#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jr9 s PHE 3 N 0.00 3.37 0.13 5.58 2.99 -1.26 -5.07 117.98 123.72 1jr9 s PHE 3 Ca 0.00 0.69 0.07 0.00 0.00 0.00 0.00 56.93 57.69 1jr9 s PHE 3 Cb 0.00 -2.61 -0.04 0.00 0.00 0.00 0.00 43.02 40.37 1jr9 s PHE 3 CO 0.00 -0.07 -0.16 -1.21 -0.00 0.00 0.00 175.22 173.78 1jr9 s GLU 4 N 1.53 1.10 0.00 0.44 2.02 -1.26 -4.92 118.70 117.61 1jr9 s GLU 4 Ca 0.22 -1.27 -0.30 0.00 0.02 0.00 0.00 54.97 53.63 1jr9 s GLU 4 Cb -0.15 -1.06 -0.05 0.00 0.10 0.00 0.00 34.13 32.97 1jr9 s GLU 4 CO 0.09 0.21 1.31 -1.17 0.02 0.00 0.00 175.26 175.72 1jr9 s LEU 5 N -2.46 4.32 0.65 1.80 0.20 -1.26 -5.00 118.68 116.93 1jr9 s LEU 5 Ca 0.10 2.03 -0.12 0.00 0.69 0.00 0.00 54.13 56.83 1jr9 s LEU 5 Cb -0.06 -3.56 -0.02 0.00 -0.43 0.00 0.00 46.19 42.12 1jr9 s LEU 5 CO 0.04 -0.64 1.05 -2.16 -0.29 0.00 0.00 176.35 174.36 1jr9 s PRO 6 N 2.03 3.19 0.05 0.98 0.04 -1.26 -5.04 135.00 134.99 1jr9 s PRO 6 Ca 0.61 1.00 -0.23 0.00 0.04 0.00 0.00 61.00 62.42 1jr9 s PRO 6 Cb -0.30 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.16 1jr9 s PRO 6 CO 0.26 -0.90 0.68 -2.00 0.04 0.00 0.00 177.00 175.08 1jr9 s GLU 7 N -4.74 4.40 -0.05 4.56 2.12 -1.26 -5.02 118.70 118.71 1jr9 s GLU 7 Ca 0.59 0.92 -0.30 0.00 0.36 0.00 0.00 54.97 56.54 1jr9 s GLU 7 Cb -0.14 -3.32 -0.05 0.00 0.26 0.00 0.00 34.13 30.88 1jr9 s GLU 7 CO 0.48 0.42 1.49 -0.51 -0.54 0.00 0.00 175.26 176.61 1jr9 s LEU 8 N -0.46 4.29 0.00 2.70 1.02 -1.26 -4.85 118.68 120.13 1jr9 s LEU 8 Ca 0.34 2.10 0.02 0.00 0.02 0.00 0.00 54.13 56.61 1jr9 s LEU 8 Cb -0.20 -3.54 0.15 0.00 0.02 0.00 0.00 46.19 42.61 1jr9 s LEU 8 CO 0.21 -0.83 0.48 -0.81 0.02 0.00 0.00 176.35 175.42 1jr9 n PRO 9 N 6.39 0.13 -3.88 1.29 -0.04 -1.26 -4.70 135.00 132.93 1jr9 n PRO 9 Ca 0.15 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.52 1jr9 n PRO 9 Cb 0.43 -1.29 -0.04 0.00 -0.04 0.00 0.00 33.50 32.56 1jr9 n PRO 9 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1jr9 s TYR 10 N -2.00 0.09 1.08 0.54 -0.85 -1.26 -5.13 117.35 109.82 1jr9 s TYR 10 Ca 0.04 -0.47 -0.13 0.00 -0.52 0.00 0.00 57.07 55.99 1jr9 s TYR 10 Cb 0.02 0.35 0.20 0.00 0.38 0.00 0.00 41.96 42.91 1jr9 s TYR 10 CO 0.03 -1.00 0.83 0.00 -1.52 0.00 0.00 175.55 173.88 1jr9 n ALA 11 N -0.38 -2.55 0.21 9.51 0.00 -1.26 -4.91 120.51 121.14 1jr9 n ALA 11 Ca -0.05 -0.98 0.11 0.00 0.00 0.00 0.00 53.44 52.52 1jr9 n ALA 11 Cb 0.62 -1.95 0.17 0.00 0.00 0.00 0.00 19.45 18.28 1jr9 n ALA 11 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1jr9 h TYR 12 N -2.28 0.00 -0.22 0.00 -1.99 -1.97 -3.05 116.97 107.45 1jr9 h TYR 12 Ca -0.54 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.19 1jr9 h TYR 12 Cb 1.32 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.05 1jr9 h TYR 12 CO 0.32 0.05 0.00 -0.40 -0.00 0.00 0.00 178.16 178.13 1jr9 n ASP 13 N -3.11 2.97 -0.41 3.88 5.75 -1.26 -3.73 116.55 120.63 1jr9 n ASP 13 Ca 0.04 -1.88 0.00 0.00 -0.01 0.00 0.00 54.79 52.94 1jr9 n ASP 13 Cb 0.54 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.49 1jr9 n ASP 13 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jr9 n ALA 14 N 1.16 1.87 -1.70 2.12 0.00 -1.15 -1.50 120.51 121.31 1jr9 n ALA 14 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1jr9 n ALA 14 Cb 0.51 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.96 1jr9 n ALA 14 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1jr9 n LEU 15 N 0.10 0.00 -0.39 0.00 4.77 -1.26 -4.02 117.00 116.20 1jr9 n LEU 15 Ca 0.00 -0.43 0.31 0.00 -0.03 0.00 0.00 56.01 55.87 1jr9 n LEU 15 Cb 0.11 0.00 0.58 0.00 -2.33 0.00 0.00 43.42 41.79 1jr9 n LEU 15 CO 0.00 0.38 1.18 -0.33 -1.33 0.00 0.00 177.39 177.30 1jr9 h GLU 16 N 0.00 0.17 0.03 3.23 4.39 -1.23 -1.76 114.58 119.41 1jr9 h GLU 16 Ca 0.00 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1jr9 h GLU 16 Cb 1.02 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 1jr9 h GLU 16 CO 0.00 0.11 -0.01 -1.00 -1.16 0.00 0.00 179.01 176.95 1jr9 h PRO 17 N 0.17 -0.04 0.00 2.33 0.13 -1.95 -3.38 132.00 129.27 1jr9 h PRO 17 Ca 0.77 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.91 1jr9 h PRO 17 Cb 2.18 0.01 0.00 0.00 0.13 0.00 0.00 31.00 33.32 1jr9 h PRO 17 CO -0.49 0.24 0.00 2.41 -0.23 0.00 0.00 178.00 179.93 1jr9 n THR 18 N -4.98 0.00 -3.68 1.56 -1.04 -0.81 -4.78 114.28 100.55 1jr9 n THR 18 Ca -0.08 0.68 -0.37 0.00 -2.04 0.00 0.00 64.05 62.24 1jr9 n THR 18 Cb 0.16 -1.46 -0.11 0.00 -1.82 0.00 0.00 70.33 67.10 1jr9 n THR 18 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1jr9 s ILE 19 N -1.25 4.95 0.02 12.58 1.01 -0.73 -5.05 121.20 132.74 1jr9 s ILE 19 Ca 0.00 0.04 -0.30 0.00 0.00 0.00 0.00 60.65 60.39 1jr9 s ILE 19 Cb 0.00 -3.33 -0.08 0.00 0.01 0.00 0.00 42.46 39.06 1jr9 s ILE 19 CO 0.00 0.31 1.78 1.51 0.00 0.00 0.00 174.94 178.54 1jr9 s ASP 20 N 1.53 6.55 0.42 3.58 -4.77 -1.26 -3.21 116.67 119.51 1jr9 s ASP 20 Ca 0.07 2.49 0.34 0.00 -3.30 0.00 0.00 52.55 52.14 1jr9 s ASP 20 Cb -0.15 -2.54 1.38 0.00 -1.09 0.00 0.00 42.92 40.51 1jr9 s ASP 20 CO 0.07 -0.97 1.37 2.29 0.70 0.00 0.00 175.17 178.63 1jr9 n LYS 21 N 6.82 -0.02 0.05 2.11 2.85 -1.24 -0.06 118.16 128.66 1jr9 n LYS 21 Ca 0.18 1.05 -0.11 0.00 -1.05 0.00 0.00 58.31 58.37 1jr9 n LYS 21 Cb 0.41 -2.17 -0.06 0.00 -0.65 0.00 0.00 35.03 32.56 1jr9 n LYS 21 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 1jr9 h GLU 22 N 0.00 -0.13 -0.51 -1.58 4.81 -1.89 0.25 114.58 115.54 1jr9 h GLU 22 Ca 0.79 0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.91 1jr9 h GLU 22 Cb 2.76 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 32.15 1jr9 h GLU 22 CO -0.28 -0.08 -0.15 1.15 -0.73 0.00 0.00 179.01 178.92 1jr9 h THR 23 N -0.13 1.27 -0.93 0.32 2.02 -0.85 -2.46 112.91 112.14 1jr9 h THR 23 Ca 0.03 -1.30 0.16 0.00 0.77 0.00 0.00 66.41 66.07 1jr9 h THR 23 Cb 0.16 1.04 -0.10 0.00 -1.74 0.00 0.00 68.15 67.51 1jr9 h THR 23 CO -0.07 0.46 0.53 0.24 0.37 0.00 0.00 175.52 177.04 1jr9 h MET 24 N 0.87 0.69 0.18 6.66 2.86 -0.99 0.64 114.93 125.84 1jr9 h MET 24 Ca 0.13 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.72 1jr9 h MET 24 Cb 0.71 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.22 1jr9 h MET 24 CO 0.05 0.46 -0.08 -0.97 1.06 0.00 0.00 176.91 177.43 1jr9 h ASN 25 N 0.72 -0.20 0.49 1.22 -0.73 -0.61 -2.73 115.58 113.73 1jr9 h ASN 25 Ca 0.52 -0.20 -0.02 0.00 1.87 0.00 0.00 56.30 58.46 1jr9 h ASN 25 Cb 0.75 0.05 0.00 0.00 0.27 0.00 0.00 38.32 39.40 1jr9 h ASN 25 CO -0.37 0.10 -0.24 0.40 -0.37 0.00 0.00 177.43 176.95 1jr9 h ILE 26 N -0.51 0.00 -0.70 2.57 2.04 -0.93 0.11 117.51 120.09 1jr9 h ILE 26 Ca -0.02 -0.12 0.20 0.00 1.00 0.00 0.00 64.86 65.92 1jr9 h ILE 26 Cb 0.39 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.44 1jr9 h ILE 26 CO 0.04 0.00 0.83 -0.74 0.00 0.00 0.00 178.15 178.28 1jr9 h HIS 27 N -0.78 0.00 0.00 1.37 2.76 0.15 0.45 115.15 119.10 1jr9 h HIS 27 Ca -0.07 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.10 1jr9 h HIS 27 Cb 0.51 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.47 1jr9 h HIS 27 CO 0.07 0.00 -0.82 1.58 -1.30 0.00 0.00 177.93 177.46 1jr9 n HIS 28 N -3.44 0.35 1.58 5.26 -0.00 -1.03 -2.90 115.22 115.04 1jr9 n HIS 28 Ca 0.15 0.15 0.15 0.00 -0.00 0.00 0.00 57.72 58.17 1jr9 n HIS 28 Cb 1.06 -0.60 0.81 0.00 -0.00 0.00 0.00 29.99 31.26 1jr9 n HIS 28 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 1jr9 n THR 29 N -4.52 0.01 0.00 3.57 -2.24 0.36 -2.90 114.28 108.56 1jr9 n THR 29 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1jr9 n THR 29 Cb 0.43 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 1jr9 n THR 29 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1jr9 n LYS 30 N -1.20 0.00 0.00 -0.78 4.76 0.15 -4.68 118.16 116.41 1jr9 n LYS 30 Ca 0.17 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.61 1jr9 n LYS 30 Cb 0.20 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.39 1jr9 n LYS 30 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1jr9 n HIS 31 N -0.38 0.00 -0.34 2.13 8.25 -1.19 -0.35 115.22 123.33 1jr9 n HIS 31 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 1jr9 n HIS 31 Cb 0.00 -0.24 -0.09 0.00 1.12 0.00 0.00 29.99 30.78 1jr9 n HIS 31 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1jr9 h HIS 32 N 0.00 -1.65 -0.67 4.41 -0.00 -1.66 0.23 115.15 115.81 1jr9 h HIS 32 Ca 0.00 0.11 0.12 0.00 -0.00 0.00 0.00 60.37 60.60 1jr9 h HIS 32 Cb 0.00 0.83 -0.12 0.00 -0.00 0.00 0.00 27.41 28.11 1jr9 h HIS 32 CO -0.33 -0.34 -0.32 -0.97 -0.00 0.00 0.00 177.93 175.97 1jr9 h ASN 33 N -0.04 -1.14 -0.66 3.26 -0.73 -1.37 0.26 115.58 115.16 1jr9 h ASN 33 Ca 0.13 0.24 0.12 0.00 1.87 0.00 0.00 56.30 58.66 1jr9 h ASN 33 Cb 0.38 0.59 -0.12 0.00 0.27 0.00 0.00 38.32 39.43 1jr9 h ASN 33 CO -0.79 -0.29 -0.28 0.74 -0.37 0.00 0.00 177.43 176.44 1jr9 h THR 34 N -0.12 0.20 -0.60 -3.57 2.02 0.24 0.17 112.91 111.26 1jr9 h THR 34 Ca 0.27 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.53 1jr9 h THR 34 Cb 0.56 0.20 -0.07 0.00 -1.74 0.00 0.00 68.15 67.10 1jr9 h THR 34 CO -0.74 0.00 0.23 1.88 0.37 0.00 0.00 175.52 177.27 1jr9 h TYR 35 N -0.09 0.41 0.00 3.16 0.05 0.31 0.39 116.97 121.20 1jr9 h TYR 35 Ca 0.28 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 59.08 1jr9 h TYR 35 Cb 0.54 -0.09 -0.00 0.00 1.01 0.00 0.00 36.73 38.19 1jr9 h TYR 35 CO -0.62 0.12 -0.07 0.28 -1.05 0.00 0.00 178.16 176.82 1jr9 h VAL 36 N 0.42 1.03 0.10 -2.88 2.07 0.23 -0.17 116.25 117.05 1jr9 h VAL 36 Ca 0.30 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 1jr9 h VAL 36 Cb 0.34 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1jr9 h VAL 36 CO -0.29 0.07 -0.05 0.74 0.02 0.00 0.00 177.57 178.06 1jr9 h THR 37 N 0.00 0.00 -1.14 2.57 2.02 0.18 -2.64 112.91 113.89 1jr9 h THR 37 Ca -0.00 -0.17 0.35 0.00 0.77 0.00 0.00 66.41 67.37 1jr9 h THR 37 Cb 0.12 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.40 1jr9 h THR 37 CO 0.01 0.00 0.71 0.11 0.37 0.00 0.00 175.52 176.72 1jr9 h LYS 38 N -0.30 0.23 0.00 6.66 1.79 -0.50 -1.73 116.57 122.72 1jr9 h LYS 38 Ca -0.01 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1jr9 h LYS 38 Cb 0.10 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.70 1jr9 h LYS 38 CO 0.02 0.15 0.00 -0.11 -1.08 0.00 0.00 179.45 178.44 1jr9 n LEU 39 N -4.78 0.05 -0.36 2.94 7.94 -0.08 -2.95 117.00 119.74 1jr9 n LEU 39 Ca 0.32 0.87 0.28 0.00 -1.11 0.00 0.00 56.01 56.38 1jr9 n LEU 39 Cb 1.14 -0.46 0.57 0.00 0.53 0.00 0.00 43.42 45.21 1jr9 n LEU 39 CO 0.19 -0.46 1.23 0.78 -1.11 0.00 0.00 177.39 178.02 1jr9 h ASN 40 N 0.00 0.34 -0.11 1.96 2.35 -1.04 0.13 115.58 119.21 1jr9 h ASN 40 Ca 0.00 0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1jr9 h ASN 40 Cb 0.00 0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1jr9 h ASN 40 CO 0.00 -0.01 0.00 0.61 -1.65 0.00 0.00 177.43 176.38 1jr9 n GLY 41 N -1.51 -0.45 0.26 2.83 0.00 -0.70 -3.07 105.19 102.55 1jr9 n GLY 41 Ca 0.29 -0.14 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 1jr9 n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jr9 n ALA 42 N -0.17 1.82 1.28 4.61 0.00 0.45 -4.32 120.51 124.18 1jr9 n ALA 42 Ca 0.05 -0.61 0.10 0.00 0.00 0.00 0.00 53.44 52.97 1jr9 n ALA 42 Cb 0.10 0.22 0.58 0.00 0.00 0.00 0.00 19.45 20.36 1jr9 n ALA 42 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1jr9 n LEU 43 N -3.25 0.00 -4.61 0.00 4.77 -1.16 -4.67 117.00 108.09 1jr9 n LEU 43 Ca -0.28 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.28 1jr9 n LEU 43 Cb 0.75 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.81 1jr9 n LEU 43 CO 0.09 0.00 1.59 -0.70 -1.33 0.00 0.00 177.39 177.04 1jr9 s GLU 44 N -2.00 3.40 0.00 3.23 2.56 -1.17 -1.52 118.70 123.20 1jr9 s GLU 44 Ca 0.29 1.69 0.00 0.00 0.00 0.00 0.00 54.97 56.95 1jr9 s GLU 44 Cb 0.13 -4.21 0.00 0.00 2.00 0.00 0.00 34.13 32.05 1jr9 s GLU 44 CO 0.22 -1.78 0.00 0.41 -0.56 0.00 0.00 175.26 173.55 1jr9 n GLY 45 N 5.34 3.40 3.22 -1.50 0.00 -1.26 -4.98 105.19 109.43 1jr9 n GLY 45 Ca 0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 1jr9 n GLY 45 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1jr9 n HIS 46 N -1.70 4.15 0.00 1.61 8.25 -0.57 -4.92 115.22 122.03 1jr9 n HIS 46 Ca 0.00 -3.15 0.00 0.00 -0.26 0.00 0.00 57.72 54.31 1jr9 n HIS 46 Cb 0.00 -2.04 0.00 0.00 1.12 0.00 0.00 29.99 29.07 1jr9 n HIS 46 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1jr9 n GLU 47 N 4.65 0.00 -0.32 -0.41 2.13 -1.26 -1.69 120.64 123.74 1jr9 n GLU 47 Ca 0.37 0.60 0.31 0.00 0.66 0.00 0.00 57.16 59.09 1jr9 n GLU 47 Cb 0.40 -0.99 0.66 0.00 0.27 0.00 0.00 31.44 31.78 1jr9 n GLU 47 CO 0.00 0.00 0.00 0.38 -0.41 0.00 0.00 177.13 177.10 1jr9 h ASP 48 N 0.00 0.17 0.16 4.31 3.04 -1.97 0.35 116.42 122.49 1jr9 h ASP 48 Ca 0.00 0.03 -0.01 0.00 -3.24 0.00 0.00 57.03 53.82 1jr9 h ASP 48 Cb 0.00 0.01 0.00 0.00 -1.04 0.00 0.00 39.33 38.30 1jr9 h ASP 48 CO 0.00 0.02 -0.08 -0.07 -2.04 0.00 0.00 179.24 177.07 1jr9 h LEU 49 N 0.14 -0.19 0.00 0.15 3.38 -1.70 -3.15 115.31 113.94 1jr9 h LEU 49 Ca 0.58 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1jr9 h LEU 49 Cb 1.98 0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.78 1jr9 h LEU 49 CO -0.12 0.29 0.10 1.17 0.09 0.00 0.00 178.44 179.97 1jr9 n LYS 50 N -4.97 0.00 -0.15 1.13 4.81 0.10 0.16 118.16 119.24 1jr9 n LYS 50 Ca -0.08 0.15 0.07 0.00 -0.87 0.00 0.00 58.31 57.57 1jr9 n LYS 50 Cb 0.26 -1.60 0.14 0.00 0.02 0.00 0.00 35.03 33.85 1jr9 n LYS 50 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1jr9 n ASN 51 N -1.05 2.81 -4.77 3.14 4.13 -1.16 -5.00 115.26 113.36 1jr9 n ASN 51 Ca 0.00 -1.87 -0.31 0.00 1.68 0.00 0.00 54.58 54.08 1jr9 n ASN 51 Cb 0.10 -0.19 -0.07 0.00 -1.54 0.00 0.00 39.78 38.08 1jr9 n ASN 51 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1jr9 s LYS 52 N -1.03 2.93 0.45 3.52 1.02 0.12 -5.09 119.74 121.67 1jr9 s LYS 52 Ca 0.24 -0.63 -0.24 0.00 0.02 0.00 0.00 55.97 55.36 1jr9 s LYS 52 Cb 0.13 -2.76 -0.07 0.00 -0.52 0.00 0.00 37.83 34.61 1jr9 s LYS 52 CO 0.18 0.59 1.21 -1.54 -0.92 0.00 0.00 175.35 174.87 1jr9 s SER 53 N -2.19 6.13 0.30 2.83 1.04 -1.26 -4.73 113.70 115.83 1jr9 s SER 53 Ca 0.27 2.42 0.06 0.00 0.48 0.00 0.00 55.95 59.18 1jr9 s SER 53 Cb -0.12 -2.61 0.82 0.00 0.10 0.00 0.00 66.02 64.21 1jr9 s SER 53 CO 0.20 -0.95 1.64 0.25 0.98 0.00 0.00 173.24 175.36 1jr9 h LEU 54 N 2.16 0.09 0.96 2.42 5.85 -1.98 0.26 115.31 125.07 1jr9 h LEU 54 Ca -0.49 0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.38 1jr9 h LEU 54 Cb 1.25 0.26 0.01 0.00 0.37 0.00 0.00 40.66 42.55 1jr9 h LEU 54 CO 0.61 -0.18 -0.46 0.78 -0.34 0.00 0.00 178.44 178.84 1jr9 h ASN 55 N 0.21 -1.09 -0.14 1.25 2.35 -1.97 0.29 115.58 116.48 1jr9 h ASN 55 Ca 0.61 0.04 0.04 0.00 -0.55 0.00 0.00 56.30 56.44 1jr9 h ASN 55 Cb 1.29 0.28 -0.07 0.00 0.05 0.00 0.00 38.32 39.88 1jr9 h ASN 55 CO -0.67 -0.76 -0.42 0.44 -1.65 0.00 0.00 177.43 174.37 1jr9 h ASP 56 N -1.33 -1.32 -0.76 5.81 3.45 -1.62 0.28 116.42 120.93 1jr9 h ASP 56 Ca -0.13 0.17 0.15 0.00 0.43 0.00 0.00 57.03 57.65 1jr9 h ASP 56 Cb 0.99 0.54 -0.14 0.00 -0.56 0.00 0.00 39.33 40.15 1jr9 h ASP 56 CO 0.22 -0.42 -0.25 0.25 -1.57 0.00 0.00 179.24 177.47 1jr9 h LEU 57 N -0.49 -0.90 -0.43 1.55 5.85 -0.42 -0.98 115.31 119.49 1jr9 h LEU 57 Ca 0.08 0.24 -0.07 0.00 0.84 0.00 0.00 57.88 58.97 1jr9 h LEU 57 Cb 0.62 0.54 -0.02 0.00 0.37 0.00 0.00 40.66 42.17 1jr9 h LEU 57 CO -0.40 -0.27 0.01 0.40 -0.34 0.00 0.00 178.44 177.83 1jr9 h ILE 58 N -0.04 1.26 0.00 4.05 1.08 0.66 -3.35 117.51 121.17 1jr9 h ILE 58 Ca 0.34 -1.01 0.00 0.00 -0.39 0.00 0.00 64.86 63.80 1jr9 h ILE 58 Cb 0.57 1.07 0.00 0.00 -3.07 0.00 0.00 36.82 35.40 1jr9 h ILE 58 CO -0.80 0.35 0.00 -1.20 -0.69 0.00 0.00 178.15 175.81 1jr9 n SER 59 N -4.42 0.00 -4.58 1.72 7.64 0.87 -3.82 113.62 111.03 1jr9 n SER 59 Ca -0.00 0.55 -0.37 0.00 1.01 0.00 0.00 58.87 60.06 1jr9 n SER 59 Cb 0.29 -0.05 -0.03 0.00 -1.01 0.00 0.00 64.21 63.41 1jr9 n SER 59 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1jr9 s ASN 60 N -2.41 6.08 0.00 6.43 -0.87 -0.94 -4.73 114.94 118.50 1jr9 s ASN 60 Ca 0.00 -2.08 0.06 0.00 -1.57 0.00 0.00 52.86 49.27 1jr9 s ASN 60 Cb 0.00 -2.58 0.37 0.00 -0.02 0.00 0.00 41.25 39.02 1jr9 s ASN 60 CO 0.00 -1.96 1.06 -0.11 -2.57 0.00 0.00 177.10 173.52 1jr9 n LEU 61 N 10.88 0.00 -0.03 0.60 7.94 -1.25 -3.24 117.00 131.90 1jr9 n LEU 61 Ca 0.47 0.00 -0.21 0.00 -1.11 0.00 0.00 56.01 55.15 1jr9 n LEU 61 Cb 0.46 0.00 -0.13 0.00 0.53 0.00 0.00 43.42 44.28 1jr9 n LEU 61 CO 0.73 0.00 -0.83 0.47 -1.11 0.00 0.00 177.39 176.65 1jr9 n ASP 62 N -0.62 2.06 0.16 1.96 8.00 -1.26 -4.10 116.55 122.74 1jr9 n ASP 62 Ca 0.05 0.22 0.08 0.00 0.71 0.00 0.00 54.79 55.84 1jr9 n ASP 62 Cb 0.02 -0.84 0.42 0.00 -0.02 0.00 0.00 41.12 40.70 1jr9 n ASP 62 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jr9 n ALA 63 N -3.14 0.76 -2.62 2.24 0.00 -1.20 -4.46 120.51 112.08 1jr9 n ALA 63 Ca -0.34 0.14 -0.39 0.00 0.00 0.00 0.00 53.44 52.86 1jr9 n ALA 63 Cb 0.97 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 19.41 1jr9 n ALA 63 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1jr9 s VAL 64 N -3.37 5.05 0.55 0.00 -7.23 -1.26 -5.04 120.40 109.11 1jr9 s VAL 64 Ca -0.02 1.15 -0.21 0.00 -1.81 0.00 0.00 61.98 61.10 1jr9 s VAL 64 Cb 0.04 -3.90 -0.05 0.00 0.56 0.00 0.00 36.38 33.04 1jr9 s VAL 64 CO 0.14 0.36 1.27 -0.81 -0.31 0.00 0.00 175.10 175.75 1jr9 n PRO 65 N 3.26 1.51 -0.22 4.82 -0.04 -1.26 -4.61 135.00 138.47 1jr9 n PRO 65 Ca -0.06 0.56 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 1jr9 n PRO 65 Cb 0.51 -2.48 0.08 0.00 -0.04 0.00 0.00 33.50 31.57 1jr9 n PRO 65 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1jr9 h GLU 66 N 1.23 0.02 -0.11 0.54 3.07 -1.96 0.94 114.58 118.30 1jr9 h GLU 66 Ca -0.50 -0.00 0.03 0.00 -0.50 0.00 0.00 59.36 58.39 1jr9 h GLU 66 Cb 1.32 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.22 1jr9 h GLU 66 CO 0.56 0.01 0.72 -0.97 -1.40 0.00 0.00 179.01 177.93 1jr9 h ASN 67 N 0.02 0.00 0.00 1.42 -1.24 -2.04 -2.10 115.58 111.65 1jr9 h ASN 67 Ca 0.32 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.33 1jr9 h ASN 67 Cb 0.49 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.54 1jr9 h ASN 67 CO -0.64 0.00 0.00 2.30 -1.29 0.00 0.00 177.43 177.80 1jr9 n ILE 68 N -2.79 0.00 -0.09 2.57 -5.35 -0.59 -4.89 119.36 108.22 1jr9 n ILE 68 Ca 0.02 0.00 -0.06 0.00 -0.27 0.00 0.00 62.75 62.44 1jr9 n ILE 68 Cb 0.78 1.28 0.00 0.00 -1.74 0.00 0.00 39.64 39.96 1jr9 n ILE 68 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 1jr9 h ARG 69 N 0.00 -0.05 -0.02 6.28 2.43 -0.12 -1.87 114.38 121.03 1jr9 h ARG 69 Ca 0.00 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1jr9 h ARG 69 Cb 0.78 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.29 1jr9 h ARG 69 CO 0.00 -0.03 -0.26 1.15 -1.51 0.00 0.00 179.97 179.32 1jr9 h THR 70 N -0.05 0.40 -0.99 0.20 2.02 -1.86 -0.94 112.91 111.69 1jr9 h THR 70 Ca 0.17 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.44 1jr9 h THR 70 Cb 0.31 0.40 -0.07 0.00 -1.74 0.00 0.00 68.15 67.05 1jr9 h THR 70 CO -0.38 0.00 0.63 0.00 0.37 0.00 0.00 175.52 176.15 1jr9 h ALA 71 N 0.44 1.49 0.00 6.16 0.00 -1.81 0.39 119.26 125.93 1jr9 h ALA 71 Ca 0.07 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1jr9 h ALA 71 Cb 0.49 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1jr9 h ALA 71 CO -0.24 0.32 -0.21 0.28 0.00 0.00 0.00 179.25 179.39 1jr9 h VAL 72 N 1.06 0.56 0.00 0.00 2.07 -0.94 -1.21 116.25 117.80 1jr9 h VAL 72 Ca 0.46 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.96 1jr9 h VAL 72 Cb 0.34 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1jr9 h VAL 72 CO -0.21 0.21 0.00 -1.14 0.02 0.00 0.00 177.57 176.44 1jr9 n ARG 73 N -3.44 0.00 -0.37 1.57 0.63 0.11 -0.17 116.66 114.99 1jr9 n ARG 73 Ca -0.00 0.04 0.30 0.00 -0.92 0.00 0.00 57.85 57.27 1jr9 n ARG 73 Cb 0.39 -0.69 0.56 0.00 0.45 0.00 0.00 32.46 33.18 1jr9 n ARG 73 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 1jr9 h ASN 74 N 0.00 0.38 0.28 6.15 2.35 -0.74 0.40 115.58 124.40 1jr9 h ASN 74 Ca 0.00 0.17 -0.33 0.00 -0.55 0.00 0.00 56.30 55.59 1jr9 h ASN 74 Cb 0.00 0.15 -0.05 0.00 0.05 0.00 0.00 38.32 38.47 1jr9 h ASN 74 CO 0.00 -0.19 -1.95 0.59 -1.65 0.00 0.00 177.43 174.24 1jr9 n ASN 75 N -4.92 1.15 0.02 5.81 3.02 -0.46 -3.24 115.26 116.63 1jr9 n ASN 75 Ca 0.34 0.26 -0.08 0.00 -0.03 0.00 0.00 54.58 55.07 1jr9 n ASN 75 Cb 1.19 -0.14 0.08 0.00 -0.61 0.00 0.00 39.78 40.31 1jr9 n ASN 75 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1jr9 h GLY 76 N 2.84 0.54 0.34 7.41 0.00 0.92 -2.43 103.07 112.69 1jr9 h GLY 76 Ca -0.38 -0.61 -0.02 0.00 0.00 0.00 0.00 47.33 46.31 1jr9 h GLY 76 CO 0.06 0.55 -0.09 -1.33 0.00 0.00 0.00 176.54 175.73 1jr9 h GLY 77 N 1.13 0.08 0.54 4.60 0.00 -0.38 -2.97 103.07 106.07 1jr9 h GLY 77 Ca 0.01 -0.13 0.03 0.00 0.00 0.00 0.00 47.33 47.25 1jr9 h GLY 77 CO 0.10 0.11 -0.15 -1.33 0.00 0.00 0.00 176.54 175.26 1jr9 h GLY 78 N -0.63 -0.14 1.44 4.60 0.00 -1.60 0.78 103.07 107.52 1jr9 h GLY 78 Ca -0.01 0.19 0.05 0.00 0.00 0.00 0.00 47.33 47.56 1jr9 h GLY 78 CO 0.02 -0.15 0.26 0.84 0.00 0.00 0.00 176.54 177.51 1jr9 h HIS 79 N -0.22 0.32 0.10 5.60 6.17 -1.55 0.40 115.15 125.97 1jr9 h HIS 79 Ca 0.07 0.01 -0.16 0.00 0.71 0.00 0.00 60.37 61.00 1jr9 h HIS 79 Cb 0.32 -0.11 0.01 0.00 2.52 0.00 0.00 27.41 30.16 1jr9 h HIS 79 CO -0.24 0.18 -0.76 0.00 0.71 0.00 0.00 177.93 177.81 1jr9 h ALA 80 N 1.79 -0.01 0.28 5.26 0.00 -1.13 -3.00 119.26 122.44 1jr9 h ALA 80 Ca 0.17 -0.75 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 1jr9 h ALA 80 Cb 0.26 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1jr9 h ALA 80 CO -0.04 0.39 -0.13 -0.91 0.00 0.00 0.00 179.25 178.56 1jr9 h ASN 81 N -0.52 -0.32 -0.43 0.00 2.35 0.92 -2.49 115.58 115.09 1jr9 h ASN 81 Ca -0.15 -0.07 -0.06 0.00 -0.55 0.00 0.00 56.30 55.47 1jr9 h ASN 81 Cb 1.51 0.08 -0.02 0.00 0.05 0.00 0.00 38.32 39.94 1jr9 h ASN 81 CO 0.09 -0.13 0.07 0.45 -1.65 0.00 0.00 177.43 176.25 1jr9 h HIS 82 N -0.49 0.83 -0.48 1.19 3.86 -1.10 -0.33 115.15 118.62 1jr9 h HIS 82 Ca -0.04 -0.09 0.07 0.00 -1.16 0.00 0.00 60.37 59.15 1jr9 h HIS 82 Cb 0.37 -0.24 -0.06 0.00 1.06 0.00 0.00 27.41 28.54 1jr9 h HIS 82 CO -0.03 0.73 0.16 0.77 0.86 0.00 0.00 177.93 180.42 1jr9 h SER 83 N 0.75 0.15 -0.04 2.45 0.02 -1.40 -1.63 113.55 113.85 1jr9 h SER 83 Ca 0.16 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 1jr9 h SER 83 Cb 0.36 0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.95 1jr9 h SER 83 CO 0.01 0.11 -0.02 0.25 -1.14 0.00 0.00 176.83 176.04 1jr9 h LEU 84 N 0.33 0.08 -0.42 5.07 6.46 -1.06 -3.31 115.31 122.46 1jr9 h LEU 84 Ca 0.23 -0.42 0.07 0.00 -0.12 0.00 0.00 57.88 57.64 1jr9 h LEU 84 Cb 0.26 -0.02 -0.09 0.00 -0.73 0.00 0.00 40.66 40.07 1jr9 h LEU 84 CO -0.25 0.49 -0.46 0.15 -0.62 0.00 0.00 178.44 177.74 1jr9 h PHE 85 N -0.32 -1.37 -1.39 1.25 3.57 -0.61 -0.59 116.94 117.47 1jr9 h PHE 85 Ca 0.01 0.07 0.42 0.00 3.53 0.00 0.00 57.97 62.00 1jr9 h PHE 85 Cb 0.46 0.66 -0.09 0.00 2.79 0.00 0.00 35.95 39.76 1jr9 h PHE 85 CO 0.07 -0.46 0.95 -1.49 -2.23 0.00 0.00 178.31 175.16 1jr9 h TRP 86 N -0.34 0.29 0.00 0.41 -0.00 -1.40 0.45 115.95 115.36 1jr9 h TRP 86 Ca 0.12 0.01 0.00 0.00 -0.00 0.00 0.00 58.89 59.03 1jr9 h TRP 86 Cb 0.59 -0.08 0.00 0.00 -0.00 0.00 0.00 29.16 29.67 1jr9 h TRP 86 CO -0.66 -0.06 -0.61 1.63 -0.00 0.00 0.00 178.44 178.74 1jr9 n LYS 87 N -4.38 0.18 -1.03 0.49 5.02 -0.26 -4.16 118.16 114.03 1jr9 n LYS 87 Ca 0.34 0.04 -0.23 0.00 -2.02 0.00 0.00 58.31 56.45 1jr9 n LYS 87 Cb 1.43 -1.60 0.06 0.00 -0.02 0.00 0.00 35.03 34.90 1jr9 n LYS 87 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1jr9 n LEU 88 N -1.86 6.78 -3.52 -0.35 4.77 0.16 -4.81 117.00 118.17 1jr9 n LEU 88 Ca 0.04 -3.58 -0.11 0.00 -0.03 0.00 0.00 56.01 52.32 1jr9 n LEU 88 Cb 0.40 -1.00 -0.03 0.00 -2.33 0.00 0.00 43.42 40.46 1jr9 n LEU 88 CO 0.36 1.27 0.29 -0.04 -1.33 0.00 0.00 177.39 177.93 1jr9 s MET 89 N -2.51 1.17 -0.29 3.23 -1.94 -1.26 -3.56 119.30 114.14 1jr9 s MET 89 Ca 0.43 -0.56 -0.24 0.00 -1.71 0.00 0.00 55.69 53.61 1jr9 s MET 89 Cb 0.34 0.53 0.15 0.00 2.01 0.00 0.00 34.83 37.86 1jr9 s MET 89 CO 0.00 -0.48 1.19 0.45 -0.01 0.00 0.00 175.02 176.16 1jr9 s SER 90 N -2.72 -0.29 0.54 3.03 0.15 -0.03 -4.67 113.70 109.69 1jr9 s SER 90 Ca 0.01 0.56 0.21 0.00 0.70 0.00 0.00 55.95 57.43 1jr9 s SER 90 Cb 0.00 0.63 1.44 0.00 -1.71 0.00 0.00 66.02 66.38 1jr9 s SER 90 CO -0.12 -0.09 2.17 1.55 1.20 0.00 0.00 173.24 177.95 1jr9 h PRO 91 N 3.99 0.00 -0.88 5.44 0.13 -1.87 -1.45 132.00 137.37 1jr9 h PRO 91 Ca -0.28 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.24 1jr9 h PRO 91 Cb 1.18 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.97 1jr9 h PRO 91 CO 0.14 0.02 0.12 0.09 -0.23 0.00 0.00 178.00 178.15 1jr9 n ASN 92 N -4.24 6.33 -0.19 1.44 3.02 -1.26 -4.99 115.26 115.38 1jr9 n ASN 92 Ca -0.03 -3.77 0.00 0.00 -0.03 0.00 0.00 54.58 50.75 1jr9 n ASN 92 Cb 0.11 -0.69 0.00 0.00 -0.61 0.00 0.00 39.78 38.58 1jr9 n ASN 92 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jr9 n GLY 93 N -0.84 6.48 2.10 7.41 0.00 -0.55 -5.07 105.19 114.73 1jr9 n GLY 93 Ca 0.54 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.75 1jr9 n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jr9 n GLY 94 N 3.00 -1.79 4.04 -0.02 0.00 0.86 -4.75 105.19 106.52 1jr9 n GLY 94 Ca 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1jr9 n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jr9 n GLY 95 N 0.00 0.34 3.65 -0.02 0.00 -1.26 -4.65 105.19 103.25 1jr9 n GLY 95 Ca 0.00 -1.30 -0.29 0.00 0.00 0.00 0.00 46.02 44.44 1jr9 n GLY 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jr9 s LYS 96 N 0.00 2.39 0.96 1.61 -2.85 -1.26 -4.95 119.74 115.64 1jr9 s LYS 96 Ca 0.00 -0.98 -0.11 0.00 -1.00 0.00 0.00 55.97 53.88 1jr9 s LYS 96 Cb 0.00 -2.42 0.14 0.00 -2.06 0.00 0.00 37.83 33.49 1jr9 s LYS 96 CO 0.00 0.50 0.96 -2.30 0.10 0.00 0.00 175.35 174.61 1jr9 n PRO 97 N 0.35 -0.68 -4.08 1.78 -0.02 -1.26 -4.92 135.00 126.17 1jr9 n PRO 97 Ca -0.11 -0.14 -0.09 0.00 -2.02 0.00 0.00 63.50 61.14 1jr9 n PRO 97 Cb 0.53 -2.23 -0.09 0.00 -0.02 0.00 0.00 33.50 31.68 1jr9 n PRO 97 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1jr9 s THR 98 N -2.56 0.13 0.00 3.45 -1.32 -1.26 -4.80 115.64 109.29 1jr9 s THR 98 Ca 0.65 -1.73 0.00 0.00 -1.21 0.00 0.00 61.69 59.39 1jr9 s THR 98 Cb -0.23 -1.81 0.00 0.00 -1.51 0.00 0.00 72.50 68.95 1jr9 s THR 98 CO 0.61 -0.59 0.00 0.61 -2.21 0.00 0.00 174.62 173.03 1jr9 n GLY 99 N -0.06 -1.93 0.40 6.08 0.00 -1.26 -3.46 105.19 104.96 1jr9 n GLY 99 Ca -0.09 -1.36 0.21 0.00 0.00 0.00 0.00 46.02 44.78 1jr9 n GLY 99 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1jr9 h GLU 100 N 0.00 0.06 -0.98 1.61 5.08 -2.00 0.18 114.58 118.53 1jr9 h GLU 100 Ca 0.00 -0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 1jr9 h GLU 100 Cb 0.01 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.18 1jr9 h GLU 100 CO 0.00 0.04 0.63 0.28 -1.00 0.00 0.00 179.01 178.95 1jr9 h VAL 101 N 0.06 1.06 0.91 3.13 2.07 -1.94 0.92 116.25 122.46 1jr9 h VAL 101 Ca 0.30 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 1jr9 h VAL 101 Cb 1.12 -0.16 0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1jr9 h VAL 101 CO -0.02 0.20 -0.44 0.00 0.02 0.00 0.00 177.57 177.34 1jr9 h ALA 102 N 1.46 -1.23 -0.14 1.67 0.00 -0.66 -0.96 119.26 119.40 1jr9 h ALA 102 Ca 0.43 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 55.09 1jr9 h ALA 102 Cb 0.21 0.47 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 1jr9 h ALA 102 CO -0.19 -1.16 -0.29 -0.44 0.00 0.00 0.00 179.25 177.18 1jr9 h ASP 103 N -1.28 -0.93 -0.95 0.00 3.45 -1.35 -0.05 116.42 115.31 1jr9 h ASP 103 Ca -0.13 0.12 0.29 0.00 0.43 0.00 0.00 57.03 57.74 1jr9 h ASP 103 Cb 0.94 0.37 -0.16 0.00 -0.56 0.00 0.00 39.33 39.93 1jr9 h ASP 103 CO 0.21 -0.23 0.34 0.50 -1.57 0.00 0.00 179.24 178.48 1jr9 h LYS 104 N -0.25 0.17 -0.94 3.56 1.63 -0.85 0.79 116.57 120.68 1jr9 h LYS 104 Ca 0.03 -0.01 0.03 0.00 -0.85 0.00 0.00 60.65 59.85 1jr9 h LYS 104 Cb 0.33 -0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 31.87 1jr9 h LYS 104 CO -0.27 0.11 0.62 0.82 -3.45 0.00 0.00 179.45 177.28 1jr9 h ILE 105 N 0.18 1.18 -0.07 2.00 2.04 0.39 0.30 117.51 123.54 1jr9 h ILE 105 Ca 0.65 -0.42 -0.18 0.00 1.00 0.00 0.00 64.86 65.92 1jr9 h ILE 105 Cb 1.45 -0.14 0.01 0.00 -0.74 0.00 0.00 36.82 37.40 1jr9 h ILE 105 CO -0.70 0.22 -0.66 0.78 0.00 0.00 0.00 178.15 177.79 1jr9 h ASN 106 N 1.21 0.70 -0.84 1.72 2.35 0.15 -2.14 115.58 118.73 1jr9 h ASN 106 Ca 0.37 -0.69 0.14 0.00 -0.55 0.00 0.00 56.30 55.57 1jr9 h ASN 106 Cb -0.04 -0.21 -0.09 0.00 0.05 0.00 0.00 38.32 38.03 1jr9 h ASN 106 CO -0.11 1.28 0.44 0.44 -1.65 0.00 0.00 177.43 177.83 1jr9 h ASP 107 N 0.17 0.55 0.00 5.81 5.19 -0.18 0.11 116.42 128.08 1jr9 h ASP 107 Ca -0.06 0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 1jr9 h ASP 107 Cb 1.33 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.83 1jr9 h ASP 107 CO 0.13 0.25 0.00 2.29 -3.12 0.00 0.00 179.24 178.79 1jr9 n LYS 108 N -4.85 0.00 -0.14 3.56 0.00 0.10 -4.26 118.16 112.58 1jr9 n LYS 108 Ca 0.16 0.00 0.01 0.00 -0.00 0.00 0.00 58.31 58.48 1jr9 n LYS 108 Cb 0.40 -0.17 0.06 0.00 -0.00 0.00 0.00 35.03 35.32 1jr9 n LYS 108 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1jr9 n TYR 109 N 0.00 0.31 0.00 5.58 4.02 -0.83 -4.91 117.16 121.34 1jr9 n TYR 109 Ca 0.00 -0.11 0.00 0.00 -0.01 0.00 0.00 57.90 57.78 1jr9 n TYR 109 Cb 0.00 -0.16 0.00 0.00 -0.02 0.00 0.00 39.34 39.16 1jr9 n TYR 109 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1jr9 n GLY 110 N 0.12 1.94 3.23 2.72 0.00 0.39 -4.52 105.19 109.08 1jr9 n GLY 110 Ca 0.04 -0.14 -0.16 0.00 0.00 0.00 0.00 46.02 45.77 1jr9 n GLY 110 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jr9 s SER 111 N 0.00 1.82 0.12 1.61 1.04 -1.26 -4.34 113.70 112.69 1jr9 s SER 111 Ca 0.00 -0.88 -0.22 0.00 0.48 0.00 0.00 55.95 55.33 1jr9 s SER 111 Cb 0.00 -0.03 -0.04 0.00 0.10 0.00 0.00 66.02 66.04 1jr9 s SER 111 CO 0.00 -0.23 1.69 0.15 0.98 0.00 0.00 173.24 175.83 1jr9 h PHE 112 N 3.29 -0.27 -0.66 5.02 3.57 -1.89 0.19 116.94 126.18 1jr9 h PHE 112 Ca -0.38 0.02 0.17 0.00 3.53 0.00 0.00 57.97 61.31 1jr9 h PHE 112 Cb 1.19 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 40.04 1jr9 h PHE 112 CO 0.65 -0.17 0.46 0.93 -2.23 0.00 0.00 178.31 177.96 1jr9 h GLU 113 N -0.14 0.12 0.23 1.11 3.07 -1.97 0.38 114.58 117.39 1jr9 h GLU 113 Ca 0.08 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 1jr9 h GLU 113 Cb 0.25 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 1jr9 h GLU 113 CO -0.19 0.08 -0.11 1.57 -1.40 0.00 0.00 179.01 178.97 1jr9 h LYS 114 N 0.13 -0.29 -0.06 2.33 5.09 -1.00 -2.03 116.57 120.73 1jr9 h LYS 114 Ca 0.32 0.02 0.04 0.00 0.09 0.00 0.00 60.65 61.12 1jr9 h LYS 114 Cb 1.08 0.07 -0.06 0.00 0.10 0.00 0.00 32.23 33.42 1jr9 h LYS 114 CO -0.04 0.02 -0.32 0.35 -2.09 0.00 0.00 179.45 177.37 1jr9 h PHE 115 N -0.62 -0.89 -0.62 0.07 3.57 0.12 -2.33 116.94 116.24 1jr9 h PHE 115 Ca -0.03 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.58 1jr9 h PHE 115 Cb 0.45 0.40 -0.11 0.00 2.79 0.00 0.00 35.95 39.48 1jr9 h PHE 115 CO 0.02 -0.41 -0.49 1.96 -2.23 0.00 0.00 178.31 177.17 1jr9 h GLN 116 N -0.44 -0.22 -1.01 1.11 4.20 -0.38 0.58 115.11 118.95 1jr9 h GLN 116 Ca 0.08 0.01 0.28 0.00 0.06 0.00 0.00 58.65 59.09 1jr9 h GLN 116 Cb 0.55 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.34 1jr9 h GLN 116 CO -0.31 -0.14 0.71 1.49 -0.67 0.00 0.00 178.83 179.91 1jr9 h GLU 117 N -0.22 0.07 0.00 1.46 4.81 -0.85 0.26 114.58 120.11 1jr9 h GLU 117 Ca 0.16 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.35 1jr9 h GLU 117 Cb 0.55 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.92 1jr9 h GLU 117 CO -0.72 0.04 -0.13 0.93 -0.73 0.00 0.00 179.01 178.41 1jr9 h GLU 118 N 0.07 0.08 0.69 1.92 4.39 0.48 -3.09 114.58 119.11 1jr9 h GLU 118 Ca 0.49 -0.09 -0.03 0.00 0.34 0.00 0.00 59.36 60.07 1jr9 h GLU 118 Cb 1.84 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 30.50 1jr9 h GLU 118 CO -0.05 0.88 -0.49 0.35 -1.16 0.00 0.00 179.01 178.54 1jr9 h PHE 119 N -0.68 -1.32 -0.96 4.33 3.57 0.14 -1.33 116.94 120.69 1jr9 h PHE 119 Ca -0.02 -0.01 0.28 0.00 3.53 0.00 0.00 57.97 61.75 1jr9 h PHE 119 Cb 0.93 0.48 -0.14 0.00 2.79 0.00 0.00 35.95 40.01 1jr9 h PHE 119 CO 0.20 -0.70 0.47 0.00 -2.23 0.00 0.00 178.31 176.04 1jr9 h ALA 120 N -1.01 1.70 -0.51 2.41 0.00 -0.75 0.55 119.26 121.64 1jr9 h ALA 120 Ca -0.09 0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1jr9 h ALA 120 Cb 0.92 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1jr9 h ALA 120 CO 0.05 -0.47 0.12 0.00 0.00 0.00 0.00 179.25 178.94 1jr9 h ALA 121 N 1.80 0.68 -0.14 0.00 0.00 -1.38 -2.06 119.26 118.17 1jr9 h ALA 121 Ca 0.66 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.33 1jr9 h ALA 121 Cb 1.40 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1jr9 h ALA 121 CO -0.59 0.38 0.01 0.00 0.00 0.00 0.00 179.25 179.05 1jr9 h ALA 122 N 1.00 0.18 0.00 0.00 0.00 0.11 0.11 119.26 120.66 1jr9 h ALA 122 Ca 0.16 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1jr9 h ALA 122 Cb 0.34 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1jr9 h ALA 122 CO 0.00 -0.14 -0.00 0.00 0.00 0.00 0.00 179.25 179.11 1jr9 h ALA 123 N 0.79 1.83 0.00 0.00 0.00 -0.51 -0.47 119.26 120.90 1jr9 h ALA 123 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1jr9 h ALA 123 Cb 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1jr9 h ALA 123 CO 0.00 0.01 -1.13 0.00 0.00 0.00 0.00 179.25 178.13 1jr9 n ALA 124 N -2.46 2.83 0.05 0.00 0.00 -0.78 -4.25 120.51 115.90 1jr9 n ALA 124 Ca -0.03 -0.32 -0.13 0.00 0.00 0.00 0.00 53.44 52.96 1jr9 n ALA 124 Cb 0.09 -1.02 -0.09 0.00 0.00 0.00 0.00 19.45 18.43 1jr9 n ALA 124 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1jr9 h GLY 125 N 4.19 -0.17 -6.76 0.00 0.00 0.91 -3.44 103.07 97.80 1jr9 h GLY 125 Ca 0.00 0.06 -0.71 0.00 0.00 0.00 0.00 47.33 46.68 1jr9 h GLY 125 CO 0.00 -0.06 1.23 -2.13 0.00 0.00 0.00 176.54 175.58 1jr9 n ARG 126 N -4.97 0.94 -3.06 4.80 3.00 -1.01 -4.93 116.66 111.42 1jr9 n ARG 126 Ca -0.09 0.29 -0.36 0.00 -0.00 0.00 0.00 57.85 57.69 1jr9 n ARG 126 Cb 0.24 -2.19 -0.06 0.00 0.00 0.00 0.00 32.46 30.45 1jr9 n ARG 126 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.63 177.75 1jr9 s PHE 127 N 5.84 3.66 0.00 -0.14 5.36 -1.26 -4.86 117.98 126.58 1jr9 s PHE 127 Ca 1.07 1.44 0.00 0.00 -0.96 0.00 0.00 56.93 58.48 1jr9 s PHE 127 Cb -1.03 -2.66 0.00 0.00 -0.34 0.00 0.00 43.02 38.99 1jr9 s PHE 127 CO 0.57 0.33 0.00 0.41 -1.46 0.00 0.00 175.22 175.07 1jr9 n GLY 128 N 0.73 0.95 3.94 13.12 0.00 -1.26 -4.76 105.19 117.90 1jr9 n GLY 128 Ca -0.02 -0.72 -0.27 0.00 0.00 0.00 0.00 46.02 45.02 1jr9 n GLY 128 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jr9 s SER 129 N -4.00 4.38 0.00 1.61 0.01 -1.26 -4.81 113.70 109.62 1jr9 s SER 129 Ca 0.00 0.32 0.00 0.00 1.31 0.00 0.00 55.95 57.58 1jr9 s SER 129 Cb 0.00 -0.80 0.00 0.00 0.21 0.00 0.00 66.02 65.43 1jr9 s SER 129 CO 0.00 -1.89 0.00 0.61 0.41 0.00 0.00 173.24 172.37 1jr9 n GLY 130 N -3.11 1.73 3.27 3.44 0.00 -1.21 -2.52 105.19 106.79 1jr9 n GLY 130 Ca 0.10 -1.87 -0.15 0.00 0.00 0.00 0.00 46.02 44.10 1jr9 n GLY 130 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1jr9 s TRP 131 N -1.33 1.37 0.08 1.61 0.52 0.15 -2.12 118.94 119.21 1jr9 s TRP 131 Ca 0.00 -0.70 0.07 0.00 0.02 0.00 0.00 56.10 55.49 1jr9 s TRP 131 Cb 0.00 -0.68 -0.04 0.00 -1.15 0.00 0.00 33.47 31.60 1jr9 s TRP 131 CO 0.00 0.15 -0.12 0.00 0.02 0.00 0.00 176.95 176.99 1jr9 s ALA 132 N -3.12 2.86 0.24 0.98 0.00 -1.13 -0.52 121.76 121.06 1jr9 s ALA 132 Ca 0.17 -1.21 -0.06 0.00 0.00 0.00 0.00 51.96 50.86 1jr9 s ALA 132 Cb 0.01 -0.87 -0.02 0.00 0.00 0.00 0.00 23.12 22.24 1jr9 s ALA 132 CO 0.02 0.62 0.32 -1.58 0.00 0.00 0.00 175.76 175.14 1jr9 s TRP 133 N -1.11 0.83 -0.61 0.00 0.52 0.52 -1.11 118.94 117.98 1jr9 s TRP 133 Ca 0.19 -1.10 0.06 0.00 0.02 0.00 0.00 56.10 55.26 1jr9 s TRP 133 Cb -0.11 -0.19 0.23 0.00 -1.15 0.00 0.00 33.47 32.25 1jr9 s TRP 133 CO 0.11 -0.86 0.64 -0.11 0.02 0.00 0.00 176.95 176.75 1jr9 n LEU 134 N -0.36 2.93 -4.24 2.99 7.94 -0.47 -2.29 117.00 123.50 1jr9 n LEU 134 Ca 0.01 -5.24 -0.27 0.00 -1.11 0.00 0.00 56.01 49.39 1jr9 n LEU 134 Cb 0.64 -0.46 0.23 0.00 0.53 0.00 0.00 43.42 44.36 1jr9 n LEU 134 CO 0.28 1.99 0.14 1.33 -1.11 0.00 0.00 177.39 180.01 1jr9 n VAL 135 N 1.26 0.00 -3.13 1.96 0.24 -0.78 -3.88 118.33 113.99 1jr9 n VAL 135 Ca 0.27 -0.19 -0.18 0.00 -2.04 0.00 0.00 64.34 62.20 1jr9 n VAL 135 Cb 0.42 -0.80 -0.05 0.00 -1.47 0.00 0.00 33.84 31.93 1jr9 n VAL 135 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1jr9 n VAL 136 N -5.07 -0.70 -2.71 3.34 0.31 -0.99 -2.89 118.33 109.62 1jr9 n VAL 136 Ca 0.07 -2.60 -0.42 0.00 -0.01 0.00 0.00 64.34 61.37 1jr9 n VAL 136 Cb 0.53 -0.65 -0.03 0.00 -0.91 0.00 0.00 33.84 32.78 1jr9 n VAL 136 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1jr9 s ASN 137 N 0.05 6.23 1.01 4.52 3.04 0.44 -4.21 114.94 126.02 1jr9 s ASN 137 Ca 0.32 -0.89 0.00 0.00 0.04 0.00 0.00 52.86 52.34 1jr9 s ASN 137 Cb 0.06 -2.49 0.00 0.00 -1.54 0.00 0.00 41.25 37.28 1jr9 s ASN 137 CO -0.15 -1.59 0.00 0.59 -3.04 0.00 0.00 177.10 172.92 1jr9 n ASN 138 N 8.42 0.00 -0.33 -4.21 4.13 -1.26 -2.66 115.26 119.34 1jr9 n ASN 138 Ca 0.04 0.00 0.14 0.00 1.68 0.00 0.00 54.58 56.44 1jr9 n ASN 138 Cb 0.48 0.00 0.62 0.00 -1.54 0.00 0.00 39.78 39.33 1jr9 n ASN 138 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1jr9 n GLY 139 N 0.00 -0.29 3.76 7.41 0.00 -1.26 -4.83 105.19 109.98 1jr9 n GLY 139 Ca 0.00 -0.36 -0.22 0.00 0.00 0.00 0.00 46.02 45.44 1jr9 n GLY 139 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1jr9 s GLU 140 N -1.97 2.50 -0.04 1.61 -1.05 -1.09 -5.14 118.70 113.53 1jr9 s GLU 140 Ca 0.39 -1.41 -0.01 0.00 -0.15 0.00 0.00 54.97 53.79 1jr9 s GLU 140 Cb 0.20 -2.29 0.03 0.00 -0.44 0.00 0.00 34.13 31.64 1jr9 s GLU 140 CO 0.33 0.18 0.07 0.96 0.95 0.00 0.00 175.26 177.74 1jr9 s ILE 141 N -2.35 -0.07 0.23 1.83 -4.36 -1.26 -0.42 121.20 114.80 1jr9 s ILE 141 Ca 0.37 0.25 0.00 0.00 -0.26 0.00 0.00 60.65 61.01 1jr9 s ILE 141 Cb -0.04 -0.14 -0.00 0.00 1.25 0.00 0.00 42.46 43.53 1jr9 s ILE 141 CO 0.23 0.10 0.01 -1.84 0.24 0.00 0.00 174.94 173.68 1jr9 n GLU 142 N 4.40 1.35 -4.80 0.37 0.28 -1.14 -4.95 120.64 116.15 1jr9 n GLU 142 Ca -0.23 -1.73 -0.30 0.00 -0.16 0.00 0.00 57.16 54.74 1jr9 n GLU 142 Cb 0.50 0.51 -0.17 0.00 1.43 0.00 0.00 31.44 33.72 1jr9 n GLU 142 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1jr9 s ILE 143 N -1.91 1.75 0.24 3.84 1.01 -1.26 -1.87 121.20 123.00 1jr9 s ILE 143 Ca 0.01 -0.82 0.04 0.00 0.00 0.00 0.00 60.65 59.88 1jr9 s ILE 143 Cb 0.00 -1.55 -0.01 0.00 0.01 0.00 0.00 42.46 40.91 1jr9 s ILE 143 CO 0.01 0.49 0.24 1.15 0.00 0.00 0.00 174.94 176.83 1jr9 n MET 144 N 3.86 0.34 -3.67 2.79 0.00 -0.97 -5.00 117.12 114.48 1jr9 n MET 144 Ca -0.20 -2.27 -0.11 0.00 0.00 0.00 0.00 57.70 55.12 1jr9 n MET 144 Cb 0.52 1.94 -0.11 0.00 0.00 0.00 0.00 33.22 35.56 1jr9 n MET 144 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1jr9 s SER 145 N -2.62 0.03 -0.10 3.17 1.04 -1.26 -0.35 113.70 113.60 1jr9 s SER 145 Ca 0.26 0.78 -0.14 0.00 0.48 0.00 0.00 55.95 57.33 1jr9 s SER 145 Cb 0.01 0.97 -0.05 0.00 0.10 0.00 0.00 66.02 67.05 1jr9 s SER 145 CO 0.19 -0.23 0.34 0.42 0.98 0.00 0.00 173.24 174.94 1jr9 s THR 146 N 2.40 5.22 0.83 2.02 -4.23 0.32 -4.91 115.64 117.29 1jr9 s THR 146 Ca -0.01 0.67 -0.11 0.00 -1.18 0.00 0.00 61.69 61.06 1jr9 s THR 146 Cb -0.12 -3.66 0.09 0.00 1.34 0.00 0.00 72.50 70.15 1jr9 s THR 146 CO -0.11 0.47 1.09 -2.16 -0.54 0.00 0.00 174.62 173.38 1jr9 s PRO 147 N -0.19 1.79 0.20 3.99 0.04 -1.26 0.34 135.00 139.91 1jr9 s PRO 147 Ca 0.20 0.78 0.00 0.00 0.04 0.00 0.00 61.00 62.02 1jr9 s PRO 147 Cb -0.14 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1jr9 s PRO 147 CO 0.08 -1.86 0.00 -0.89 0.04 0.00 0.00 177.00 174.37 1jr9 n ILE 148 N -3.62 0.00 0.83 0.56 2.08 -1.05 -1.66 119.36 116.50 1jr9 n ILE 148 Ca 0.07 0.00 0.09 0.00 0.56 0.00 0.00 62.75 63.47 1jr9 n ILE 148 Cb 0.55 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.45 1jr9 n ILE 148 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1jr9 n GLN 149 N 14.00 1.52 -1.40 0.38 1.13 -1.26 -3.30 117.38 128.45 1jr9 n GLN 149 Ca 0.00 -0.96 -0.42 0.00 -1.94 0.00 0.00 57.00 53.67 1jr9 n GLN 149 Cb 0.00 -1.36 -0.00 0.00 0.11 0.00 0.00 30.24 28.99 1jr9 n GLN 149 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1jr9 n ASP 150 N 0.03 -1.59 -4.32 1.08 8.00 -0.67 -3.97 116.55 115.11 1jr9 n ASP 150 Ca 0.08 0.90 -0.31 0.00 0.71 0.00 0.00 54.79 56.16 1jr9 n ASP 150 Cb 0.40 -1.02 -0.16 0.00 -0.02 0.00 0.00 41.12 40.33 1jr9 n ASP 150 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1jr9 s ASN 151 N -0.97 3.23 0.61 -2.24 3.84 -1.26 -4.72 114.94 113.44 1jr9 s ASN 151 Ca 0.62 -0.44 0.30 0.00 0.21 0.00 0.00 52.86 53.55 1jr9 s ASN 151 Cb -0.65 -0.61 1.61 0.00 -0.55 0.00 0.00 41.25 41.05 1jr9 s ASN 151 CO 0.60 0.30 1.90 1.55 -2.79 0.00 0.00 177.10 178.65 1jr9 h PRO 152 N 5.68 0.00 0.00 0.43 0.13 -1.93 0.43 132.00 136.74 1jr9 h PRO 152 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1jr9 h PRO 152 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1jr9 h PRO 152 CO 0.48 0.00 0.00 1.25 -0.23 0.00 0.00 178.00 179.50 1jr9 h LEU 153 N 0.00 0.00 -0.24 1.56 7.12 -1.89 -1.35 115.31 120.51 1jr9 h LEU 153 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1jr9 h LEU 153 Cb 0.55 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.68 1jr9 h LEU 153 CO 0.00 0.00 0.00 0.23 -0.13 0.00 0.00 178.44 178.54 1jr9 n MET 154 N -2.33 1.16 0.00 1.25 2.81 0.14 -2.87 117.12 117.28 1jr9 n MET 154 Ca 0.01 -0.24 0.00 0.00 -1.81 0.00 0.00 57.70 55.66 1jr9 n MET 154 Cb 0.18 -1.32 0.00 0.00 -0.71 0.00 0.00 33.22 31.37 1jr9 n MET 154 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1jr9 n GLU 155 N -0.56 1.00 -0.64 0.03 1.02 -0.56 -4.99 120.64 115.95 1jr9 n GLU 155 Ca 0.15 -0.81 0.00 0.00 -0.02 0.00 0.00 57.16 56.47 1jr9 n GLU 155 Cb 0.12 -0.75 0.00 0.00 -0.02 0.00 0.00 31.44 30.79 1jr9 n GLU 155 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1jr9 n GLY 156 N -0.19 0.65 3.36 0.62 0.00 -1.14 -5.05 105.19 103.44 1jr9 n GLY 156 Ca 0.00 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 1jr9 n GLY 156 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jr9 s LYS 157 N -0.73 3.45 -0.27 1.61 1.02 -0.90 -4.92 119.74 119.00 1jr9 s LYS 157 Ca 0.00 -0.60 -0.27 0.00 0.02 0.00 0.00 55.97 55.12 1jr9 s LYS 157 Cb 0.00 -2.99 0.01 0.00 -0.52 0.00 0.00 37.83 34.33 1jr9 s LYS 157 CO 0.00 -0.09 0.93 0.15 -0.92 0.00 0.00 175.35 175.43 1jr9 s LYS 158 N 1.20 4.13 0.62 1.68 1.02 -1.26 -2.59 119.74 124.54 1jr9 s LYS 158 Ca 0.03 1.01 -0.14 0.00 0.02 0.00 0.00 55.97 56.88 1jr9 s LYS 158 Cb -0.14 -3.68 -0.03 0.00 -0.52 0.00 0.00 37.83 33.46 1jr9 s LYS 158 CO -0.01 -0.67 1.05 -1.25 -0.92 0.00 0.00 175.35 173.55 1jr9 s PRO 159 N 3.15 3.27 0.00 -1.68 0.04 -1.26 -2.33 135.00 136.18 1jr9 s PRO 159 Ca 0.39 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.54 1jr9 s PRO 159 Cb -0.14 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1jr9 s PRO 159 CO 0.10 -0.84 0.00 0.44 0.04 0.00 0.00 177.00 176.74 1jr9 n ILE 160 N -2.31 0.00 -3.63 0.56 -5.35 -1.25 -4.94 119.36 102.44 1jr9 n ILE 160 Ca 0.08 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 62.44 1jr9 n ILE 160 Cb 0.53 0.64 -0.07 0.00 -1.74 0.00 0.00 39.64 39.00 1jr9 n ILE 160 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 1jr9 s LEU 161 N 0.00 -0.77 0.06 7.28 2.96 -1.26 -4.47 118.68 122.48 1jr9 s LEU 161 Ca 0.00 1.42 -0.21 0.00 -0.22 0.00 0.00 54.13 55.12 1jr9 s LEU 161 Cb 0.00 2.41 0.05 0.00 0.50 0.00 0.00 46.19 49.15 1jr9 s LEU 161 CO 0.00 -0.24 0.49 -0.83 -1.32 0.00 0.00 176.35 174.45 1jr9 s GLY 162 N 0.67 -0.39 -0.11 7.98 0.00 -1.26 -1.36 107.32 112.85 1jr9 s GLY 162 Ca -0.02 0.48 -0.01 0.00 0.00 0.00 0.00 44.72 45.17 1jr9 s GLY 162 CO -0.04 0.19 -0.03 -2.27 0.00 0.00 0.00 173.10 170.95 1jr9 s LEU 163 N -2.08 0.97 0.22 0.66 2.96 -0.27 -4.89 118.68 116.25 1jr9 s LEU 163 Ca -0.04 -0.30 -0.32 0.00 -0.22 0.00 0.00 54.13 53.25 1jr9 s LEU 163 Cb -0.00 -0.64 -0.12 0.00 0.50 0.00 0.00 46.19 45.92 1jr9 s LEU 163 CO -0.03 -0.18 1.71 -0.67 -1.32 0.00 0.00 176.35 175.86 1jr9 n ASP 164 N 5.04 4.00 0.00 3.68 -0.08 -1.26 -2.86 116.55 125.07 1jr9 n ASP 164 Ca -0.10 1.07 0.00 0.00 -1.51 0.00 0.00 54.79 54.26 1jr9 n ASP 164 Cb 0.49 -1.58 0.00 0.00 2.34 0.00 0.00 41.12 42.37 1jr9 n ASP 164 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1jr9 n VAL 165 N 3.73 0.33 -1.87 5.18 0.31 -0.90 -4.92 118.33 120.19 1jr9 n VAL 165 Ca 0.15 -0.64 -0.39 0.00 -0.01 0.00 0.00 64.34 63.45 1jr9 n VAL 165 Cb 0.35 0.87 0.02 0.00 -0.91 0.00 0.00 33.84 34.17 1jr9 n VAL 165 CO 0.00 0.00 0.00 0.26 -1.32 0.00 0.00 176.83 175.77 1jr9 s TRP 166 N -0.33 2.51 -0.70 3.52 0.52 -1.23 -4.71 118.94 118.52 1jr9 s TRP 166 Ca 0.00 1.33 0.09 0.00 0.02 0.00 0.00 56.10 57.55 1jr9 s TRP 166 Cb 0.00 -3.81 0.49 0.00 -1.15 0.00 0.00 33.47 29.00 1jr9 s TRP 166 CO 0.00 -2.68 1.29 0.39 0.02 0.00 0.00 176.95 175.97 1jr9 n GLU 167 N -0.35 0.06 0.00 4.98 1.02 -1.26 -1.06 120.64 124.02 1jr9 n GLU 167 Ca 0.06 0.53 0.14 0.00 -0.02 0.00 0.00 57.16 57.87 1jr9 n GLU 167 Cb 0.43 -1.67 0.63 0.00 -0.02 0.00 0.00 31.44 30.81 1jr9 n GLU 167 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 1jr9 n HIS 168 N -1.79 0.00 1.16 -0.32 1.44 -1.26 -0.37 115.22 114.07 1jr9 n HIS 168 Ca -0.00 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.83 1jr9 n HIS 168 Cb 0.03 -0.36 0.33 0.00 0.12 0.00 0.00 29.99 30.12 1jr9 n HIS 168 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1jr9 n ALA 169 N -1.35 2.51 -0.48 1.59 0.00 -0.23 -4.60 120.51 117.96 1jr9 n ALA 169 Ca 0.10 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.94 1jr9 n ALA 169 Cb 0.30 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1jr9 n ALA 169 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1jr9 n TYR 170 N 0.71 0.00 0.18 0.00 0.18 -1.17 -4.95 117.16 112.10 1jr9 n TYR 170 Ca 0.17 0.00 0.18 0.00 1.88 0.00 0.00 57.90 60.14 1jr9 n TYR 170 Cb 0.45 0.00 0.79 0.00 -0.38 0.00 0.00 39.34 40.20 1jr9 n TYR 170 CO 0.00 0.00 0.00 -0.92 -2.08 0.00 0.00 176.86 173.86 1jr9 h TYR 171 N 0.00 0.00 0.06 -3.48 3.20 -0.91 0.15 116.97 115.99 1jr9 h TYR 171 Ca 0.00 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1jr9 h TYR 171 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 1jr9 h TYR 171 CO 0.00 0.00 -0.03 -0.07 -1.64 0.00 0.00 178.16 176.42 1jr9 h LEU 172 N 0.00 -0.07 0.13 2.82 3.38 -1.89 -2.18 115.31 117.49 1jr9 h LEU 172 Ca 0.12 -0.41 -0.33 0.00 0.09 0.00 0.00 57.88 57.35 1jr9 h LEU 172 Cb 0.85 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1jr9 h LEU 172 CO -0.00 0.39 -1.70 0.50 0.09 0.00 0.00 178.44 177.72 1jr9 h LYS 173 N -0.54 0.27 -0.01 1.13 3.64 -1.77 -3.40 116.57 115.89 1jr9 h LYS 173 Ca -0.01 -0.46 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1jr9 h LYS 173 Cb 0.47 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 1jr9 h LYS 173 CO 0.01 1.13 -0.14 0.66 -2.27 0.00 0.00 179.45 178.84 1jr9 n TYR 174 N -3.46 0.00 0.00 1.91 4.02 0.44 -5.07 117.16 115.00 1jr9 n TYR 174 Ca -0.22 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.67 1jr9 n TYR 174 Cb 1.05 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.37 1jr9 n TYR 174 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1jr9 n GLN 175 N -0.13 0.00 0.05 -0.72 3.00 -0.82 -1.28 117.38 117.48 1jr9 n GLN 175 Ca 0.04 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.16 1jr9 n GLN 175 Cb 0.19 0.00 0.42 0.00 0.00 0.00 0.00 30.24 30.85 1jr9 n GLN 175 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1jr9 n ASN 176 N 4.75 0.47 -4.00 1.08 0.23 -1.26 -4.36 115.26 112.16 1jr9 n ASN 176 Ca 0.00 0.36 -0.42 0.00 -0.53 0.00 0.00 54.58 53.99 1jr9 n ASN 176 Cb 0.00 -0.39 -0.01 0.00 -2.08 0.00 0.00 39.78 37.30 1jr9 n ASN 176 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1jr9 n LYS 177 N -1.87 2.72 -0.22 -3.83 5.02 -0.40 -4.74 118.16 114.84 1jr9 n LYS 177 Ca 0.06 -2.70 -0.07 0.00 -2.02 0.00 0.00 58.31 53.58 1jr9 n LYS 177 Cb 0.39 -3.33 0.04 0.00 -0.02 0.00 0.00 35.03 32.10 1jr9 n LYS 177 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 1jr9 h ARG 178 N 6.86 0.92 -0.87 1.97 2.43 -1.83 -2.74 114.38 121.13 1jr9 h ARG 178 Ca 0.50 -0.15 0.13 0.00 -0.81 0.00 0.00 59.98 59.65 1jr9 h ARG 178 Cb 0.72 -0.16 -0.09 0.00 -0.42 0.00 0.00 29.97 30.03 1jr9 h ARG 178 CO 1.74 0.76 0.48 -1.35 -1.51 0.00 0.00 179.97 180.10 1jr9 h PRO 179 N 0.87 0.69 -0.13 0.20 0.11 -1.96 0.16 132.00 131.94 1jr9 h PRO 179 Ca 0.21 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 66.30 1jr9 h PRO 179 Cb 0.17 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.10 1jr9 h PRO 179 CO -0.02 0.46 0.01 -0.44 -0.21 0.00 0.00 178.00 177.80 1jr9 h ASP 180 N 0.72 -0.03 -0.72 -2.05 5.19 -1.89 0.23 116.42 117.87 1jr9 h ASP 180 Ca 0.46 0.02 0.09 0.00 -0.62 0.00 0.00 57.03 56.98 1jr9 h ASP 180 Cb 0.59 0.04 -0.07 0.00 0.18 0.00 0.00 39.33 40.07 1jr9 h ASP 180 CO -0.33 0.01 0.37 0.22 -3.12 0.00 0.00 179.24 176.39 1jr9 h TYR 181 N 0.06 0.67 -0.20 4.55 3.20 -0.93 -0.49 116.97 123.83 1jr9 h TYR 181 Ca 0.06 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 1jr9 h TYR 181 Cb 0.06 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 1jr9 h TYR 181 CO -0.13 0.26 0.09 0.82 -1.64 0.00 0.00 178.16 177.56 1jr9 h ILE 182 N 0.64 1.15 0.09 1.81 2.04 0.12 -1.36 117.51 122.01 1jr9 h ILE 182 Ca 0.35 -0.43 0.02 0.00 1.00 0.00 0.00 64.86 65.79 1jr9 h ILE 182 Cb 0.34 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 1jr9 h ILE 182 CO -0.25 0.14 -0.23 0.28 0.00 0.00 0.00 178.15 178.10 1jr9 h SER 183 N 0.18 -0.64 -0.89 1.72 0.02 -0.00 -2.35 113.55 111.59 1jr9 h SER 183 Ca 0.07 0.08 0.18 0.00 -0.84 0.00 0.00 61.79 61.28 1jr9 h SER 183 Cb 0.14 0.25 -0.11 0.00 0.14 0.00 0.00 62.40 62.83 1jr9 h SER 183 CO -0.01 -0.31 0.45 0.00 -1.14 0.00 0.00 176.83 175.83 1jr9 h ALA 184 N 0.38 1.40 -0.85 3.77 0.00 -0.97 -2.58 119.26 120.42 1jr9 h ALA 184 Ca 0.03 0.11 0.14 0.00 0.00 0.00 0.00 54.91 55.19 1jr9 h ALA 184 Cb 0.44 0.03 -0.15 0.00 0.00 0.00 0.00 17.79 18.12 1jr9 h ALA 184 CO -0.14 -0.17 -0.35 0.35 0.00 0.00 0.00 179.25 178.93 1jr9 h PHE 185 N 0.57 -0.98 -1.19 0.00 3.57 -0.67 -1.45 116.94 116.78 1jr9 h PHE 185 Ca 0.52 0.09 0.43 0.00 3.53 0.00 0.00 57.97 62.54 1jr9 h PHE 185 Cb 0.84 0.55 -0.15 0.00 2.79 0.00 0.00 35.95 39.98 1jr9 h PHE 185 CO -0.09 -0.39 0.72 -1.49 -2.23 0.00 0.00 178.31 174.83 1jr9 h TRP 186 N -0.06 0.67 -0.97 0.41 -0.00 -1.54 -0.68 115.95 113.79 1jr9 h TRP 186 Ca 0.31 0.03 0.01 0.00 -0.00 0.00 0.00 58.89 59.24 1jr9 h TRP 186 Cb 0.59 -0.16 -0.05 0.00 -0.00 0.00 0.00 29.16 29.54 1jr9 h TRP 186 CO -0.78 -0.32 0.63 -0.91 -0.00 0.00 0.00 178.44 177.06 1jr9 h ASN 187 N 0.06 1.13 0.94 -3.49 2.35 -1.45 -3.16 115.58 111.96 1jr9 h ASN 187 Ca 0.84 -0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 56.47 1jr9 h ASN 187 Cb 2.44 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 40.51 1jr9 h ASN 187 CO -0.58 0.83 -1.11 -0.37 -1.65 0.00 0.00 177.43 174.55 1jr9 h VAL 188 N 1.32 0.25 -1.73 2.81 -1.51 -1.28 -2.92 116.25 113.20 1jr9 h VAL 188 Ca 0.35 -1.48 -0.68 0.00 -1.23 0.00 0.00 66.70 63.66 1jr9 h VAL 188 Cb -0.13 1.79 0.04 0.00 -2.13 0.00 0.00 31.29 30.86 1jr9 h VAL 188 CO -0.07 0.14 0.68 0.52 -1.23 0.00 0.00 177.57 177.61 1jr9 n VAL 189 N -2.81 0.14 -3.07 7.19 0.31 -1.10 -0.85 118.33 118.13 1jr9 n VAL 189 Ca -0.04 -0.03 -0.44 0.00 -0.01 0.00 0.00 64.34 63.83 1jr9 n VAL 189 Cb 0.68 -1.10 -0.05 0.00 -0.91 0.00 0.00 33.84 32.46 1jr9 n VAL 189 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1jr9 s ASN 190 N 1.77 6.21 0.53 4.52 3.84 -1.23 -0.10 114.94 130.47 1jr9 s ASN 190 Ca 0.89 -1.11 0.32 0.00 0.21 0.00 0.00 52.86 53.17 1jr9 s ASN 190 Cb -0.94 -2.33 1.17 0.00 -0.55 0.00 0.00 41.25 38.60 1jr9 s ASN 190 CO 0.52 -1.10 1.91 -0.50 -2.79 0.00 0.00 177.10 175.15 1jr9 h TRP 191 N 9.19 0.00 -0.14 0.43 4.06 -1.91 -2.86 115.95 124.72 1jr9 h TRP 191 Ca -0.28 0.00 0.01 0.00 2.06 0.00 0.00 58.89 60.68 1jr9 h TRP 191 Cb 1.09 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.23 1jr9 h TRP 191 CO 0.83 0.00 0.05 -0.44 -3.56 0.00 0.00 178.44 175.32 1jr9 h ASP 192 N 0.00 0.05 -0.14 -3.49 5.19 -1.93 -1.00 116.42 115.10 1jr9 h ASP 192 Ca -0.00 0.01 0.02 0.00 -0.62 0.00 0.00 57.03 56.44 1jr9 h ASP 192 Cb 0.61 0.01 -0.02 0.00 0.18 0.00 0.00 39.33 40.11 1jr9 h ASP 192 CO 0.00 0.05 0.03 -0.08 -3.12 0.00 0.00 179.24 176.12 1jr9 h GLU 193 N 0.11 0.08 -0.82 3.56 4.57 -1.84 -1.97 114.58 118.27 1jr9 h GLU 193 Ca 0.06 -0.00 0.18 0.00 -1.18 0.00 0.00 59.36 58.42 1jr9 h GLU 193 Cb 0.04 -0.02 -0.11 0.00 -0.16 0.00 0.00 28.75 28.50 1jr9 h GLU 193 CO -0.07 0.05 0.32 0.28 -1.18 0.00 0.00 179.01 178.42 1jr9 h VAL 194 N 0.08 0.55 0.52 0.32 2.07 -1.42 0.24 116.25 118.62 1jr9 h VAL 194 Ca 0.06 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1jr9 h VAL 194 Cb 0.06 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 29.92 1jr9 h VAL 194 CO -0.09 0.07 -0.47 0.00 0.02 0.00 0.00 177.57 177.10 1jr9 h ALA 195 N 1.64 -1.15 -0.59 1.67 0.00 -0.46 -0.56 119.26 119.79 1jr9 h ALA 195 Ca 0.48 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 55.29 1jr9 h ALA 195 Cb 0.84 0.68 -0.07 0.00 0.00 0.00 0.00 17.79 19.24 1jr9 h ALA 195 CO -0.48 -1.17 0.23 0.00 0.00 0.00 0.00 179.25 177.83 1jr9 h ALA 196 N -1.01 0.76 0.00 0.00 0.00 -0.77 0.20 119.26 118.43 1jr9 h ALA 196 Ca -0.07 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1jr9 h ALA 196 Cb 0.84 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1jr9 h ALA 196 CO -0.03 -0.17 0.00 1.96 0.00 0.00 0.00 179.25 181.01 1jr9 h GLN 197 N 0.42 0.00 0.00 0.00 4.20 -0.29 -2.46 115.11 116.98 1jr9 h GLN 197 Ca 0.29 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.94 1jr9 h GLN 197 Cb 0.34 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 1jr9 h GLN 197 CO -0.28 0.00 -0.44 -0.92 -0.67 0.00 0.00 178.83 176.52 1jr9 h TYR 198 N 0.00 0.00 -0.62 2.96 3.20 0.10 -3.24 116.97 119.37 1jr9 h TYR 198 Ca 0.00 0.00 0.09 0.00 3.14 0.00 0.00 58.73 61.96 1jr9 h TYR 198 Cb 0.14 0.00 -0.07 0.00 1.54 0.00 0.00 36.73 38.34 1jr9 h TYR 198 CO 0.00 0.74 0.26 0.77 -1.64 0.00 0.00 178.16 178.28 1jr9 h SER 199 N -1.00 0.28 0.30 -2.11 0.02 -1.10 -2.50 113.55 107.44 1jr9 h SER 199 Ca -0.10 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1jr9 h SER 199 Cb 0.78 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.34 1jr9 h SER 199 CO -0.06 0.17 -0.21 1.56 -1.14 0.00 0.00 176.83 177.15 1jr9 h GLN 200 N 0.45 -0.49 0.00 3.45 4.20 -1.63 -3.23 115.11 117.86 1jr9 h GLN 200 Ca 0.31 0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.05 1jr9 h GLN 200 Cb 0.36 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1jr9 h GLN 200 CO -0.29 -0.33 0.00 0.00 -0.67 0.00 0.00 178.83 177.55 1jr9 n ALA 201 N -2.42 -0.21 0.03 3.87 0.00 -1.04 -5.13 120.51 115.60 1jr9 n ALA 201 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1jr9 n ALA 201 Cb 0.25 0.29 0.01 0.00 0.00 0.00 0.00 19.45 20.00 1jr9 n ALA 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50