.60 -1.38 0.98 0.00 0.00 173.24 170.81 1ur9 s HIS 310 N -2.87 0.41 -0.33 5.02 -3.43 -1.26 -4.08 115.29 108.76 1ur9 s HIS 310 Ca 0.64 -0.84 0.11 0.00 -0.80 0.00 0.00 55.06 54.17 1ur9 s HIS 310 Cb -0.19 0.37 0.46 0.00 -1.43 0.00 0.00 32.58 31.79 1ur9 s HIS 310 CO 0.58 -1.23 1.12 -1.13 -2.00 0.00 0.00 174.74 172.07 1ur9 n SER 311 N -0.97 3.65 -4.66 7.38 3.41 0.20 -4.97 113.62 117.66 1ur9 n SER 311 Ca -0.03 -3.23 -0.37 0.00 -0.26 0.00 0.00 58.87 54.98 1ur9 n SER 311 Cb 0.61 -0.43 -0.09 0.00 -0.26 0.00 0.00 64.21 64.04 1ur9 n SER 311 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1ur9 s THR 312 N -4.47 5.34 0.40 6.66 2.01 -1.25 -4.81 115.64 119.52 1ur9 s THR 312 Ca 0.42 0.25 -0.26 0.00 0.31 0.00 0.00 61.69 62.40 1ur9 s THR 312 Cb 0.40 -3.53 -0.09 0.00 0.01 0.00 0.00 72.50 69.29 1ur9 s THR 312 CO -0.04 0.33 1.26 -2.16 -0.69 0.00 0.00 174.62 173.32 1ur9 s PRO 313 N 1.12 4.01 0.00 4.92 0.04 -1.26 -4.81 135.00 139.03 1ur9 s PRO 313 Ca 0.09 2.06 0.21 0.00 0.04 0.00 0.00 61.00 63.40 1ur9 s PRO 313 Cb -0.14 -2.75 -0.22 0.00 0.04 0.00 0.00 34.50 31.43 1ur9 s PRO 313 CO 0.05 -0.43 0.89 0.41 0.04 0.00 0.00 177.00 177.96 1ur9 n GLY 314 N 0.68 -0.93 3.61 0.56 0.00 -1.26 -4.83 105.19 103.02 1ur9 n GLY 314 Ca 0.04 -0.59 -0.43 0.00 0.00 0.00 0.00 46.02 45.04 1ur9 n GLY 314 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ur9 n GLU 315 N -1.45 1.46 -3.38 1.61 4.71 -1.26 -4.79 120.64 117.54 1ur9 n GLU 315 Ca 0.04 0.52 -0.43 0.00 -0.01 0.00 0.00 57.16 57.27 1ur9 n GLU 315 Cb 0.33 -1.99 -0.09 0.00 -1.01 0.00 0.00 31.44 28.68 1ur9 n GLU 315 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1ur9 s ASP 316 N -0.59 6.15 0.00 1.62 -1.08 -1.26 -4.01 116.67 117.50 1ur9 s ASP 316 Ca 0.60 -0.95 0.00 0.00 -0.52 0.00 0.00 52.55 51.67 1ur9 s ASP 316 Cb -0.62 -2.19 0.00 0.00 -1.46 0.00 0.00 42.92 38.64 1ur9 s ASP 316 CO 0.59 -0.57 0.00 -2.65 0.52 0.00 0.00 175.17 173.06 1ur9 n PRO 317 N 5.36 0.00 -1.59 4.34 -0.02 -1.26 -5.04 135.00 136.79 1ur9 n PRO 317 Ca -0.10 0.00 -0.54 0.00 -2.02 0.00 0.00 63.50 60.84 1ur9 n PRO 317 Cb 0.46 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.87 1ur9 n PRO 317 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1ur9 n TYR 318 N 1.66 1.90 -2.38 6.00 4.19 -1.26 -4.82 117.16 122.45 1ur9 n TYR 318 Ca 0.00 0.37 -0.43 0.00 3.31 0.00 0.00 57.90 61.16 1ur9 n TYR 318 Cb 0.00 -2.51 0.00 0.00 0.49 0.00 0.00 39.34 37.32 1ur9 n TYR 318 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 1ur9 n PRO 319 N 6.70 3.13 0.00 2.98 -0.04 -1.26 -4.87 135.00 141.64 1ur9 n PRO 319 Ca 0.33 -3.15 0.00 0.00 -0.04 0.00 0.00 63.50 60.64 1ur9 n PRO 319 Cb 0.18 -3.40 0.00 0.00 -0.04 0.00 0.00 33.50 30.24 1ur9 n PRO 319 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ur9 n SER 320 N 7.48 0.00 -0.02 3.54 2.88 -1.26 -4.96 113.62 121.27 1ur9 n SER 320 Ca 0.49 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 58.04 1ur9 n SER 320 Cb 0.44 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.92 1ur9 n SER 320 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1ur9 n THR 321 N -0.87 1.11 -2.71 2.46 -2.24 -1.26 -4.92 114.28 105.85 1ur9 n THR 321 Ca 0.00 -1.15 -0.42 0.00 -2.27 0.00 0.00 64.05 60.21 1ur9 n THR 321 Cb 0.00 0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 68.61 1ur9 n THR 321 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ur9 s ASP 322 N -1.22 6.40 -0.96 3.42 3.68 -1.26 -4.94 116.67 121.79 1ur9 s ASP 322 Ca 0.04 -1.31 -0.16 0.00 2.13 0.00 0.00 52.55 53.26 1ur9 s ASP 322 Cb 0.04 -2.50 0.17 0.00 -1.45 0.00 0.00 42.92 39.18 1ur9 s ASP 322 CO 0.01 -1.45 1.08 -0.31 0.13 0.00 0.00 175.17 174.63 1ur9 s TYR 323 N 4.38 3.42 -1.62 -5.34 2.02 -1.26 -4.82 117.35 114.13 1ur9 s TYR 323 Ca 0.36 -1.75 0.30 0.00 -0.37 0.00 0.00 57.07 55.61 1ur9 s TYR 323 Cb -0.06 -4.14 1.46 0.00 -0.40 0.00 0.00 41.96 38.82 1ur9 s TYR 323 CO -0.01 -1.31 2.00 -2.67 -1.57 0.00 0.00 175.55 171.99 1ur9 n TRP 324 N 5.49 0.00 -2.69 2.71 4.27 -1.26 -4.67 117.44 121.29 1ur9 n TRP 324 Ca 0.23 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.42 1ur9 n TRP 324 Cb 0.47 -0.20 -0.03 0.00 -1.36 0.00 0.00 31.31 30.19 1ur9 n TRP 324 CO 0.00 0.00 0.00 -1.17 -2.29 0.00 0.00 177.69 174.23 1ur9 s LEU 325 N -2.44 3.96 0.06 5.67 2.96 -1.26 -4.95 118.68 122.69 1ur9 s LEU 325 Ca 0.32 -1.37 -0.37 0.00 -0.22 0.00 0.00 54.13 52.49 1ur9 s LEU 325 Cb 0.20 -2.50 -0.18 0.00 0.50 0.00 0.00 46.19 44.21 1ur9 s LEU 325 CO 0.45 -1.44 1.12 0.52 -1.32 0.00 0.00 176.35 175.68 1ur9 n VAL 326 N 6.31 0.27 -0.53 1.68 0.31 -1.26 -1.36 118.33 123.74 1ur9 n VAL 326 Ca 0.20 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.47 1ur9 n VAL 326 Cb 0.49 -0.37 0.00 0.00 -0.91 0.00 0.00 33.84 33.06 1ur9 n VAL 326 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ur9 n GLY 327 N 1.92 1.10 3.45 2.92 0.00 -1.26 -4.96 105.19 108.36 1ur9 n GLY 327 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1ur9 n GLY 327 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ur9 h GLU 329 N 9.49 0.14 -0.70 0.00 5.08 -1.93 -3.15 114.58 123.51 1ur9 h GLU 329 Ca -0.24 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 57.98 1ur9 h GLU 329 Cb 1.07 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 1ur9 h GLU 329 CO 1.18 0.81 0.39 0.93 -1.00 0.00 0.00 179.01 181.31 1ur9 h GLU 330 N 0.09 0.97 -0.98 2.33 5.08 -1.96 -0.49 114.58 119.62 1ur9 h GLU 330 Ca -0.02 -0.11 0.12 0.00 -1.00 0.00 0.00 59.36 58.35 1ur9 h GLU 330 Cb 1.29 -0.19 -0.08 0.00 0.50 0.00 0.00 28.75 30.26 1ur9 h GLU 330 CO 0.11 0.72 0.62 0.00 -1.00 0.00 0.00 179.01 179.46 1ur9 h VAL 332 N 0.97 1.10 -0.22 0.00 2.07 -1.47 0.67 116.25 119.37 1ur9 h VAL 332 Ca 0.48 -1.06 0.06 0.00 0.82 0.00 0.00 66.70 67.00 1ur9 h VAL 332 Cb 0.48 1.74 -0.06 0.00 -1.52 0.00 0.00 31.29 31.93 1ur9 h VAL 332 CO -0.24 0.24 -0.21 -0.09 0.02 0.00 0.00 177.57 177.29 1ur9 h ARG 333 N -0.67 -0.21 -0.35 1.57 1.12 -0.11 -2.14 114.38 113.59 1ur9 h ARG 333 Ca -0.02 0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1ur9 h ARG 333 Cb 0.51 0.05 0.00 0.00 -0.01 0.00 0.00 29.97 30.52 1ur9 h ARG 333 CO 0.03 -0.14 0.00 -0.25 -3.11 0.00 0.00 179.97 176.49 1ur9 n ASP 334 N -5.35 2.47 -3.68 -3.80 8.00 0.46 -4.98 116.55 109.66 1ur9 n ASP 334 Ca -0.01 -1.90 -0.25 0.00 0.71 0.00 0.00 54.79 53.34 1ur9 n ASP 334 Cb 0.27 -0.23 0.03 0.00 -0.02 0.00 0.00 41.12 41.17 1ur9 n ASP 334 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1ur9 n LYS 335 N 0.84 -3.05 -3.19 -1.24 5.02 0.19 -4.99 118.16 111.75 1ur9 n LYS 335 Ca 0.17 0.56 0.04 0.00 -2.02 0.00 0.00 58.31 57.06 1ur9 n LYS 335 Cb 0.43 -4.77 -0.02 0.00 -0.02 0.00 0.00 35.03 30.65 1ur9 n LYS 335 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ur9 s ASP 336 N -3.94 -0.83 -0.01 4.39 -1.08 0.95 -4.60 116.67 111.55 1ur9 s ASP 336 Ca 0.22 0.59 0.08 0.00 -0.52 0.00 0.00 52.55 52.92 1ur9 s ASP 336 Cb -0.07 1.72 0.25 0.00 -1.46 0.00 0.00 42.92 43.37 1ur9 s ASP 336 CO 0.83 -0.16 1.18 -0.81 0.52 0.00 0.00 175.17 176.73 1ur9 n PRO 337 N 5.41 1.74 0.00 4.34 -0.04 -1.26 -4.06 135.00 141.13 1ur9 n PRO 337 Ca -0.05 -1.02 0.12 0.00 -0.04 0.00 0.00 63.50 62.51 1ur9 n PRO 337 Cb 0.52 -1.28 0.15 0.00 -0.04 0.00 0.00 33.50 32.85 1ur9 n PRO 337 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1ur9 n ARG 338 N 0.30 0.90 -4.02 0.54 1.74 -1.26 -4.56 116.66 110.31 1ur9 n ARG 338 Ca 0.09 -0.67 -0.13 0.00 -0.77 0.00 0.00 57.85 56.37 1ur9 n ARG 338 Cb 0.28 -1.49 -0.14 0.00 -1.02 0.00 0.00 32.46 30.09 1ur9 n ARG 338 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1ur9 s ILE 339 N -2.56 0.23 -0.14 0.55 -1.09 -1.26 -0.24 121.20 116.70 1ur9 s ILE 339 Ca 0.20 -0.29 -0.13 0.00 -2.23 0.00 0.00 60.65 58.19 1ur9 s ILE 339 Cb 0.18 -0.23 0.04 0.00 -1.58 0.00 0.00 42.46 40.87 1ur9 s ILE 339 CO 0.58 -0.04 0.38 0.00 -1.23 0.00 0.00 174.94 174.63 1ur9 s ALA 340 N -0.34 -0.94 0.61 9.38 0.00 -0.95 -4.68 121.76 124.84 1ur9 s ALA 340 Ca -0.02 1.05 -0.16 0.00 0.00 0.00 0.00 51.96 52.84 1ur9 s ALA 340 Cb -0.03 -0.60 -0.03 0.00 0.00 0.00 0.00 23.12 22.46 1ur9 s ALA 340 CO -0.00 -0.18 1.08 -1.54 0.00 0.00 0.00 175.76 175.11 1ur9 s SER 341 N 0.16 5.58 0.37 0.00 1.04 -1.26 -0.21 113.70 119.38 1ur9 s SER 341 Ca -0.00 1.90 0.09 0.00 0.48 0.00 0.00 55.95 58.42 1ur9 s SER 341 Cb -0.03 -2.54 0.82 0.00 0.10 0.00 0.00 66.02 64.37 1ur9 s SER 341 CO 0.01 -1.30 1.90 0.22 0.98 0.00 0.00 173.24 175.05 1ur9 h TYR 342 N 0.40 0.76 -0.47 5.02 3.20 -0.74 0.68 116.97 125.81 1ur9 h TYR 342 Ca -0.47 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.44 1ur9 h TYR 342 Cb 1.23 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 39.23 1ur9 h TYR 342 CO 0.57 0.32 0.27 -0.09 -1.64 0.00 0.00 178.16 177.59 1ur9 h ARG 343 N 0.68 0.52 0.02 1.82 2.43 -1.66 -0.77 114.38 117.43 1ur9 h ARG 343 Ca 0.39 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.53 1ur9 h ARG 343 Cb 0.58 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1ur9 h ARG 343 CO -0.16 0.35 -0.01 0.37 -1.51 0.00 0.00 179.97 179.01 1ur9 h GLN 344 N 0.54 -0.03 -0.95 0.20 5.75 -1.41 -2.97 115.11 116.24 1ur9 h GLN 344 Ca 0.19 0.00 0.14 0.00 -0.15 0.00 0.00 58.65 58.83 1ur9 h GLN 344 Cb 0.03 0.01 -0.09 0.00 1.07 0.00 0.00 27.48 28.50 1ur9 h GLN 344 CO -0.09 0.26 0.56 -0.07 -2.65 0.00 0.00 178.83 176.84 1ur9 h LEU 345 N -0.32 0.77 -0.79 -2.39 3.38 -0.69 0.66 115.31 115.93 1ur9 h LEU 345 Ca -0.00 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1ur9 h LEU 345 Cb 0.31 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1ur9 h LEU 345 CO 0.01 0.36 0.47 -0.08 0.09 0.00 0.00 178.44 179.28 1ur9 h GLU 346 N 0.82 1.08 0.00 1.13 4.81 -1.11 0.29 114.58 121.60 1ur9 h GLU 346 Ca 0.50 -0.10 -0.10 0.00 -0.13 0.00 0.00 59.36 59.52 1ur9 h GLU 346 Cb 0.63 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1ur9 h GLU 346 CO -0.32 0.77 -0.49 1.96 -0.73 0.00 0.00 179.01 180.20 1ur9 h GLN 347 N 1.08 0.00 -0.10 1.92 4.20 -0.92 -1.51 115.11 119.78 1ur9 h GLN 347 Ca 0.28 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.85 1ur9 h GLN 347 Cb -0.02 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 1ur9 h GLN 347 CO -0.05 0.49 -0.55 0.52 -0.67 0.00 0.00 178.83 178.57 1ur9 h MET 348 N 0.00 0.29 -0.15 1.46 2.86 -0.03 -0.83 114.93 118.53 1ur9 h MET 348 Ca -0.00 -0.18 -0.18 0.00 -2.06 0.00 0.00 59.70 57.27 1ur9 h MET 348 Cb 0.93 0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.62 1ur9 h MET 348 CO 0.06 0.77 -0.62 -0.07 1.06 0.00 0.00 176.91 178.11 1ur9 h LEU 349 N 0.22 0.80 0.00 1.22 3.38 -0.56 -3.25 115.31 117.13 1ur9 h LEU 349 Ca 0.00 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 57.35 1ur9 h LEU 349 Cb 1.04 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1ur9 h LEU 349 CO 0.09 1.29 -0.21 0.00 0.09 0.00 0.00 178.44 179.70 1ur9 n GLN 350 N -4.09 0.19 -0.12 1.13 10.64 -0.61 -3.25 117.38 121.28 1ur9 n GLN 350 Ca -0.07 0.12 0.03 0.00 -1.83 0.00 0.00 57.00 55.24 1ur9 n GLN 350 Cb 0.66 -1.69 0.08 0.00 -0.86 0.00 0.00 30.24 28.44 1ur9 n GLN 350 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1ur9 n GLY 351 N 1.37 0.28 3.64 2.61 0.00 -0.32 -4.93 105.19 107.85 1ur9 n GLY 351 Ca 0.05 -0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.63 1ur9 n GLY 351 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ur9 n ASN 352 N 0.05 -3.53 -1.43 1.61 3.02 -1.20 -4.85 115.26 108.92 1ur9 n ASN 352 Ca 0.06 -0.83 0.11 0.00 -0.03 0.00 0.00 54.58 53.89 1ur9 n ASN 352 Cb 0.22 -1.22 0.33 0.00 -0.61 0.00 0.00 39.78 38.51 1ur9 n ASN 352 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1ur9 n TYR 353 N -2.69 1.19 0.00 3.10 4.01 -1.25 -4.92 117.16 116.60 1ur9 n TYR 353 Ca -0.21 -0.55 0.00 0.00 -0.16 0.00 0.00 57.90 56.98 1ur9 n TYR 353 Cb 0.51 -0.11 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 1ur9 n TYR 353 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ur9 n GLY 354 N 1.38 0.99 3.83 2.72 0.00 -1.26 -4.96 105.19 107.90 1ur9 n GLY 354 Ca 0.25 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.89 1ur9 n GLY 354 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ur9 s TYR 355 N -2.00 3.71 -0.14 1.61 2.02 -1.26 -4.18 117.35 117.11 1ur9 s TYR 355 Ca 0.00 1.06 -0.01 0.00 -0.37 0.00 0.00 57.07 57.76 1ur9 s TYR 355 Cb 0.00 -2.35 -0.01 0.00 -0.40 0.00 0.00 41.96 39.20 1ur9 s TYR 355 CO 0.00 0.58 -0.12 -0.65 -1.57 0.00 0.00 175.55 173.79 1ur9 s GLN 356 N -1.34 3.40 -0.30 -0.62 -0.21 -0.40 -4.94 119.66 115.24 1ur9 s GLN 356 Ca 0.29 -0.67 -0.22 0.00 0.02 0.00 0.00 55.36 54.78 1ur9 s GLN 356 Cb -0.17 -2.69 -0.01 0.00 1.00 0.00 0.00 33.01 31.15 1ur9 s GLN 356 CO 0.17 0.17 0.70 0.50 -2.12 0.00 0.00 175.29 174.70 1ur9 s ARG 357 N 0.48 3.94 0.41 2.91 3.52 -1.26 -1.86 118.95 127.09 1ur9 s ARG 357 Ca -0.08 0.44 0.07 0.00 -0.13 0.00 0.00 55.73 56.03 1ur9 s ARG 357 Cb -0.16 -3.72 -0.04 0.00 -1.56 0.00 0.00 34.95 29.47 1ur9 s ARG 357 CO 0.04 -0.61 0.24 -0.51 -0.81 0.00 0.00 175.30 173.65 1ur9 s LEU 358 N 2.75 3.22 -0.02 -0.88 1.43 0.06 -4.98 118.68 120.27 1ur9 s LEU 358 Ca 0.28 -0.95 0.00 0.00 -1.03 0.00 0.00 54.13 52.44 1ur9 s LEU 358 Cb -0.15 -1.66 0.02 0.00 0.03 0.00 0.00 46.19 44.44 1ur9 s LEU 358 CO 0.12 -0.56 0.02 0.86 0.23 0.00 0.00 176.35 177.02 1ur9 s TRP 359 N -2.55 0.03 -0.32 0.29 -0.11 -1.26 -1.95 118.94 113.07 1ur9 s TRP 359 Ca 0.43 0.10 -0.11 0.00 1.22 0.00 0.00 56.10 57.75 1ur9 s TRP 359 Cb 0.01 -0.19 -0.01 0.00 -1.50 0.00 0.00 33.47 31.78 1ur9 s TRP 359 CO 0.24 -0.07 0.18 1.21 -4.62 0.00 0.00 176.95 173.89 1ur9 s ASN 360 N 0.86 5.72 0.00 5.86 3.84 -0.61 -4.95 114.94 125.66 1ur9 s ASN 360 Ca -0.07 -0.53 0.26 0.00 0.21 0.00 0.00 52.86 52.73 1ur9 s ASN 360 Cb -0.10 -2.04 1.49 0.00 -0.55 0.00 0.00 41.25 40.04 1ur9 s ASN 360 CO -0.02 -0.22 1.97 -0.67 -2.79 0.00 0.00 177.10 175.36 1ur9 n ASP 361 N 5.02 0.22 -0.12 -4.21 2.03 -1.26 -0.45 116.55 117.78 1ur9 n ASP 361 Ca -0.13 -1.23 -0.24 0.00 0.52 0.00 0.00 54.79 53.70 1ur9 n ASP 361 Cb 0.49 -0.01 -0.10 0.00 -0.72 0.00 0.00 41.12 40.78 1ur9 n ASP 361 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1ur9 n LYS 362 N -0.75 0.57 0.23 -0.67 4.76 -1.26 -4.36 118.16 116.68 1ur9 n LYS 362 Ca 0.20 0.41 0.13 0.00 -2.87 0.00 0.00 58.31 56.18 1ur9 n LYS 362 Cb 0.13 -1.61 0.27 0.00 -1.84 0.00 0.00 35.03 31.98 1ur9 n LYS 362 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 1ur9 h THR 363 N -1.00 0.05 -5.35 -0.18 1.35 -1.69 -3.36 112.91 102.74 1ur9 h THR 363 Ca -0.49 -0.96 -0.33 0.00 -0.55 0.00 0.00 66.41 64.08 1ur9 h THR 363 Cb 1.41 1.92 0.14 0.00 -1.73 0.00 0.00 68.15 69.88 1ur9 h THR 363 CO -0.30 0.03 -0.65 0.29 -0.25 0.00 0.00 175.52 174.64 1ur9 n LYS 364 N -3.11 -6.69 -4.00 4.72 4.76 0.40 -1.55 118.16 112.69 1ur9 n LYS 364 Ca 0.03 0.76 -0.10 0.00 -2.87 0.00 0.00 58.31 56.13 1ur9 n LYS 364 Cb 0.49 -5.56 -0.11 0.00 -1.84 0.00 0.00 35.03 28.02 1ur9 n LYS 364 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1ur9 s THR 365 N -3.31 0.20 0.61 -0.18 -4.23 -1.09 -4.43 115.64 103.22 1ur9 s THR 365 Ca 0.30 -0.99 -0.02 0.00 -1.18 0.00 0.00 61.69 59.80 1ur9 s THR 365 Cb -0.13 -0.40 0.05 0.00 1.34 0.00 0.00 72.50 73.35 1ur9 s THR 365 CO 0.66 -0.50 0.87 -2.16 -0.54 0.00 0.00 174.62 172.94 1ur9 s PRO 366 N -1.62 2.39 0.05 3.99 0.04 -1.26 -1.57 135.00 137.03 1ur9 s PRO 366 Ca -0.13 -0.60 -0.26 0.00 0.04 0.00 0.00 61.00 60.05 1ur9 s PRO 366 Cb -0.09 -2.37 0.07 0.00 0.04 0.00 0.00 34.50 32.15 1ur9 s PRO 366 CO -0.01 -0.93 0.61 1.52 0.04 0.00 0.00 177.00 178.23 1ur9 s TYR 367 N -2.95 -0.56 -0.07 0.56 1.13 -0.82 -3.76 117.35 110.88 1ur9 s TYR 367 Ca 0.59 0.67 -0.01 0.00 -1.41 0.00 0.00 57.07 56.90 1ur9 s TYR 367 Cb -0.10 0.45 -0.03 0.00 -1.10 0.00 0.00 41.96 41.17 1ur9 s TYR 367 CO 0.41 -0.71 -0.00 -0.51 -2.51 0.00 0.00 175.55 172.23 1ur9 s LEU 368 N -1.97 3.54 -0.07 -3.49 1.43 0.05 -0.76 118.68 117.41 1ur9 s LEU 368 Ca -0.05 0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.18 1ur9 s LEU 368 Cb -0.01 -1.85 0.01 0.00 0.03 0.00 0.00 46.19 44.38 1ur9 s LEU 368 CO -0.02 0.36 -0.13 -0.47 0.23 0.00 0.00 176.35 176.32 1ur9 s TYR 369 N -0.92 1.57 -0.63 0.29 5.04 -0.77 -1.04 117.35 120.89 1ur9 s TYR 369 Ca 0.14 -0.61 -0.03 0.00 -2.44 0.00 0.00 57.07 54.14 1ur9 s TYR 369 Cb -0.11 -1.14 0.16 0.00 0.35 0.00 0.00 41.96 41.22 1ur9 s TYR 369 CO 0.04 -0.31 0.45 -1.58 -1.34 0.00 0.00 175.55 172.81 1ur9 s HIS 370 N 0.70 3.43 0.21 4.97 5.65 -0.09 -1.28 115.29 128.89 1ur9 s HIS 370 Ca -0.14 -2.68 -0.11 0.00 0.25 0.00 0.00 55.06 52.39 1ur9 s HIS 370 Cb -0.16 -3.23 0.30 0.00 -1.18 0.00 0.00 32.58 28.31 1ur9 s HIS 370 CO 0.03 -0.85 1.66 0.00 -0.65 0.00 0.00 174.74 174.94 1ur9 h ALA 371 N 7.07 0.61 0.64 1.58 0.00 -1.85 0.16 119.26 127.48 1ur9 h ALA 371 Ca -0.01 0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1ur9 h ALA 371 Cb 0.96 0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1ur9 h ALA 371 CO 0.72 -0.39 -0.33 0.37 0.00 0.00 0.00 179.25 179.61 1ur9 h GLN 372 N 0.12 -0.86 -0.01 0.00 4.15 -1.93 -3.25 115.11 113.33 1ur9 h GLN 372 Ca 0.33 0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.80 1ur9 h GLN 372 Cb 0.53 0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.41 1ur9 h GLN 372 CO -0.53 -0.57 -0.16 0.09 -1.93 0.00 0.00 178.83 175.72 1ur9 n ASN 373 N -5.48 1.39 -2.16 -0.69 5.03 -1.16 -4.97 115.26 107.22 1ur9 n ASN 373 Ca -0.13 -1.23 -0.08 0.00 0.87 0.00 0.00 54.58 54.01 1ur9 n ASN 373 Cb 0.37 0.10 0.04 0.00 -1.02 0.00 0.00 39.78 39.27 1ur9 n ASN 373 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ur9 n GLY 374 N 1.28 0.05 3.56 7.41 0.00 0.52 -4.50 105.19 113.51 1ur9 n GLY 374 Ca 0.15 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 1ur9 n GLY 374 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ur9 s LEU 375 N -4.02 2.97 -0.02 0.99 1.43 -0.98 -1.76 118.68 117.29 1ur9 s LEU 375 Ca 0.05 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.69 1ur9 s LEU 375 Cb -0.01 -1.74 0.02 0.00 0.03 0.00 0.00 46.19 44.49 1ur9 s LEU 375 CO 0.33 0.16 -0.00 0.12 0.23 0.00 0.00 176.35 177.19 1ur9 s PHE 376 N -1.34 0.23 -0.06 0.29 5.36 -0.77 -0.91 117.98 120.78 1ur9 s PHE 376 Ca 0.22 0.00 0.02 0.00 -0.96 0.00 0.00 56.93 56.21 1ur9 s PHE 376 Cb -0.10 -0.28 0.02 0.00 -0.34 0.00 0.00 43.02 42.32 1ur9 s PHE 376 CO 0.14 -0.07 -0.09 0.08 -1.46 0.00 0.00 175.22 173.81 1ur9 s VAL 377 N 0.61 0.89 -0.18 3.12 1.01 -0.20 -0.74 120.40 124.90 1ur9 s VAL 377 Ca -0.06 -0.32 -0.06 0.00 0.00 0.00 0.00 61.98 61.54 1ur9 s VAL 377 Cb -0.09 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 1ur9 s VAL 377 CO -0.01 0.30 0.03 0.28 0.00 0.00 0.00 175.10 175.70 1ur9 s THR 378 N 0.83 4.47 0.34 3.92 -1.32 -0.43 -0.77 115.64 122.67 1ur9 s THR 378 Ca -0.12 -0.15 -0.09 0.00 -1.21 0.00 0.00 61.69 60.13 1ur9 s THR 378 Cb -0.15 -3.00 0.03 0.00 -1.51 0.00 0.00 72.50 67.87 1ur9 s THR 378 CO 0.02 0.46 0.60 0.00 -2.21 0.00 0.00 174.62 173.48 1ur9 n TYR 379 N 3.64 -1.88 -4.38 9.09 4.11 -1.25 -1.07 117.16 125.43 1ur9 n TYR 379 Ca -0.17 -1.82 -0.20 0.00 -0.00 0.00 0.00 57.90 55.71 1ur9 n TYR 379 Cb 0.52 0.69 -0.10 0.00 -0.00 0.00 0.00 39.34 40.45 1ur9 n TYR 379 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1ur9 s ASP 380 N -2.87 2.86 0.13 9.48 1.11 -1.26 -4.03 116.67 122.10 1ur9 s ASP 380 Ca 0.19 -1.00 -0.01 0.00 0.18 0.00 0.00 52.55 51.91 1ur9 s ASP 380 Cb -0.03 -0.18 0.00 0.00 1.07 0.00 0.00 42.92 43.78 1ur9 s ASP 380 CO 0.14 -0.09 0.18 -0.90 1.18 0.00 0.00 175.17 175.67 1ur9 n ASP 381 N -0.33 -0.50 0.30 0.27 5.68 -1.26 -4.92 116.55 115.79 1ur9 n ASP 381 Ca -0.08 -1.71 0.17 0.00 -0.50 0.00 0.00 54.79 52.67 1ur9 n ASP 381 Cb 0.60 0.93 0.97 0.00 -1.14 0.00 0.00 41.12 42.48 1ur9 n ASP 381 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ur9 h ALA 382 N 1.65 1.37 0.11 2.12 0.00 -1.94 -0.28 119.26 122.29 1ur9 h ALA 382 Ca -0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1ur9 h ALA 382 Cb 0.44 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1ur9 h ALA 382 CO 0.14 0.02 -0.05 0.93 0.00 0.00 0.00 179.25 180.28 1ur9 h GLU 383 N 0.00 -0.14 -0.31 0.00 4.39 -1.98 -3.02 114.58 113.52 1ur9 h GLU 383 Ca -0.00 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 1ur9 h GLU 383 Cb 0.04 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 1ur9 h GLU 383 CO 0.00 0.36 0.17 0.66 -1.16 0.00 0.00 179.01 179.04 1ur9 h SER 384 N -0.84 0.37 0.34 1.42 4.64 -1.68 -1.24 113.55 116.55 1ur9 h SER 384 Ca -0.01 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 1ur9 h SER 384 Cb 0.56 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1ur9 h SER 384 CO 0.02 0.30 -0.04 -0.26 -0.87 0.00 0.00 176.83 175.98 1ur9 h PHE 385 N 0.42 0.00 -0.17 4.77 0.04 -1.05 -2.55 116.94 118.40 1ur9 h PHE 385 Ca 0.11 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.86 1ur9 h PHE 385 Cb 0.01 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 1ur9 h PHE 385 CO 0.00 0.04 0.03 0.87 -0.60 0.00 0.00 178.31 178.65 1ur9 h LYS 386 N 0.00 0.28 -0.58 1.51 1.57 -1.09 -0.41 116.57 117.86 1ur9 h LYS 386 Ca -0.00 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.60 1ur9 h LYS 386 Cb 0.22 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 1ur9 h LYS 386 CO 0.01 0.44 -0.05 1.88 -0.57 0.00 0.00 179.45 181.15 1ur9 h TYR 387 N 0.07 1.15 -0.43 -1.35 0.05 -1.58 -1.48 116.97 113.40 1ur9 h TYR 387 Ca 0.05 -0.22 -0.09 0.00 0.05 0.00 0.00 58.73 58.52 1ur9 h TYR 387 Cb 0.30 -0.29 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 1ur9 h TYR 387 CO 0.02 1.04 -0.12 0.87 -1.05 0.00 0.00 178.16 178.91 1ur9 h LYS 388 N 0.94 0.77 -0.48 4.88 1.57 -1.39 -0.69 116.57 122.18 1ur9 h LYS 388 Ca 0.16 -0.26 -0.13 0.00 -1.87 0.00 0.00 60.65 58.55 1ur9 h LYS 388 Cb 0.61 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 1ur9 h LYS 388 CO 0.04 0.86 -0.22 0.00 -0.57 0.00 0.00 179.45 179.55 1ur9 h ALA 389 N 1.17 0.70 -0.30 3.86 0.00 -0.91 -0.99 119.26 122.80 1ur9 h ALA 389 Ca 0.12 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 1ur9 h ALA 389 Cb 0.60 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1ur9 h ALA 389 CO 0.04 0.67 -0.20 -0.22 0.00 0.00 0.00 179.25 179.55 1ur9 h LYS 390 N 0.85 0.54 -0.39 0.00 3.64 -1.03 -1.95 116.57 118.24 1ur9 h LYS 390 Ca 0.11 -0.19 -0.04 0.00 -1.27 0.00 0.00 60.65 59.26 1ur9 h LYS 390 Cb 0.80 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 1ur9 h LYS 390 CO 0.07 0.71 0.08 -0.92 -2.27 0.00 0.00 179.45 177.12 1ur9 h TYR 391 N 0.49 0.67 -0.96 1.91 3.20 -0.85 0.93 116.97 122.35 1ur9 h TYR 391 Ca 0.08 -0.09 0.10 0.00 3.14 0.00 0.00 58.73 61.97 1ur9 h TYR 391 Cb 0.62 -0.19 -0.08 0.00 1.54 0.00 0.00 36.73 38.62 1ur9 h TYR 391 CO 0.02 0.66 0.60 0.82 -1.64 0.00 0.00 178.16 178.61 1ur9 h ILE 392 N 0.49 0.95 -0.02 1.81 2.04 -0.83 0.89 117.51 122.83 1ur9 h ILE 392 Ca 0.12 -0.34 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 1ur9 h ILE 392 Cb 0.34 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1ur9 h ILE 392 CO 0.00 0.18 -0.05 0.11 0.00 0.00 0.00 178.15 178.39 1ur9 h LYS 393 N 0.98 0.07 -0.77 2.37 1.57 -0.90 -0.67 116.57 119.22 1ur9 h LYS 393 Ca 0.46 -0.05 0.07 0.00 -1.87 0.00 0.00 60.65 59.26 1ur9 h LYS 393 Cb 0.40 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.65 1ur9 h LYS 393 CO -0.24 0.64 0.45 1.96 -0.57 0.00 0.00 179.45 181.69 1ur9 h GLN 394 N -0.49 0.79 -0.07 3.15 4.20 -0.38 -1.47 115.11 120.84 1ur9 h GLN 394 Ca -0.00 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1ur9 h GLN 394 Cb 0.64 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1ur9 h GLN 394 CO 0.01 0.52 0.00 1.04 -0.67 0.00 0.00 178.83 179.73 1ur9 n GLN 395 N -4.72 1.36 -3.72 1.46 1.13 0.27 -4.92 117.38 108.24 1ur9 n GLN 395 Ca 0.11 -0.53 -0.25 0.00 -1.94 0.00 0.00 57.00 54.38 1ur9 n GLN 395 Cb 0.20 -1.37 0.05 0.00 0.11 0.00 0.00 30.24 29.23 1ur9 n GLN 395 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1ur9 n GLN 396 N -0.27 -6.57 -1.92 -1.09 6.02 -0.55 -4.89 117.38 108.10 1ur9 n GLN 396 Ca 0.16 0.72 -0.30 0.00 -0.01 0.00 0.00 57.00 57.57 1ur9 n GLN 396 Cb 0.20 -5.65 0.04 0.00 1.02 0.00 0.00 30.24 25.85 1ur9 n GLN 396 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1ur9 s LEU 397 N -7.14 3.00 0.49 1.08 1.43 -0.29 -3.22 118.68 114.03 1ur9 s LEU 397 Ca 0.49 1.16 0.28 0.00 -1.03 0.00 0.00 54.13 55.03 1ur9 s LEU 397 Cb -0.23 -4.02 1.19 0.00 0.03 0.00 0.00 46.19 43.16 1ur9 s LEU 397 CO 0.78 -1.22 1.93 1.23 0.23 0.00 0.00 176.35 179.31 1ur9 h GLY 398 N -0.55 0.00 0.00 -3.19 0.00 -0.55 -3.45 103.07 95.33 1ur9 h GLY 398 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1ur9 h GLY 398 CO 0.63 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.78 1ur9 n GLY 399 N -0.09 -0.11 3.35 4.60 0.00 -1.24 -1.08 105.19 110.61 1ur9 n GLY 399 Ca -0.00 -1.27 -0.24 0.00 0.00 0.00 0.00 46.02 44.51 1ur9 n GLY 399 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ur9 s VAL 400 N -3.15 1.96 0.05 1.61 0.11 -0.01 -1.40 120.40 119.56 1ur9 s VAL 400 Ca 0.00 -1.86 0.02 0.00 -2.93 0.00 0.00 61.98 57.21 1ur9 s VAL 400 Cb 0.00 -1.86 -0.03 0.00 -1.53 0.00 0.00 36.38 32.96 1ur9 s VAL 400 CO 0.00 -0.19 -0.07 -0.32 -3.33 0.00 0.00 175.10 171.19 1ur9 s MET 401 N -2.54 0.55 0.00 1.54 0.00 0.22 -0.62 119.30 118.45 1ur9 s MET 401 Ca 0.15 -0.82 -0.05 0.00 0.00 0.00 0.00 55.69 54.97 1ur9 s MET 401 Cb -0.07 -0.25 -0.00 0.00 0.00 0.00 0.00 34.83 34.50 1ur9 s MET 401 CO 0.07 0.03 0.10 -0.59 0.00 0.00 0.00 175.02 174.63 1ur9 s PHE 402 N -1.66 0.07 -0.24 4.11 -0.12 0.46 -0.24 117.98 120.36 1ur9 s PHE 402 Ca -0.08 -0.18 0.02 0.00 -0.05 0.00 0.00 56.93 56.64 1ur9 s PHE 402 Cb -0.08 -0.07 0.04 0.00 -0.63 0.00 0.00 43.02 42.28 1ur9 s PHE 402 CO -0.00 -0.25 -0.12 -0.46 -0.05 0.00 0.00 175.22 174.34 1ur9 s TRP 403 N -1.27 3.12 0.12 3.49 -0.11 -0.84 -1.43 118.94 122.02 1ur9 s TRP 403 Ca -0.14 -2.03 -0.03 0.00 1.22 0.00 0.00 56.10 55.13 1ur9 s TRP 403 Cb -0.08 -1.96 -0.03 0.00 -1.50 0.00 0.00 33.47 29.91 1ur9 s TRP 403 CO 0.01 -0.84 0.09 -3.38 -4.62 0.00 0.00 176.95 168.22 1ur9 s HIS 404 N 1.19 0.65 0.35 5.86 -3.43 -1.26 -0.93 115.29 117.71 1ur9 s HIS 404 Ca -0.04 -1.06 0.12 0.00 -0.80 0.00 0.00 55.06 53.28 1ur9 s HIS 404 Cb -0.18 -0.35 0.92 0.00 -1.43 0.00 0.00 32.58 31.55 1ur9 s HIS 404 CO -0.07 -0.53 1.77 1.25 -2.00 0.00 0.00 174.74 175.16 1ur9 h LEU 405 N 2.85 0.62 0.00 5.38 6.46 -0.97 -1.14 115.31 128.51 1ur9 h LEU 405 Ca -0.34 0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.52 1ur9 h LEU 405 Cb 1.19 -0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.12 1ur9 h LEU 405 CO 0.58 0.15 0.00 0.61 -0.62 0.00 0.00 178.44 179.16 1ur9 n GLY 406 N -1.38 -0.70 0.75 3.75 0.00 -1.26 -2.42 105.19 103.93 1ur9 n GLY 406 Ca 0.25 -0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.34 1ur9 n GLY 406 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ur9 n GLN 407 N -1.37 1.83 -1.29 1.61 6.02 -0.43 -4.75 117.38 119.00 1ur9 n GLN 407 Ca 0.04 -1.52 -0.30 0.00 -0.01 0.00 0.00 57.00 55.21 1ur9 n GLN 407 Cb 0.09 -1.46 0.13 0.00 1.02 0.00 0.00 30.24 30.02 1ur9 n GLN 407 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1ur9 s ASP 408 N -2.17 3.64 0.93 1.08 -1.08 -1.02 -2.23 116.67 115.83 1ur9 s ASP 408 Ca 0.24 1.41 -0.15 0.00 -0.52 0.00 0.00 52.55 53.53 1ur9 s ASP 408 Cb 0.19 -2.10 0.17 0.00 -1.46 0.00 0.00 42.92 39.72 1ur9 s ASP 408 CO 0.41 -2.52 1.26 0.54 0.52 0.00 0.00 175.17 175.38 1ur9 s ASN 409 N -3.54 3.40 0.41 -0.34 2.20 -1.26 -4.42 114.94 111.39 1ur9 s ASN 409 Ca 0.63 0.46 0.09 0.00 -0.94 0.00 0.00 52.86 53.10 1ur9 s ASN 409 Cb -0.17 -0.66 0.88 0.00 -2.00 0.00 0.00 41.25 39.30 1ur9 s ASN 409 CO 0.56 -2.57 2.02 0.03 -2.94 0.00 0.00 177.10 174.20 1ur9 h ARG 410 N -1.52 0.36 0.00 3.55 2.47 -1.96 -1.05 114.38 116.23 1ur9 h ARG 410 Ca -0.45 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 1ur9 h ARG 410 Cb 1.27 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 1ur9 h ARG 410 CO 0.47 0.32 0.00 0.09 0.56 0.00 0.00 179.97 181.41 1ur9 n ASN 411 N -4.41 0.27 -2.44 7.04 5.03 -1.26 -4.92 115.26 114.57 1ur9 n ASN 411 Ca 0.01 0.53 -0.15 0.00 0.87 0.00 0.00 54.58 55.84 1ur9 n ASN 411 Cb 0.14 -0.60 0.05 0.00 -1.02 0.00 0.00 39.78 38.35 1ur9 n ASN 411 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ur9 n GLY 412 N 1.23 0.01 0.35 7.41 0.00 -0.40 -4.93 105.19 108.86 1ur9 n GLY 412 Ca 0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 46.02 45.98 1ur9 n GLY 412 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ur9 h ASP 413 N -1.66 0.95 -0.19 1.61 3.32 -1.92 -1.06 116.42 117.47 1ur9 h ASP 413 Ca -0.36 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 56.61 1ur9 h ASP 413 Cb 1.23 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 1ur9 h ASP 413 CO 0.35 0.71 -0.03 -0.07 -1.72 0.00 0.00 179.24 178.48 1ur9 h LEU 414 N 1.10 0.36 -0.46 1.55 3.38 -1.93 -0.58 115.31 118.74 1ur9 h LEU 414 Ca 0.29 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1ur9 h LEU 414 Cb -0.07 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1ur9 h LEU 414 CO -0.06 0.62 0.22 0.25 0.09 0.00 0.00 178.44 179.57 1ur9 h LEU 415 N 0.10 0.60 -0.93 1.67 5.85 -1.94 -2.38 115.31 118.27 1ur9 h LEU 415 Ca 0.05 -0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.69 1ur9 h LEU 415 Cb 0.45 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.27 1ur9 h LEU 415 CO 0.02 0.55 0.60 0.00 -0.34 0.00 0.00 178.44 179.27 1ur9 h ALA 416 N 1.07 1.25 -0.44 1.25 0.00 -1.07 -1.72 119.26 119.60 1ur9 h ALA 416 Ca 0.16 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1ur9 h ALA 416 Cb 0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1ur9 h ALA 416 CO -0.02 0.44 0.22 0.00 0.00 0.00 0.00 179.25 179.89 1ur9 h ALA 417 N 1.40 0.56 -0.21 0.00 0.00 -0.78 0.16 119.26 120.39 1ur9 h ALA 417 Ca 0.38 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.21 1ur9 h ALA 417 Cb 0.05 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1ur9 h ALA 417 CO -0.14 0.12 0.07 -0.07 0.00 0.00 0.00 179.25 179.23 1ur9 h LEU 418 N 0.57 0.08 -0.60 0.00 3.38 -0.92 0.32 115.31 118.13 1ur9 h LEU 418 Ca 0.15 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1ur9 h LEU 418 Cb 0.10 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1ur9 h LEU 418 CO -0.02 0.07 0.29 -0.78 0.09 0.00 0.00 178.44 178.09 1ur9 h ASP 419 N 0.17 0.79 -0.16 -0.43 3.58 -1.14 -2.95 116.42 116.27 1ur9 h ASP 419 Ca 0.09 -0.13 0.02 0.00 0.42 0.00 0.00 57.03 57.43 1ur9 h ASP 419 Cb 0.06 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 40.88 1ur9 h ASP 419 CO -0.09 0.70 0.02 -0.09 -2.88 0.00 0.00 179.24 176.90 1ur9 h ARG 420 N 0.83 0.08 0.00 0.28 2.43 -0.08 0.12 114.38 118.04 1ur9 h ARG 420 Ca 0.21 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.35 1ur9 h ARG 420 Cb 0.12 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1ur9 h ARG 420 CO -0.03 0.05 -0.10 1.88 -1.51 0.00 0.00 179.97 180.26 1ur9 h TYR 421 N 0.08 0.00 0.00 2.20 0.05 -0.83 -0.75 116.97 117.71 1ur9 h TYR 421 Ca 0.07 0.00 -0.35 0.00 0.05 0.00 0.00 58.73 58.50 1ur9 h TYR 421 Cb 0.08 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 37.75 1ur9 h TYR 421 CO -0.14 0.10 -2.19 1.19 -1.05 0.00 0.00 178.16 176.07 1ur9 n PHE 422 N -3.68 0.34 0.00 4.88 3.72 -1.06 -4.79 117.46 116.87 1ur9 n PHE 422 Ca -0.02 0.11 0.01 0.00 -0.05 0.00 0.00 57.45 57.50 1ur9 n PHE 422 Cb 0.22 -1.06 -0.01 0.00 -0.94 0.00 0.00 39.48 37.69 1ur9 n PHE 422 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1ur9 n ASN 423 N -2.90 4.47 -4.71 4.37 3.02 0.40 -4.97 115.26 114.94 1ur9 n ASN 423 Ca -0.29 -0.03 -0.42 0.00 -0.03 0.00 0.00 54.58 53.81 1ur9 n ASN 423 Cb 1.11 1.05 -0.03 0.00 -0.61 0.00 0.00 39.78 41.30 1ur9 n ASN 423 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ur9 s ALA 424 N -2.03 3.69 0.37 5.41 0.00 -0.31 -4.88 121.76 124.01 1ur9 s ALA 424 Ca -0.00 1.22 0.20 0.00 0.00 0.00 0.00 51.96 53.38 1ur9 s ALA 424 Cb 0.01 -3.61 1.09 0.00 0.00 0.00 0.00 23.12 20.60 1ur9 s ALA 424 CO 0.05 -0.81 1.95 0.00 0.00 0.00 0.00 175.76 176.95 1ur9 h ALA 425 N 7.23 1.34 -0.65 0.00 0.00 -1.96 -2.78 119.26 122.44 1ur9 h ALA 425 Ca -0.42 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1ur9 h ALA 425 Cb 1.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1ur9 h ALA 425 CO 0.90 0.28 0.00 -0.40 0.00 0.00 0.00 179.25 180.03 1ur9 n ASP 426 N -3.86 4.08 -4.59 0.00 5.68 -1.26 -4.86 116.55 111.75 1ur9 n ASP 426 Ca -0.02 -2.21 -0.34 0.00 -0.50 0.00 0.00 54.79 51.72 1ur9 n ASP 426 Cb 0.32 -0.51 -0.11 0.00 -1.14 0.00 0.00 41.12 39.68 1ur9 n ASP 426 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 1ur9 s TYR 427 N -1.46 3.15 -0.20 2.11 5.04 -1.05 -5.08 117.35 119.85 1ur9 s TYR 427 Ca 0.47 -0.06 -0.03 0.00 -2.44 0.00 0.00 57.07 55.01 1ur9 s TYR 427 Cb 0.27 -1.98 0.06 0.00 0.35 0.00 0.00 41.96 40.66 1ur9 s TYR 427 CO 0.27 0.13 0.05 0.34 -1.34 0.00 0.00 175.55 175.00 1ur9 s ASP 428 N 0.17 2.85 -0.24 4.32 2.15 -1.26 -4.89 116.67 119.76 1ur9 s ASP 428 Ca 0.01 -0.82 0.14 0.00 0.43 0.00 0.00 52.55 52.31 1ur9 s ASP 428 Cb -0.13 -0.51 0.76 0.00 -0.30 0.00 0.00 42.92 42.73 1ur9 s ASP 428 CO 0.02 -0.33 1.70 -0.90 -0.17 0.00 0.00 175.17 175.49 1ur9 n ASP 429 N 5.10 5.22 0.23 -0.34 5.68 -1.26 -4.60 116.55 126.59 1ur9 n ASP 429 Ca -0.08 -3.02 0.07 0.00 -0.50 0.00 0.00 54.79 51.26 1ur9 n ASP 429 Cb 0.47 -0.67 0.58 0.00 -1.14 0.00 0.00 41.12 40.36 1ur9 n ASP 429 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1ur9 h SER 430 N 3.34 0.04 -0.22 -1.12 4.64 -2.03 -1.51 113.55 116.68 1ur9 h SER 430 Ca 0.05 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1ur9 h SER 430 Cb 1.95 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 64.03 1ur9 h SER 430 CO 0.49 0.08 0.00 0.00 -0.87 0.00 0.00 176.83 176.53 1ur9 n GLN 431 N -4.47 2.19 -1.86 4.77 6.02 -1.26 -4.94 117.38 117.83 1ur9 n GLN 431 Ca -0.02 -1.78 -0.42 0.00 -0.01 0.00 0.00 57.00 54.77 1ur9 n GLN 431 Cb 0.13 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 29.90 1ur9 n GLN 431 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1ur9 s LEU 432 N -1.66 4.38 -0.25 1.08 2.96 -0.57 -4.95 118.68 119.67 1ur9 s LEU 432 Ca 0.35 2.51 -0.18 0.00 -0.22 0.00 0.00 54.13 56.59 1ur9 s LEU 432 Cb 0.21 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.32 1ur9 s LEU 432 CO 0.30 -0.95 0.53 -0.62 -1.32 0.00 0.00 176.35 174.29 1ur9 s ASP 433 N 3.12 6.49 0.00 3.68 2.15 -1.26 -4.94 116.67 125.90 1ur9 s ASP 433 Ca 0.78 0.59 0.23 0.00 0.43 0.00 0.00 52.55 54.58 1ur9 s ASP 433 Cb -0.40 -2.29 1.40 0.00 -0.30 0.00 0.00 42.92 41.33 1ur9 s ASP 433 CO 0.34 -0.28 1.78 0.23 -0.17 0.00 0.00 175.17 177.08 1ur9 n MET 434 N 5.39 0.77 -0.01 4.34 2.81 -1.26 -5.00 117.12 124.16 1ur9 n MET 434 Ca -0.04 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 1ur9 n MET 434 Cb 0.50 -1.48 -0.00 0.00 -0.71 0.00 0.00 33.22 31.53 1ur9 n MET 434 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ur9 n GLY 435 N 0.53 -1.91 0.65 3.03 0.00 -1.26 -4.57 105.19 101.66 1ur9 n GLY 435 Ca 0.18 -1.36 0.06 0.00 0.00 0.00 0.00 46.02 44.90 1ur9 n GLY 435 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ur9 n THR 436 N -0.43 2.21 -1.29 2.61 -2.24 -1.26 -5.04 114.28 108.82 1ur9 n THR 436 Ca 0.00 -2.31 -0.33 0.00 -2.27 0.00 0.00 64.05 59.14 1ur9 n THR 436 Cb 0.01 -0.26 0.10 0.00 -2.10 0.00 0.00 70.33 68.08 1ur9 n THR 436 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1ur9 s GLY 437 N -2.48 2.14 0.04 3.38 0.00 -1.26 -4.88 107.32 104.26 1ur9 s GLY 437 Ca 0.39 0.74 -0.30 0.00 0.00 0.00 0.00 44.72 45.55 1ur9 s GLY 437 CO 0.04 1.14 1.69 1.08 0.00 0.00 0.00 173.10 177.05 1ur9 s LEU 438 N -5.49 4.36 0.25 0.66 1.02 0.21 -4.61 118.68 115.10 1ur9 s LEU 438 Ca 0.71 2.46 -0.10 0.00 0.02 0.00 0.00 54.13 57.22 1ur9 s LEU 438 Cb -0.26 -3.55 -0.07 0.00 0.02 0.00 0.00 46.19 42.33 1ur9 s LEU 438 CO 0.48 -0.92 0.58 -0.13 0.02 0.00 0.00 176.35 176.39 1ur9 s ARG 439 N 3.16 3.81 -0.01 1.70 3.00 -1.26 -0.61 118.95 128.74 1ur9 s ARG 439 Ca 0.76 0.30 -0.30 0.00 0.00 0.00 0.00 55.73 56.49 1ur9 s ARG 439 Cb -0.39 -2.61 -0.06 0.00 0.00 0.00 0.00 34.95 31.89 1ur9 s ARG 439 CO 0.33 0.27 1.54 -0.47 0.00 0.00 0.00 175.30 176.97 1ur9 s TYR 440 N -1.89 2.44 -2.40 -0.53 5.04 -1.26 -4.89 117.35 113.86 1ur9 s TYR 440 Ca 0.48 0.49 0.24 0.00 -2.44 0.00 0.00 57.07 55.84 1ur9 s TYR 440 Cb -0.11 -3.81 0.82 0.00 0.35 0.00 0.00 41.96 39.21 1ur9 s TYR 440 CO 0.22 -3.23 1.60 0.25 -1.34 0.00 0.00 175.55 173.05 1ur9 n THR 441 N 5.01 0.14 -1.95 4.34 -2.24 -1.26 -4.96 114.28 113.37 1ur9 n THR 441 Ca 0.15 -0.34 -0.33 0.00 -2.27 0.00 0.00 64.05 61.26 1ur9 n THR 441 Cb 0.43 0.50 0.02 0.00 -2.10 0.00 0.00 70.33 69.18 1ur9 n THR 441 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1ur9 s GLY 442 N -1.74 2.15 -0.04 3.38 0.00 -1.26 -4.93 107.32 104.88 1ur9 s GLY 442 Ca 0.35 0.46 -0.02 0.00 0.00 0.00 0.00 44.72 45.51 1ur9 s GLY 442 CO 0.29 0.79 0.09 0.14 0.00 0.00 0.00 173.10 174.42 1ur9 s VAL 443 N -2.39 -0.05 0.21 1.40 1.01 -0.07 -4.91 120.40 115.61 1ur9 s VAL 443 Ca 0.65 0.17 0.01 0.00 0.00 0.00 0.00 61.98 62.81 1ur9 s VAL 443 Cb -0.18 -0.16 -0.01 0.00 0.00 0.00 0.00 36.38 36.03 1ur9 s VAL 443 CO 0.38 0.07 0.05 0.61 0.00 0.00 0.00 175.10 176.21 1ur9 n GLY 444 N 4.03 3.75 0.33 4.51 0.00 -1.26 -3.21 105.19 113.34 1ur9 n GLY 444 Ca -0.25 -2.09 0.09 0.00 0.00 0.00 0.00 46.02 43.77 1ur9 n GLY 444 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ur9 h PRO 445 N 0.00 0.44 -0.01 1.61 0.11 -1.92 -2.93 132.00 129.30 1ur9 h PRO 445 Ca -0.17 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.92 1ur9 h PRO 445 Cb 0.59 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.60 1ur9 h PRO 445 CO 0.27 0.29 -0.08 0.41 -0.21 0.00 0.00 178.00 178.68 1ur9 n GLY 446 N -1.50 -0.58 2.74 -0.55 0.00 0.12 -4.26 105.19 101.15 1ur9 n GLY 446 Ca 0.07 -0.34 -0.05 0.00 0.00 0.00 0.00 46.02 45.71 1ur9 n GLY 446 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ur9 n ASN 447 N -0.54 0.86 -4.77 1.61 2.04 -1.11 -4.74 115.26 108.62 1ur9 n ASN 447 Ca 0.17 -2.36 -0.38 0.00 -0.44 0.00 0.00 54.58 51.57 1ur9 n ASN 447 Cb 0.29 -0.23 -0.02 0.00 -2.53 0.00 0.00 39.78 37.28 1ur9 n ASN 447 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 1ur9 s LEU 448 N -3.50 4.17 0.20 -4.53 1.43 -1.22 -4.69 118.68 110.53 1ur9 s LEU 448 Ca 0.25 2.32 -0.30 0.00 -1.03 0.00 0.00 54.13 55.37 1ur9 s LEU 448 Cb 0.40 -4.06 -0.08 0.00 0.03 0.00 0.00 46.19 42.48 1ur9 s LEU 448 CO -0.02 -0.69 1.01 -2.16 0.23 0.00 0.00 176.35 174.72 1ur9 s PRO 449 N -2.36 4.72 0.18 1.29 0.04 -1.26 -4.60 135.00 133.00 1ur9 s PRO 449 Ca 0.58 1.59 -0.33 0.00 0.04 0.00 0.00 61.00 62.88 1ur9 s PRO 449 Cb -0.30 -3.29 -0.14 0.00 0.04 0.00 0.00 34.50 30.81 1ur9 s PRO 449 CO 0.37 0.28 1.44 -0.89 0.04 0.00 0.00 177.00 178.24 1ur9 n ILE 450 N 1.99 0.44 -4.06 0.56 5.41 -1.26 -2.13 119.36 120.31 1ur9 n ILE 450 Ca 0.00 -0.11 -0.10 0.00 1.00 0.00 0.00 62.75 63.54 1ur9 n ILE 450 Cb 0.47 -1.35 -0.08 0.00 -0.71 0.00 0.00 39.64 37.97 1ur9 n ILE 450 CO 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 176.55 176.51 1ur9 s MET 451 N 0.23 1.20 0.00 0.38 -1.94 0.51 -4.78 119.30 114.90 1ur9 s MET 451 Ca 0.75 -1.35 0.02 0.00 -1.71 0.00 0.00 55.69 53.40 1ur9 s MET 451 Cb -0.72 0.34 -0.01 0.00 2.01 0.00 0.00 34.83 36.45 1ur9 s MET 451 CO 0.45 -0.42 -0.07 0.95 -0.01 0.00 0.00 175.02 175.92 1ur9 s THR 452 N -4.04 0.51 -0.06 2.05 -4.23 -1.26 -3.01 115.64 105.60 1ur9 s THR 452 Ca 0.25 -0.39 -0.29 0.00 -1.18 0.00 0.00 61.69 60.08 1ur9 s THR 452 Cb 0.04 -0.45 0.10 0.00 1.34 0.00 0.00 72.50 73.53 1ur9 s THR 452 CO 0.05 0.07 0.84 0.00 -0.54 0.00 0.00 174.62 175.04 1ur9 s ALA 453 N -0.32 -1.82 0.46 3.99 0.00 -1.26 -5.01 121.76 117.80 1ur9 s ALA 453 Ca 0.01 1.26 -0.24 0.00 0.00 0.00 0.00 51.96 52.99 1ur9 s ALA 453 Cb -0.03 -0.07 -0.09 0.00 0.00 0.00 0.00 23.12 22.93 1ur9 s ALA 453 CO -0.00 -0.46 1.21 -2.30 0.00 0.00 0.00 175.76 174.21 1ur9 n PRO 454 N 0.43 1.71 -1.73 0.00 -0.02 -1.26 -3.80 135.00 130.33 1ur9 n PRO 454 Ca -0.13 0.61 -0.37 0.00 -2.02 0.00 0.00 63.50 61.59 1ur9 n PRO 454 Cb 0.59 -2.34 0.07 0.00 -0.02 0.00 0.00 33.50 31.80 1ur9 n PRO 454 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ur9 n ALA 455 N -0.52 1.16 -1.77 3.55 0.00 -1.26 -0.31 120.51 121.36 1ur9 n ALA 455 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.12 1ur9 n ALA 455 Cb 0.41 -2.33 -0.03 0.00 0.00 0.00 0.00 19.45 17.51 1ur9 n ALA 455 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1ur9 s TYR 456 N -1.38 3.21 -0.28 0.00 5.04 -0.51 -4.67 117.35 118.76 1ur9 s TYR 456 Ca 0.83 1.51 0.02 0.00 -2.44 0.00 0.00 57.07 56.99 1ur9 s TYR 456 Cb -0.38 -3.54 0.06 0.00 0.35 0.00 0.00 41.96 38.45 1ur9 s TYR 456 CO 0.40 -1.42 -0.06 0.08 -1.34 0.00 0.00 175.55 173.20 1ur9 s VAL 457 N -1.17 2.41 0.25 3.14 1.01 -1.26 -5.02 120.40 119.77 1ur9 s VAL 457 Ca 0.48 -1.63 -0.31 0.00 0.00 0.00 0.00 61.98 60.52 1ur9 s VAL 457 Cb -0.37 -2.44 -0.12 0.00 0.00 0.00 0.00 36.38 33.45 1ur9 s VAL 457 CO 0.48 -0.10 1.65 -2.16 0.00 0.00 0.00 175.10 174.97 1ur9 s PRO 458 N 1.13 4.12 0.00 2.72 0.04 -1.26 -1.86 135.00 139.89 1ur9 s PRO 458 Ca -0.06 2.59 0.00 0.00 0.04 0.00 0.00 61.00 63.57 1ur9 s PRO 458 Cb -0.20 -3.04 0.00 0.00 0.04 0.00 0.00 34.50 31.30 1ur9 s PRO 458 CO -0.04 -0.69 0.00 0.41 0.04 0.00 0.00 177.00 176.72 1ur9 n GLY 459 N 2.97 1.61 3.85 0.56 0.00 -1.26 -5.08 105.19 107.84 1ur9 n GLY 459 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1ur9 n GLY 459 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ur9 s THR 460 N -2.30 4.78 -0.12 2.61 2.01 -0.77 -5.08 115.64 116.77 1ur9 s THR 460 Ca 0.00 0.87 -0.05 0.00 0.31 0.00 0.00 61.69 62.82 1ur9 s THR 460 Cb 0.00 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 1ur9 s THR 460 CO 0.00 0.10 0.06 -0.89 -0.69 0.00 0.00 174.62 173.20 1ur9 s THR 461 N -1.64 4.79 -0.02 -0.82 2.01 -1.26 -4.61 115.64 114.09 1ur9 s THR 461 Ca 0.44 -0.05 0.06 0.00 0.31 0.00 0.00 61.69 62.44 1ur9 s THR 461 Cb -0.14 -3.08 -0.02 0.00 0.01 0.00 0.00 72.50 69.27 1ur9 s THR 461 CO 0.20 0.57 -0.21 -0.31 -0.69 0.00 0.00 174.62 174.18 1ur9 s TYR 462 N -0.56 2.50 0.66 4.92 2.02 -0.13 -4.91 117.35 121.85 1ur9 s TYR 462 Ca 0.11 -0.31 -0.09 0.00 -0.37 0.00 0.00 57.07 56.41 1ur9 s TYR 462 Cb -0.12 -1.53 0.01 0.00 -0.40 0.00 0.00 41.96 39.92 1ur9 s TYR 462 CO 0.02 0.10 1.02 0.00 -1.57 0.00 0.00 175.55 175.12 1ur9 s ALA 463 N -0.72 3.06 0.27 3.71 0.00 -1.26 -0.85 121.76 125.97 1ur9 s ALA 463 Ca 0.11 -0.50 -0.30 0.00 0.00 0.00 0.00 51.96 51.27 1ur9 s ALA 463 Cb -0.10 -2.85 -0.11 0.00 0.00 0.00 0.00 23.12 20.06 1ur9 s ALA 463 CO 0.01 -1.01 1.60 -1.14 0.00 0.00 0.00 175.76 175.21 1ur9 s GLN 464 N -5.21 4.14 0.00 0.00 0.74 -1.23 -2.40 119.66 115.70 1ur9 s GLN 464 Ca 0.56 2.55 0.00 0.00 0.05 0.00 0.00 55.36 58.52 1ur9 s GLN 464 Cb -0.11 -3.05 0.00 0.00 1.10 0.00 0.00 33.01 30.96 1ur9 s GLN 464 CO 0.49 -0.63 0.00 0.41 -0.55 0.00 0.00 175.29 175.01 1ur9 n GLY 465 N 2.53 0.73 3.77 2.59 0.00 -1.07 -4.93 105.19 108.81 1ur9 n GLY 465 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1ur9 n GLY 465 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ur9 s ALA 466 N -2.26 3.36 -0.09 4.61 0.00 -1.01 -4.65 121.76 121.72 1ur9 s ALA 466 Ca 0.00 1.22 0.01 0.00 0.00 0.00 0.00 51.96 53.19 1ur9 s ALA 466 Cb 0.00 -3.47 -0.02 0.00 0.00 0.00 0.00 23.12 19.63 1ur9 s ALA 466 CO 0.00 -0.70 -0.13 -0.51 0.00 0.00 0.00 175.76 174.42 1ur9 s LEU 467 N -2.13 2.77 0.08 0.00 1.43 -1.26 -1.70 118.68 117.87 1ur9 s LEU 467 Ca 0.53 -0.24 -0.05 0.00 -1.03 0.00 0.00 54.13 53.34 1ur9 s LEU 467 Cb -0.38 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.22 1ur9 s LEU 467 CO 0.50 0.25 0.08 0.68 0.23 0.00 0.00 176.35 178.09 1ur9 s VAL 468 N -0.17 0.17 -0.13 -1.59 -7.23 -0.21 -4.31 120.40 106.93 1ur9 s VAL 468 Ca 0.00 -1.53 -0.03 0.00 -1.81 0.00 0.00 61.98 58.61 1ur9 s VAL 468 Cb -0.13 -1.50 -0.03 0.00 0.56 0.00 0.00 36.38 35.28 1ur9 s VAL 468 CO 0.03 -0.78 -0.02 -0.94 -0.31 0.00 0.00 175.10 173.08 1ur9 s SER 469 N -2.91 4.98 -0.19 4.85 1.04 0.58 0.19 113.70 122.24 1ur9 s SER 469 Ca 0.08 -0.02 -0.08 0.00 0.48 0.00 0.00 55.95 56.40 1ur9 s SER 469 Cb 0.06 -1.65 0.08 0.00 0.10 0.00 0.00 66.02 64.62 1ur9 s SER 469 CO -0.09 0.25 0.42 -0.47 0.98 0.00 0.00 173.24 174.33 1ur9 s TYR 470 N -0.10 -0.74 -1.33 5.02 5.04 0.66 -1.42 117.35 124.47 1ur9 s TYR 470 Ca 0.03 1.46 -0.04 0.00 -2.44 0.00 0.00 57.07 56.08 1ur9 s TYR 470 Cb -0.13 0.30 0.02 0.00 0.35 0.00 0.00 41.96 42.50 1ur9 s TYR 470 CO 0.02 -0.43 0.87 1.04 -1.34 0.00 0.00 175.55 175.71 1ur9 n GLN 471 N 4.95 -5.70 -0.27 4.97 6.02 -1.26 -2.39 117.38 123.69 1ur9 n GLN 471 Ca -0.14 0.68 0.00 0.00 -0.01 0.00 0.00 57.00 57.53 1ur9 n GLN 471 Cb 0.52 -5.45 0.00 0.00 1.02 0.00 0.00 30.24 26.33 1ur9 n GLN 471 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ur9 n GLY 472 N -1.55 2.36 3.52 1.08 0.00 -1.26 -5.01 105.19 104.33 1ur9 n GLY 472 Ca -0.20 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 1ur9 n GLY 472 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ur9 s TYR 473 N -3.20 2.39 -0.21 1.61 2.02 -1.00 -1.70 117.35 117.25 1ur9 s TYR 473 Ca 0.00 -0.36 -0.06 0.00 -0.37 0.00 0.00 57.07 56.28 1ur9 s TYR 473 Cb 0.00 -1.15 -0.02 0.00 -0.40 0.00 0.00 41.96 40.39 1ur9 s TYR 473 CO 0.00 0.66 0.02 0.08 -1.57 0.00 0.00 175.55 174.73 1ur9 s VAL 474 N -2.51 4.03 0.09 0.71 1.01 -0.67 -0.25 120.40 122.82 1ur9 s VAL 474 Ca 0.31 -0.28 0.06 0.00 0.00 0.00 0.00 61.98 62.08 1ur9 s VAL 474 Cb -0.03 -2.84 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 1ur9 s VAL 474 CO 0.16 0.41 -0.09 0.26 0.00 0.00 0.00 175.10 175.85 1ur9 s TRP 475 N 1.15 2.78 -0.02 5.22 0.52 0.13 -1.07 118.94 127.65 1ur9 s TRP 475 Ca 0.03 -0.13 0.05 0.00 0.02 0.00 0.00 56.10 56.07 1ur9 s TRP 475 Cb -0.14 -1.46 -0.01 0.00 -1.15 0.00 0.00 33.47 30.70 1ur9 s TRP 475 CO 0.02 0.42 -0.17 -1.14 0.02 0.00 0.00 176.95 176.10 1ur9 s GLN 476 N -2.12 1.49 0.41 4.98 0.74 0.10 -1.05 119.66 124.21 1ur9 s GLN 476 Ca 0.21 -0.60 -0.24 0.00 0.05 0.00 0.00 55.36 54.79 1ur9 s GLN 476 Cb -0.11 -1.39 -0.09 0.00 1.10 0.00 0.00 33.01 32.52 1ur9 s GLN 476 CO 0.13 0.32 1.07 0.95 -0.55 0.00 0.00 175.29 177.21 1ur9 s THR 477 N -0.24 3.63 -0.51 -0.34 -4.23 -0.69 -0.30 115.64 112.96 1ur9 s THR 477 Ca 0.03 1.24 0.23 0.00 -1.18 0.00 0.00 61.69 62.01 1ur9 s THR 477 Cb -0.08 -3.64 -0.14 0.00 1.34 0.00 0.00 72.50 69.97 1ur9 s THR 477 CO 0.00 0.00 0.94 0.29 -0.54 0.00 0.00 174.62 175.31 1ur9 n LYS 478 N -0.13 0.36 -3.91 3.99 5.02 0.14 -2.58 118.16 121.04 1ur9 n LYS 478 Ca 0.05 -0.02 -0.11 0.00 -2.02 0.00 0.00 58.31 56.22 1ur9 n LYS 478 Cb 0.49 -1.60 -0.00 0.00 -0.02 0.00 0.00 35.03 33.90 1ur9 n LYS 478 CO 0.00 0.00 0.00 1.67 -0.52 0.00 0.00 177.40 178.55 1ur9 s TRP 479 N -3.25 0.43 0.63 2.13 -2.14 -1.26 -4.88 118.94 110.60 1ur9 s TRP 479 Ca 0.02 -0.94 -0.04 0.00 2.66 0.00 0.00 56.10 57.81 1ur9 s TRP 479 Cb 0.14 0.50 0.04 0.00 -3.10 0.00 0.00 33.47 31.05 1ur9 s TRP 479 CO 0.82 -1.39 0.91 0.20 -2.66 0.00 0.00 176.95 174.83 1ur9 s GLY 480 N -3.12 1.72 -1.21 3.67 0.00 -1.26 -3.56 107.32 103.57 1ur9 s GLY 480 Ca 0.20 -1.04 -0.03 0.00 0.00 0.00 0.00 44.72 43.86 1ur9 s GLY 480 CO 0.14 -0.70 1.02 -1.72 0.00 0.00 0.00 173.10 171.85 1ur9 n TYR 481 N -2.66 -2.32 -2.66 1.90 4.02 -0.89 -4.85 117.16 109.70 1ur9 n TYR 481 Ca 0.07 0.93 -0.43 0.00 -0.01 0.00 0.00 57.90 58.47 1ur9 n TYR 481 Cb 0.60 -4.97 -0.02 0.00 -0.02 0.00 0.00 39.34 34.92 1ur9 n TYR 481 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1ur9 s ILE 482 N -3.34 4.71 -0.72 -0.72 -1.09 -0.03 -4.82 121.20 115.19 1ur9 s ILE 482 Ca 0.17 1.99 0.06 0.00 -2.23 0.00 0.00 60.65 60.64 1ur9 s ILE 482 Cb -0.07 -4.28 0.05 0.00 -1.58 0.00 0.00 42.46 36.58 1ur9 s ILE 482 CO 0.71 -0.03 0.71 0.35 -1.23 0.00 0.00 174.94 175.45 1ur9 n THR 483 N 4.70 0.06 -4.50 2.92 -2.24 -1.26 -0.95 114.28 113.00 1ur9 n THR 483 Ca 0.10 -0.53 -0.23 0.00 -2.27 0.00 0.00 64.05 61.12 1ur9 n THR 483 Cb 0.48 1.08 -0.05 0.00 -2.10 0.00 0.00 70.33 69.74 1ur9 n THR 483 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1ur9 n SER 484 N 0.31 2.44 -4.87 3.42 2.88 -1.26 -4.75 113.62 111.80 1ur9 n SER 484 Ca 0.04 -2.65 -0.31 0.00 -1.33 0.00 0.00 58.87 54.61 1ur9 n SER 484 Cb 0.16 0.43 -0.05 0.00 -0.75 0.00 0.00 64.21 64.00 1ur9 n SER 484 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ur9 s ALA 485 N -2.71 3.44 0.39 -1.46 0.00 -1.26 -4.88 121.76 115.28 1ur9 s ALA 485 Ca 0.05 -0.19 -0.27 0.00 0.00 0.00 0.00 51.96 51.55 1ur9 s ALA 485 Cb 0.00 -2.59 -0.11 0.00 0.00 0.00 0.00 23.12 20.42 1ur9 s ALA 485 CO 0.04 0.29 1.38 -2.30 0.00 0.00 0.00 175.76 175.16 1ur9 n PRO 486 N -0.59 2.29 0.00 0.00 -0.02 -1.26 -0.82 135.00 134.59 1ur9 n PRO 486 Ca 0.02 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 1ur9 n PRO 486 Cb 0.53 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1ur9 n PRO 486 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ur9 n GLY 487 N 0.64 2.95 0.18 -1.23 0.00 -1.26 -4.68 105.19 101.78 1ur9 n GLY 487 Ca 0.04 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.13 1ur9 n GLY 487 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ur9 n SER 488 N 0.00 1.70 -3.20 1.61 7.64 -0.00 -4.95 113.62 116.41 1ur9 n SER 488 Ca 0.00 -2.75 0.04 0.00 1.01 0.00 0.00 58.87 57.16 1ur9 n SER 488 Cb 0.00 -0.35 -0.01 0.00 -1.01 0.00 0.00 64.21 62.83 1ur9 n SER 488 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1ur9 s ASP 489 N -2.31 -1.24 0.00 6.43 3.68 -0.68 -4.56 116.67 117.99 1ur9 s ASP 489 Ca 0.22 0.87 0.00 0.00 2.13 0.00 0.00 52.55 55.78 1ur9 s ASP 489 Cb 0.20 2.08 0.00 0.00 -1.45 0.00 0.00 42.92 43.74 1ur9 s ASP 489 CO 0.02 -0.23 0.64 -1.20 0.13 0.00 0.00 175.17 174.53 1ur9 n SER 490 N 5.43 0.00 0.06 -0.34 7.64 -1.26 -1.80 113.62 123.34 1ur9 n SER 490 Ca -0.03 0.16 0.12 0.00 1.01 0.00 0.00 58.87 60.13 1ur9 n SER 490 Cb 0.51 -0.16 0.48 0.00 -1.01 0.00 0.00 64.21 64.03 1ur9 n SER 490 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ur9 n ALA 491 N -1.14 2.09 -2.86 -0.43 0.00 -1.26 -4.80 120.51 112.11 1ur9 n ALA 491 Ca 0.00 -0.04 -0.36 0.00 0.00 0.00 0.00 53.44 53.04 1ur9 n ALA 491 Cb 0.01 -1.42 -0.06 0.00 0.00 0.00 0.00 19.45 17.98 1ur9 n ALA 491 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1ur9 s TRP 492 N -3.08 3.52 -0.13 0.00 0.52 -0.75 0.26 118.94 119.29 1ur9 s TRP 492 Ca 0.10 0.44 0.03 0.00 0.02 0.00 0.00 56.10 56.69 1ur9 s TRP 492 Cb 0.14 -1.89 0.01 0.00 -1.15 0.00 0.00 33.47 30.57 1ur9 s TRP 492 CO 0.49 0.68 -0.21 -1.17 0.02 0.00 0.00 176.95 176.76 1ur9 s LEU 493 N -1.21 2.03 -0.20 2.99 2.96 0.59 -4.87 118.68 120.96 1ur9 s LEU 493 Ca 0.17 -0.56 -0.29 0.00 -0.22 0.00 0.00 54.13 53.23 1ur9 s LEU 493 Cb -0.12 -1.36 -0.02 0.00 0.50 0.00 0.00 46.19 45.19 1ur9 s LEU 493 CO 0.07 0.08 1.48 -0.75 -1.32 0.00 0.00 176.35 175.91 1ur9 s LYS 494 N 0.76 3.97 0.00 1.98 2.20 -1.26 -0.72 119.74 126.66 1ur9 s LYS 494 Ca -0.09 1.65 0.00 0.00 -0.36 0.00 0.00 55.97 57.17 1ur9 s LYS 494 Cb -0.16 -3.94 0.00 0.00 -1.51 0.00 0.00 37.83 32.22 1ur9 s LYS 494 CO 0.00 -1.07 0.00 1.33 -0.36 0.00 0.00 175.35 175.25 1ur9 n VAL 495 N 6.01 0.00 -3.95 4.02 0.24 -0.23 -4.97 118.33 119.45 1ur9 n VAL 495 Ca 0.17 -0.37 -0.12 0.00 -2.04 0.00 0.00 64.34 61.97 1ur9 n VAL 495 Cb 0.45 0.88 -0.01 0.00 -1.47 0.00 0.00 33.84 33.70 1ur9 n VAL 495 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ur9 n GLY 496 N 1.26 1.62 3.13 7.63 0.00 -0.91 -4.36 105.19 113.55 1ur9 n GLY 496 Ca 0.00 -1.46 -0.09 0.00 0.00 0.00 0.00 46.02 44.47 1ur9 n GLY 496 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ur9 s ARG 497 N -2.50 0.82 0.00 1.61 1.70 -0.90 -1.66 118.95 118.01 1ur9 s ARG 497 Ca 0.24 -1.36 0.00 0.00 -0.47 0.00 0.00 55.73 54.13 1ur9 s ARG 497 Cb -0.03 0.20 0.00 0.00 -0.57 0.00 0.00 34.95 34.55 1ur9 s ARG 497 CO 0.17 -0.20 0.00 0.28 -1.08 0.00 0.00 175.30 174.47 1ur9 n VAL 498 N -0.03 0.00 0.00 4.99 0.31 -0.69 -0.37 118.33 122.55 1ur9 n VAL 498 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1ur9 n VAL 498 Cb 0.63 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.56 1ur9 n VAL 498 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05