#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nr9 n LEU 5 N 0.00 0.00 0.00 5.98 0.00 -1.26 -4.62 117.00 117.10 2nr9 n LEU 5 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 2nr9 n LEU 5 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.42 2nr9 n LEU 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.39 177.39 2nr9 n ALA 6 N -3.00 0.00 0.16 1.96 0.00 -1.26 -3.58 120.51 114.80 2nr9 n ALA 6 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2nr9 n ALA 6 Cb 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 18.66 2nr9 n ALA 6 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2nr9 n GLN 7 N -1.02 0.00 -0.62 0.00 7.27 -1.26 -5.15 117.38 116.60 2nr9 n GLN 7 Ca 0.00 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 56.78 2nr9 n GLN 7 Cb 0.04 0.00 0.23 0.00 2.41 0.00 0.00 30.24 32.92 2nr9 n GLN 7 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 2nr9 s GLN 8 N -2.00 -0.47 0.39 3.69 1.11 -1.23 -4.97 119.66 116.18 2nr9 s GLN 8 Ca 0.00 0.96 -0.25 0.00 0.01 0.00 0.00 55.36 56.08 2nr9 s GLN 8 Cb 0.00 -1.60 -0.09 0.00 -1.01 0.00 0.00 33.01 30.31 2nr9 s GLN 8 CO 0.00 -3.46 1.08 0.20 0.01 0.00 0.00 175.29 173.12 2nr9 s GLY 9 N -2.61 2.78 0.15 3.09 0.00 -1.26 -4.88 107.32 104.59 2nr9 s GLY 9 Ca 0.68 0.77 -0.11 0.00 0.00 0.00 0.00 44.72 46.05 2nr9 s GLY 9 CO 0.63 1.22 1.54 0.50 0.00 0.00 0.00 173.10 176.99 2nr9 h LYS 10 N 2.60 0.95 -0.22 2.90 1.57 -1.98 -1.83 116.57 120.56 2nr9 h LYS 10 Ca -0.48 -0.40 -0.05 0.00 -1.87 0.00 0.00 60.65 57.84 2nr9 h LYS 10 Cb 1.22 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 2nr9 h LYS 10 CO 0.63 1.07 -0.08 0.82 -0.57 0.00 0.00 179.45 181.32 2nr9 h ILE 11 N 0.80 1.29 -0.17 1.86 1.08 -1.93 -0.11 117.51 120.33 2nr9 h ILE 11 Ca 0.11 -1.10 0.05 0.00 -0.39 0.00 0.00 64.86 63.53 2nr9 h ILE 11 Cb 0.77 1.56 -0.06 0.00 -3.07 0.00 0.00 36.82 36.02 2nr9 h ILE 11 CO 0.06 0.34 -0.22 0.74 -0.69 0.00 0.00 178.15 178.38 2nr9 h THR 12 N 0.16 0.45 -0.35 -0.27 2.02 -1.90 -0.38 112.91 112.64 2nr9 h THR 12 Ca 0.05 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.26 2nr9 h THR 12 Cb 0.55 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 2nr9 h THR 12 CO 0.03 0.00 0.17 0.25 0.37 0.00 0.00 175.52 176.34 2nr9 h LEU 13 N -0.26 0.25 -0.71 2.58 5.85 -1.26 -0.57 115.31 121.21 2nr9 h LEU 13 Ca 0.11 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.87 2nr9 h LEU 13 Cb 0.42 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 2nr9 h LEU 13 CO -0.32 0.19 0.46 0.40 -0.34 0.00 0.00 178.44 178.83 2nr9 h ILE 14 N 0.36 1.14 -0.36 4.05 2.04 -0.58 -0.66 117.51 123.49 2nr9 h ILE 14 Ca 0.15 -0.31 -0.16 0.00 1.00 0.00 0.00 64.86 65.54 2nr9 h ILE 14 Cb 0.06 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.28 2nr9 h ILE 14 CO -0.11 0.17 -0.39 -0.07 0.00 0.00 0.00 178.15 177.75 2nr9 h LEU 15 N 0.91 0.95 -0.04 1.44 3.38 -0.80 -1.30 115.31 119.85 2nr9 h LEU 15 Ca 0.27 -0.43 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 2nr9 h LEU 15 Cb -0.05 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.43 2nr9 h LEU 15 CO -0.08 1.22 0.01 0.74 0.09 0.00 0.00 178.44 180.42 2nr9 h THR 16 N 0.72 1.18 -0.32 0.22 2.02 -0.93 -2.19 112.91 113.62 2nr9 h THR 16 Ca 0.06 -0.54 -0.03 0.00 0.77 0.00 0.00 66.41 66.66 2nr9 h THR 16 Cb 0.98 1.47 -0.02 0.00 -1.74 0.00 0.00 68.15 68.84 2nr9 h THR 16 CO 0.09 0.15 0.06 0.00 0.37 0.00 0.00 175.52 176.19 2nr9 h ALA 17 N 0.80 1.51 -0.38 6.16 0.00 -1.11 -1.56 119.26 124.67 2nr9 h ALA 17 Ca 0.01 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 2nr9 h ALA 17 Cb 0.23 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2nr9 h ALA 17 CO -0.00 0.36 0.02 -0.07 0.00 0.00 0.00 179.25 179.56 2nr9 h LEU 18 N 0.46 0.64 -0.35 0.00 3.38 -1.12 -0.93 115.31 117.39 2nr9 h LEU 18 Ca 0.11 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2nr9 h LEU 18 Cb 0.21 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2nr9 h LEU 18 CO -0.00 0.78 0.23 0.00 0.09 0.00 0.00 178.44 179.54 2nr9 h VAL 20 N 0.47 1.19 -0.59 0.00 2.07 -1.21 -0.95 116.25 117.23 2nr9 h VAL 20 Ca 0.13 -0.42 -0.10 0.00 0.82 0.00 0.00 66.70 67.13 2nr9 h VAL 20 Cb -0.05 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 2nr9 h VAL 20 CO -0.03 0.19 -0.02 -0.07 0.02 0.00 0.00 177.57 177.66 2nr9 h LEU 21 N 0.87 1.04 -0.51 2.57 3.38 -0.89 -0.53 115.31 121.25 2nr9 h LEU 21 Ca 0.23 -0.32 -0.15 0.00 0.09 0.00 0.00 57.88 57.74 2nr9 h LEU 21 Cb -0.03 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 2nr9 h LEU 21 CO -0.04 1.11 -0.39 0.40 0.09 0.00 0.00 178.44 179.60 2nr9 h ILE 22 N 0.95 1.28 0.14 1.22 2.04 -0.99 -1.66 117.51 120.50 2nr9 h ILE 22 Ca 0.16 -1.57 -0.01 0.00 1.00 0.00 0.00 64.86 64.45 2nr9 h ILE 22 Cb 0.58 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 38.11 2nr9 h ILE 22 CO 0.03 0.51 -0.07 0.22 0.00 0.00 0.00 178.15 178.85 2nr9 h TYR 23 N 0.65 -0.17 -0.69 1.37 3.20 -1.00 0.02 116.97 120.34 2nr9 h TYR 23 Ca 0.05 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.05 2nr9 h TYR 23 Cb 0.95 0.06 -0.09 0.00 1.54 0.00 0.00 36.73 39.18 2nr9 h TYR 23 CO 0.05 0.08 0.21 0.82 -1.64 0.00 0.00 178.16 177.69 2nr9 h ILE 24 N -0.42 0.63 -1.00 1.81 1.08 -1.10 0.32 117.51 118.83 2nr9 h ILE 24 Ca -0.02 -0.12 0.05 0.00 -0.39 0.00 0.00 64.86 64.39 2nr9 h ILE 24 Cb 0.33 0.25 -0.06 0.00 -3.07 0.00 0.00 36.82 34.27 2nr9 h ILE 24 CO 0.03 0.06 0.65 0.00 -0.69 0.00 0.00 178.15 178.21 2nr9 h ALA 25 N 1.53 1.38 -0.29 1.87 0.00 -0.91 -0.20 119.26 122.64 2nr9 h ALA 25 Ca 0.38 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.34 2nr9 h ALA 25 Cb 0.58 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2nr9 h ALA 25 CO -0.42 0.49 0.22 1.96 0.00 0.00 0.00 179.25 181.51 2nr9 h GLN 26 N 1.22 0.00 0.00 0.00 4.20 0.16 -2.79 115.11 117.90 2nr9 h GLN 26 Ca 0.42 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.13 2nr9 h GLN 26 Cb 0.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.88 2nr9 h GLN 26 CO -0.15 0.00 -0.71 1.96 -0.67 0.00 0.00 178.83 179.26 2nr9 h GLN 27 N 0.00 0.00 -1.85 1.46 1.08 -0.50 -3.24 115.11 112.05 2nr9 h GLN 27 Ca 0.14 0.00 -0.63 0.00 -1.45 0.00 0.00 58.65 56.71 2nr9 h GLN 27 Cb 0.58 0.00 -0.39 0.00 -0.05 0.00 0.00 27.48 27.62 2nr9 h GLN 27 CO -0.00 0.00 -0.36 1.28 -0.95 0.00 0.00 178.83 178.79 2nr9 n LEU 28 N -2.53 5.18 0.00 1.46 4.32 -1.05 -4.88 117.00 119.50 2nr9 n LEU 28 Ca 0.02 -5.32 0.00 0.00 -0.02 0.00 0.00 56.01 50.69 2nr9 n LEU 28 Cb 0.51 -0.61 0.00 0.00 -1.62 0.00 0.00 43.42 41.69 2nr9 n LEU 28 CO 0.38 2.20 0.00 0.61 -1.22 0.00 0.00 177.39 179.36 2nr9 n GLY 29 N -0.39 -0.49 3.64 -0.72 0.00 -1.26 -5.04 105.19 100.93 2nr9 n GLY 29 Ca 0.39 0.24 -0.00 0.00 0.00 0.00 0.00 46.02 46.65 2nr9 n GLY 29 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2nr9 s PHE 30 N 0.00 -0.36 -0.17 1.61 -0.12 -1.26 -4.95 117.98 112.73 2nr9 s PHE 30 Ca 0.00 0.72 0.29 0.00 -0.05 0.00 0.00 56.93 57.90 2nr9 s PHE 30 Cb 0.00 0.22 1.06 0.00 -0.63 0.00 0.00 43.02 43.67 2nr9 s PHE 30 CO 0.00 -0.18 1.85 0.93 -0.05 0.00 0.00 175.22 177.77 2nr9 h GLU 31 N 5.71 0.00 0.14 1.99 5.08 -1.84 -3.34 114.58 122.32 2nr9 h GLU 31 Ca -0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2nr9 h GLU 31 Cb 1.18 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 2nr9 h GLU 31 CO 0.21 0.00 -0.37 -0.44 -1.00 0.00 0.00 179.01 177.41 2nr9 h ASP 32 N 0.00 -1.11 -0.20 1.42 3.32 -1.92 0.95 116.42 118.89 2nr9 h ASP 32 Ca 0.00 0.11 0.05 0.00 0.02 0.00 0.00 57.03 57.21 2nr9 h ASP 32 Cb 0.59 0.40 -0.07 0.00 0.22 0.00 0.00 39.33 40.47 2nr9 h ASP 32 CO 0.00 -0.41 -0.42 -0.78 -1.72 0.00 0.00 179.24 175.90 2nr9 h ASP 33 N -0.57 -1.35 -0.52 6.45 1.82 -1.99 -1.18 116.42 119.07 2nr9 h ASP 33 Ca -0.01 0.18 0.07 0.00 -0.39 0.00 0.00 57.03 56.88 2nr9 h ASP 33 Cb 0.56 0.56 -0.06 0.00 0.68 0.00 0.00 39.33 41.07 2nr9 h ASP 33 CO -0.17 -0.41 0.21 0.40 -1.61 0.00 0.00 179.24 177.66 2nr9 h ILE 34 N -0.45 0.86 -0.59 2.25 2.04 -1.63 -1.72 117.51 118.26 2nr9 h ILE 34 Ca 0.09 -0.14 -0.05 0.00 1.00 0.00 0.00 64.86 65.76 2nr9 h ILE 34 Cb 0.62 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 2nr9 h ILE 34 CO -0.44 0.07 0.18 0.24 0.00 0.00 0.00 178.15 178.21 2nr9 h MET 35 N 0.41 0.88 -0.53 2.37 2.86 0.12 -1.01 114.93 120.03 2nr9 h MET 35 Ca 0.25 -0.17 -0.11 0.00 -2.06 0.00 0.00 59.70 57.61 2nr9 h MET 35 Cb 0.24 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 2nr9 h MET 35 CO -0.23 0.76 -0.11 -0.92 1.06 0.00 0.00 176.91 177.47 2nr9 h TYR 36 N 0.86 1.14 0.00 -0.22 5.03 -0.48 -2.28 116.97 121.02 2nr9 h TYR 36 Ca 0.19 -0.24 -0.11 0.00 2.58 0.00 0.00 58.73 61.15 2nr9 h TYR 36 Cb 0.25 -0.28 -0.02 0.00 1.55 0.00 0.00 36.73 38.23 2nr9 h TYR 36 CO 0.02 1.06 -0.53 1.25 -1.32 0.00 0.00 178.16 178.64 2nr9 h LEU 37 N 0.89 0.00 0.00 2.82 6.46 -1.17 -3.38 115.31 120.93 2nr9 h LEU 37 Ca 0.14 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.90 2nr9 h LEU 37 Cb 0.68 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.61 2nr9 h LEU 37 CO 0.05 0.53 -1.84 0.23 -0.62 0.00 0.00 178.44 176.79 2nr9 n MET 38 N -3.26 0.60 -1.62 1.25 2.81 -0.40 -4.80 117.12 111.70 2nr9 n MET 38 Ca 0.02 -0.17 -0.34 0.00 -1.81 0.00 0.00 57.70 55.40 2nr9 n MET 38 Cb 0.73 -1.47 0.07 0.00 -0.71 0.00 0.00 33.22 31.83 2nr9 n MET 38 CO 0.00 0.00 0.00 -3.38 1.51 0.00 0.00 175.97 174.10 2nr9 s HIS 39 N -3.35 2.38 0.59 2.03 -3.43 -0.86 -1.76 115.29 110.88 2nr9 s HIS 39 Ca -0.06 1.58 -0.20 0.00 -0.80 0.00 0.00 55.06 55.58 2nr9 s HIS 39 Cb 0.13 -3.30 -0.04 0.00 -1.43 0.00 0.00 32.58 27.94 2nr9 s HIS 39 CO 0.83 -2.07 1.17 0.98 -2.00 0.00 0.00 174.74 173.65 2nr9 n TYR 40 N -2.54 1.58 -1.65 0.38 9.36 -1.25 -4.75 117.16 118.29 2nr9 n TYR 40 Ca 0.12 0.44 -0.50 0.00 3.32 0.00 0.00 57.90 61.27 2nr9 n TYR 40 Cb 0.51 -2.25 -0.05 0.00 -0.63 0.00 0.00 39.34 36.92 2nr9 n TYR 40 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 2nr9 n PRO 41 N -1.18 1.62 -1.10 2.98 -0.02 -1.26 -4.85 135.00 131.19 2nr9 n PRO 41 Ca 0.13 0.59 0.04 0.00 -2.02 0.00 0.00 63.50 62.24 2nr9 n PRO 41 Cb 0.46 -2.31 0.12 0.00 -0.02 0.00 0.00 33.50 31.75 2nr9 n PRO 41 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2nr9 n ALA 42 N 3.81 3.15 -3.64 3.55 0.00 -1.26 -4.80 120.51 121.31 2nr9 n ALA 42 Ca 0.20 -2.91 -0.05 0.00 0.00 0.00 0.00 53.44 50.67 2nr9 n ALA 42 Cb 0.23 -0.53 -0.07 0.00 0.00 0.00 0.00 19.45 19.08 2nr9 n ALA 42 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2nr9 s TYR 43 N -1.93 -0.75 0.47 0.00 6.14 -1.26 -5.03 117.35 114.99 2nr9 s TYR 43 Ca 0.37 1.52 0.26 0.00 0.64 0.00 0.00 57.07 59.86 2nr9 s TYR 43 Cb 0.38 0.45 1.30 0.00 0.42 0.00 0.00 41.96 44.50 2nr9 s TYR 43 CO -0.11 -0.37 1.82 0.93 0.64 0.00 0.00 175.55 178.46 2nr9 h GLU 44 N 6.21 0.20 0.00 4.97 5.08 -2.02 0.59 114.58 129.61 2nr9 h GLU 44 Ca -0.29 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 2nr9 h GLU 44 Cb 1.20 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2nr9 h GLU 44 CO 0.17 0.13 0.00 0.93 -1.00 0.00 0.00 179.01 179.25 2nr9 h GLU 45 N 0.21 0.00 -0.00 2.33 5.08 -2.02 -2.96 114.58 117.22 2nr9 h GLU 45 Ca 0.53 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.89 2nr9 h GLU 45 Cb 1.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.94 2nr9 h GLU 45 CO -0.14 0.00 -0.42 1.04 -1.00 0.00 0.00 179.01 178.49 2nr9 n GLN 46 N -2.96 0.12 0.15 2.33 6.02 0.20 -3.90 117.38 119.34 2nr9 n GLN 46 Ca 0.02 -0.07 0.16 0.00 -0.01 0.00 0.00 57.00 57.11 2nr9 n GLN 46 Cb 0.37 -1.50 0.74 0.00 1.02 0.00 0.00 30.24 30.87 2nr9 n GLN 46 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 2nr9 h ASP 47 N 0.16 0.00 1.33 1.08 5.19 -1.33 0.17 116.42 123.01 2nr9 h ASP 47 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2nr9 h ASP 47 Cb 0.50 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.01 2nr9 h ASP 47 CO 0.00 0.00 -0.53 0.77 -3.12 0.00 0.00 179.24 176.36 2nr9 h SER 48 N 0.00 0.00 -0.55 6.45 4.64 -1.79 -3.40 113.55 118.90 2nr9 h SER 48 Ca 0.13 -0.04 -0.65 0.00 -0.47 0.00 0.00 61.79 60.75 2nr9 h SER 48 Cb 0.57 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.60 2nr9 h SER 48 CO -0.00 0.02 2.35 -0.62 -0.87 0.00 0.00 176.83 177.71 2nr9 n GLU 49 N -2.66 2.88 0.23 4.77 1.02 0.05 -4.82 120.64 122.09 2nr9 n GLU 49 Ca 0.02 -2.96 0.17 0.00 -0.02 0.00 0.00 57.16 54.38 2nr9 n GLU 49 Cb 0.51 -3.44 0.85 0.00 -0.02 0.00 0.00 31.44 29.34 2nr9 n GLU 49 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2nr9 h VAL 50 N 5.16 0.46 0.00 2.62 2.07 -1.80 -1.69 116.25 123.07 2nr9 h VAL 50 Ca 0.46 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.94 2nr9 h VAL 50 Cb 0.81 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 2nr9 h VAL 50 CO 1.57 0.00 -0.19 4.11 0.02 0.00 0.00 177.57 183.09 2nr9 h TRP 51 N 0.00 0.00 -0.06 1.57 0.09 -1.95 -2.91 115.95 112.70 2nr9 h TRP 51 Ca 0.07 0.00 0.02 0.00 0.09 0.00 0.00 58.89 59.07 2nr9 h TRP 51 Cb 0.41 0.00 -0.00 0.00 0.08 0.00 0.00 29.16 29.64 2nr9 h TRP 51 CO 0.00 0.19 0.05 0.00 0.09 0.00 0.00 178.44 178.77 2nr9 h ARG 52 N 0.00 0.00 0.00 0.12 3.08 -1.60 0.35 114.38 116.33 2nr9 h ARG 52 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2nr9 h ARG 52 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 2nr9 h ARG 52 CO 0.02 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 179.58 2nr9 n TYR 53 N -4.01 0.76 0.00 3.04 4.02 -1.10 -3.95 117.16 115.91 2nr9 n TYR 53 Ca -0.02 0.31 0.00 0.00 -0.01 0.00 0.00 57.90 58.18 2nr9 n TYR 53 Cb 0.15 -1.00 0.00 0.00 -0.02 0.00 0.00 39.34 38.48 2nr9 n TYR 53 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 2nr9 n ILE 54 N -2.20 0.00 0.16 -0.72 5.41 -0.21 -3.30 119.36 118.50 2nr9 n ILE 54 Ca 0.02 0.00 0.16 0.00 1.00 0.00 0.00 62.75 63.92 2nr9 n ILE 54 Cb 0.21 -0.46 0.74 0.00 -0.71 0.00 0.00 39.64 39.41 2nr9 n ILE 54 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 2nr9 h SER 55 N 0.00 0.00 0.00 4.38 4.64 -0.52 -2.32 113.55 119.73 2nr9 h SER 55 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2nr9 h SER 55 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 2nr9 h SER 55 CO 0.00 0.00 0.24 1.12 -0.87 0.00 0.00 176.83 177.32 2nr9 h HIS 56 N 0.00 0.00 0.00 4.77 2.07 -1.51 -0.78 115.15 119.71 2nr9 h HIS 56 Ca 0.11 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.63 2nr9 h HIS 56 Cb 0.49 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.47 2nr9 h HIS 56 CO 0.00 0.00 -0.04 0.25 -3.07 0.00 0.00 177.93 175.07 2nr9 n THR 57 N -2.78 0.12 1.19 6.12 -2.24 -0.87 -0.76 114.28 115.06 2nr9 n THR 57 Ca -0.02 -0.06 0.12 0.00 -2.27 0.00 0.00 64.05 61.82 2nr9 n THR 57 Cb 0.29 -0.47 0.26 0.00 -2.10 0.00 0.00 70.33 68.31 2nr9 n THR 57 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2nr9 n LEU 58 N -1.66 1.62 -4.61 3.22 4.32 -0.30 -3.05 117.00 116.55 2nr9 n LEU 58 Ca 0.07 -0.53 -0.34 0.00 -0.02 0.00 0.00 56.01 55.18 2nr9 n LEU 58 Cb 0.36 -0.05 -0.11 0.00 -1.62 0.00 0.00 43.42 42.00 2nr9 n LEU 58 CO 0.28 0.29 -0.33 -0.69 -1.22 0.00 0.00 177.39 175.72 2nr9 s VAL 59 N -2.35 4.11 0.16 4.08 1.01 -1.22 -4.61 120.40 121.57 2nr9 s VAL 59 Ca 0.26 -0.31 0.08 0.00 0.00 0.00 0.00 61.98 62.01 2nr9 s VAL 59 Cb 0.19 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 2nr9 s VAL 59 CO 0.48 0.57 -0.19 -1.00 0.00 0.00 0.00 175.10 174.96 2nr9 s HIS 60 N -0.47 1.81 -0.80 5.22 3.76 -1.26 -0.69 115.29 122.85 2nr9 s HIS 60 Ca 0.08 -0.46 0.14 0.00 -0.15 0.00 0.00 55.06 54.66 2nr9 s HIS 60 Cb -0.12 -0.92 -0.11 0.00 1.11 0.00 0.00 32.58 32.54 2nr9 s HIS 60 CO 0.02 0.31 0.63 1.28 -0.85 0.00 0.00 174.74 176.13 2nr9 n LEU 61 N 0.41 0.85 -3.77 0.89 4.77 -1.26 -5.00 117.00 113.89 2nr9 n LEU 61 Ca -0.14 -0.57 -0.08 0.00 -0.03 0.00 0.00 56.01 55.19 2nr9 n LEU 61 Cb 0.57 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.63 2nr9 n LEU 61 CO 0.28 0.19 0.43 -0.94 -1.33 0.00 0.00 177.39 176.03 2nr9 s SER 62 N -2.13 -0.32 0.27 -1.43 1.04 -1.26 -5.01 113.70 104.87 2nr9 s SER 62 Ca 0.07 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 56.01 2nr9 s SER 62 Cb 0.10 0.69 0.38 0.00 0.10 0.00 0.00 66.02 67.30 2nr9 s SER 62 CO 0.50 -1.25 1.74 0.78 0.98 0.00 0.00 173.24 175.99 2nr9 h ASN 63 N 2.02 0.60 0.15 7.02 -0.26 -1.99 -2.24 115.58 120.89 2nr9 h ASN 63 Ca -0.23 -0.18 -0.25 0.00 -0.56 0.00 0.00 56.30 55.08 2nr9 h ASN 63 Cb 1.26 -0.16 0.01 0.00 -1.06 0.00 0.00 38.32 38.37 2nr9 h ASN 63 CO 0.27 0.77 -1.02 -0.07 -1.06 0.00 0.00 177.43 176.32 2nr9 h LEU 64 N 0.56 0.75 0.02 1.61 3.38 -1.97 -1.25 115.31 118.41 2nr9 h LEU 64 Ca 0.10 -0.61 0.03 0.00 0.09 0.00 0.00 57.88 57.48 2nr9 h LEU 64 Cb 0.57 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 2nr9 h LEU 64 CO 0.04 1.41 -0.32 -0.74 0.09 0.00 0.00 178.44 178.92 2nr9 h HIS 65 N 0.32 -0.88 -0.03 1.13 2.76 -1.91 -0.12 115.15 116.41 2nr9 h HIS 65 Ca -0.11 0.03 -0.16 0.00 -2.20 0.00 0.00 60.37 57.93 2nr9 h HIS 65 Cb 1.67 0.39 -0.01 0.00 1.55 0.00 0.00 27.41 31.00 2nr9 h HIS 65 CO 0.09 -0.42 -0.69 0.97 -1.30 0.00 0.00 177.93 176.58 2nr9 h ILE 66 N -0.48 1.44 -0.22 6.26 2.10 -1.48 -2.06 117.51 123.08 2nr9 h ILE 66 Ca 0.06 -2.24 -0.02 0.00 1.08 0.00 0.00 64.86 63.73 2nr9 h ILE 66 Cb 0.56 2.19 -0.01 0.00 -1.09 0.00 0.00 36.82 38.47 2nr9 h ILE 66 CO -0.26 0.65 0.04 0.25 -1.08 0.00 0.00 178.15 177.76 2nr9 h LEU 67 N 0.10 0.34 -0.21 2.19 5.85 -0.87 -0.81 115.31 121.90 2nr9 h LEU 67 Ca -0.02 -0.25 -0.13 0.00 0.84 0.00 0.00 57.88 58.32 2nr9 h LEU 67 Cb 1.23 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.17 2nr9 h LEU 67 CO 0.10 0.50 -0.39 -0.26 -0.34 0.00 0.00 178.44 178.05 2nr9 h PHE 68 N 0.16 0.79 0.26 1.25 -1.00 -1.03 -2.51 116.94 114.86 2nr9 h PHE 68 Ca 0.07 -0.28 -0.00 0.00 2.81 0.00 0.00 57.97 60.56 2nr9 h PHE 68 Cb 0.30 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 2nr9 h PHE 68 CO 0.02 1.04 -0.19 -0.91 -1.61 0.00 0.00 178.31 176.66 2nr9 h ASN 69 N 0.31 -0.48 -0.36 2.17 -0.26 -1.33 -2.49 115.58 113.14 2nr9 h ASN 69 Ca 0.01 0.04 -0.06 0.00 -0.56 0.00 0.00 56.30 55.72 2nr9 h ASN 69 Cb 0.99 0.15 -0.02 0.00 -1.06 0.00 0.00 38.32 38.38 2nr9 h ASN 69 CO 0.09 -0.29 0.03 -0.07 -1.06 0.00 0.00 177.43 176.12 2nr9 h LEU 70 N -0.44 0.68 0.59 1.61 3.38 -1.24 -0.48 115.31 119.41 2nr9 h LEU 70 Ca -0.02 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 2nr9 h LEU 70 Cb 0.39 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 2nr9 h LEU 70 CO 0.00 0.73 -0.33 0.28 0.09 0.00 0.00 178.44 179.21 2nr9 h SER 71 N 0.68 -0.82 -0.72 -0.43 0.02 -1.36 0.13 113.55 111.06 2nr9 h SER 71 Ca 0.14 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.10 2nr9 h SER 71 Cb 0.38 0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 2nr9 h SER 71 CO 0.01 -0.54 0.34 -0.50 -1.14 0.00 0.00 176.83 175.00 2nr9 h TRP 72 N -0.86 1.04 -0.42 3.45 4.06 -1.37 -2.15 115.95 119.70 2nr9 h TRP 72 Ca -0.07 -0.05 -0.12 0.00 2.06 0.00 0.00 58.89 60.70 2nr9 h TRP 72 Cb 0.69 -0.32 -0.01 0.00 -1.00 0.00 0.00 29.16 28.51 2nr9 h TRP 72 CO -0.07 0.77 -0.23 0.35 -3.56 0.00 0.00 178.44 175.70 2nr9 h PHE 73 N 1.01 0.99 -0.26 0.49 3.57 -1.06 -1.35 116.94 120.33 2nr9 h PHE 73 Ca 0.25 -0.24 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 2nr9 h PHE 73 Cb 0.13 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 2nr9 h PHE 73 CO 0.01 1.01 0.05 0.35 -2.23 0.00 0.00 178.31 177.49 2nr9 h PHE 74 N 0.75 0.45 0.54 0.41 3.57 -0.56 0.36 116.94 122.45 2nr9 h PHE 74 Ca 0.10 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 2nr9 h PHE 74 Cb 0.78 -0.12 0.01 0.00 2.79 0.00 0.00 35.95 39.40 2nr9 h PHE 74 CO 0.04 0.52 -0.26 0.82 -2.23 0.00 0.00 178.31 177.21 2nr9 h ILE 75 N 0.24 0.35 0.05 1.41 2.04 -1.38 -2.19 117.51 118.03 2nr9 h ILE 75 Ca 0.08 -0.35 -0.27 0.00 1.00 0.00 0.00 64.86 65.32 2nr9 h ILE 75 Cb 0.31 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 2nr9 h ILE 75 CO 0.00 0.04 -1.38 -0.26 0.00 0.00 0.00 178.15 176.56 2nr9 h PHE 76 N -0.97 0.19 -0.57 1.37 -1.00 -1.30 -1.94 116.94 112.72 2nr9 h PHE 76 Ca -0.07 -0.14 -0.05 0.00 2.81 0.00 0.00 57.97 60.52 2nr9 h PHE 76 Cb 0.63 -0.01 -0.03 0.00 3.61 0.00 0.00 35.95 40.16 2nr9 h PHE 76 CO 0.00 1.16 0.16 0.78 -1.61 0.00 0.00 178.31 178.80 2nr9 h GLY 77 N 2.56 0.93 0.84 -1.45 0.00 -0.42 -2.12 103.07 103.40 2nr9 h GLY 77 Ca -0.17 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.61 2nr9 h GLY 77 CO 0.13 0.49 0.03 -1.33 0.00 0.00 0.00 176.54 175.86 2nr9 h GLY 78 N 0.98 0.39 0.21 4.60 0.00 -1.37 -1.14 103.07 106.74 2nr9 h GLY 78 Ca 0.19 -0.27 0.09 0.00 0.00 0.00 0.00 47.33 47.34 2nr9 h GLY 78 CO -0.01 0.25 -0.04 -0.33 0.00 0.00 0.00 176.54 176.41 2nr9 h MET 79 N 0.15 0.06 -0.13 4.80 2.07 -1.16 0.63 114.93 121.35 2nr9 h MET 79 Ca 0.06 -0.00 0.01 0.00 -2.07 0.00 0.00 59.70 57.70 2nr9 h MET 79 Cb 0.34 -0.01 -0.01 0.00 -1.87 0.00 0.00 31.60 30.04 2nr9 h MET 79 CO 0.01 0.04 0.04 0.82 1.07 0.00 0.00 176.91 178.89 2nr9 h ILE 80 N 0.07 0.96 -0.23 -1.22 2.04 -1.21 -0.18 117.51 117.73 2nr9 h ILE 80 Ca 0.22 -0.04 0.01 0.00 1.00 0.00 0.00 64.86 66.05 2nr9 h ILE 80 Cb 0.33 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 2nr9 h ILE 80 CO -0.40 0.02 0.13 -0.08 0.00 0.00 0.00 178.15 177.82 2nr9 h GLU 81 N 0.10 0.27 0.00 2.37 4.81 -0.71 0.36 114.58 121.79 2nr9 h GLU 81 Ca 0.06 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2nr9 h GLU 81 Cb 0.04 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.35 2nr9 h GLU 81 CO -0.06 0.18 -0.02 0.00 -0.73 0.00 0.00 179.01 178.37 2nr9 h ARG 82 N 0.27 0.00 0.00 1.92 3.08 -0.76 -1.13 114.38 117.76 2nr9 h ARG 82 Ca 0.09 0.00 -0.39 0.00 0.07 0.00 0.00 59.98 59.75 2nr9 h ARG 82 Cb -0.00 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 29.98 2nr9 h ARG 82 CO -0.04 0.02 -2.47 2.41 -1.07 0.00 0.00 179.97 178.81 2nr9 n THR 83 N -3.12 1.49 0.22 2.04 -1.04 -0.09 -4.71 114.28 109.07 2nr9 n THR 83 Ca 0.01 -0.58 0.02 0.00 -2.04 0.00 0.00 64.05 61.46 2nr9 n THR 83 Cb 0.32 -1.40 -0.01 0.00 -1.82 0.00 0.00 70.33 67.42 2nr9 n THR 83 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2nr9 n PHE 84 N -3.25 0.00 0.00 -1.42 3.01 0.12 -5.08 117.46 110.85 2nr9 n PHE 84 Ca -0.45 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.01 2nr9 n PHE 84 Cb 1.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.47 2nr9 n PHE 84 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2nr9 n GLY 85 N 0.83 2.73 0.17 1.37 0.00 -0.43 -4.58 105.19 105.28 2nr9 n GLY 85 Ca 0.02 -1.94 -0.02 0.00 0.00 0.00 0.00 46.02 44.07 2nr9 n GLY 85 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2nr9 h SER 86 N 0.00 0.15 -0.41 1.61 0.02 -1.90 -3.05 113.55 109.98 2nr9 h SER 86 Ca 0.00 -0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 60.83 2nr9 h SER 86 Cb 0.00 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 2nr9 h SER 86 CO 0.00 0.66 0.07 0.58 -1.14 0.00 0.00 176.83 177.00 2nr9 h VAL 87 N 0.11 1.24 -0.36 2.27 2.07 -1.95 -1.48 116.25 118.15 2nr9 h VAL 87 Ca -0.00 -0.87 0.05 0.00 0.82 0.00 0.00 66.70 66.70 2nr9 h VAL 87 Cb 0.98 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.73 2nr9 h VAL 87 CO 0.08 0.30 0.11 0.50 0.02 0.00 0.00 177.57 178.57 2nr9 h LYS 88 N 0.53 0.24 -0.29 1.57 1.63 -1.79 0.78 116.57 119.24 2nr9 h LYS 88 Ca 0.12 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.88 2nr9 h LYS 88 Cb 0.37 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.93 2nr9 h LYS 88 CO 0.01 0.16 0.08 1.25 -3.45 0.00 0.00 179.45 177.49 2nr9 h LEU 89 N 0.25 0.43 -0.32 5.20 5.85 -1.43 -0.62 115.31 124.67 2nr9 h LEU 89 Ca 0.17 -0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.70 2nr9 h LEU 89 Cb 0.16 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 2nr9 h LEU 89 CO -0.19 0.53 0.12 0.25 -0.34 0.00 0.00 178.44 178.82 2nr9 h LEU 90 N 0.30 0.14 0.26 2.25 6.46 -0.87 0.04 115.31 123.89 2nr9 h LEU 90 Ca 0.09 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.87 2nr9 h LEU 90 Cb 0.27 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.21 2nr9 h LEU 90 CO -0.00 0.12 -0.13 0.24 -0.62 0.00 0.00 178.44 178.04 2nr9 h MET 91 N 0.26 -0.35 -0.97 1.25 2.86 -0.73 -0.46 114.93 116.80 2nr9 h MET 91 Ca 0.14 0.02 0.13 0.00 -2.06 0.00 0.00 59.70 57.94 2nr9 h MET 91 Cb 0.11 0.08 -0.08 0.00 0.06 0.00 0.00 31.60 31.76 2nr9 h MET 91 CO -0.14 -0.23 0.61 1.25 1.06 0.00 0.00 176.91 179.46 2nr9 h LEU 92 N -0.36 0.82 0.14 1.22 5.85 -0.89 -1.12 115.31 120.97 2nr9 h LEU 92 Ca -0.03 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2nr9 h LEU 92 Cb 0.28 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.20 2nr9 h LEU 92 CO 0.05 0.42 -0.07 0.22 -0.34 0.00 0.00 178.44 178.73 2nr9 h TYR 93 N 0.87 -0.17 -0.29 1.25 3.20 -0.32 0.18 116.97 121.70 2nr9 h TYR 93 Ca 0.49 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.36 2nr9 h TYR 93 Cb 0.61 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 2nr9 h TYR 93 CO -0.00 0.09 0.17 0.28 -1.64 0.00 0.00 178.16 177.06 2nr9 h VAL 94 N -0.41 1.04 -0.11 1.81 2.07 -0.85 -0.82 116.25 118.98 2nr9 h VAL 94 Ca -0.02 -0.12 -0.07 0.00 0.82 0.00 0.00 66.70 67.31 2nr9 h VAL 94 Cb 0.33 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2nr9 h VAL 94 CO 0.03 0.06 -0.19 0.58 0.02 0.00 0.00 177.57 178.07 2nr9 h VAL 95 N 0.35 1.38 -0.46 2.57 2.07 -1.19 -1.82 116.25 119.16 2nr9 h VAL 95 Ca 0.11 -1.46 0.00 0.00 0.82 0.00 0.00 66.70 66.18 2nr9 h VAL 95 Cb -0.01 2.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 2nr9 h VAL 95 CO -0.04 0.42 0.30 0.00 0.02 0.00 0.00 177.57 178.27 2nr9 h ALA 96 N 0.53 0.59 -0.44 1.67 0.00 -0.67 0.18 119.26 121.12 2nr9 h ALA 96 Ca 0.01 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.93 2nr9 h ALA 96 Cb 0.77 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 2nr9 h ALA 96 CO 0.04 0.05 0.16 0.77 0.00 0.00 0.00 179.25 180.27 2nr9 h SER 97 N 0.63 0.16 -0.24 0.00 0.02 -1.10 0.61 113.55 113.63 2nr9 h SER 97 Ca 0.17 0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 61.10 2nr9 h SER 97 Cb -0.06 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 2nr9 h SER 97 CO -0.04 0.13 -0.12 0.00 -1.14 0.00 0.00 176.83 175.66 2nr9 h ALA 98 N 1.29 0.34 -0.17 3.77 0.00 -1.13 -2.55 119.26 120.80 2nr9 h ALA 98 Ca 0.21 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 2nr9 h ALA 98 Cb 0.20 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2nr9 h ALA 98 CO -0.21 0.20 -0.12 0.82 0.00 0.00 0.00 179.25 179.94 2nr9 h ILE 99 N 0.22 1.33 -0.65 0.00 2.04 -0.73 -1.76 117.51 117.96 2nr9 h ILE 99 Ca 0.05 -1.23 -0.06 0.00 1.00 0.00 0.00 64.86 64.62 2nr9 h ILE 99 Cb 0.63 1.76 -0.03 0.00 -0.74 0.00 0.00 36.82 38.44 2nr9 h ILE 99 CO 0.04 0.37 0.15 0.71 0.00 0.00 0.00 178.15 179.42 2nr9 h THR 100 N 0.05 1.25 -0.51 -0.27 1.35 -0.97 -1.30 112.91 112.50 2nr9 h THR 100 Ca 0.03 -0.93 -0.05 0.00 -0.55 0.00 0.00 66.41 64.91 2nr9 h THR 100 Cb 0.63 0.59 -0.02 0.00 -1.73 0.00 0.00 68.15 67.62 2nr9 h THR 100 CO 0.03 0.35 0.12 1.23 -0.25 0.00 0.00 175.52 177.00 2nr9 h GLY 101 N 1.05 0.89 0.63 5.82 0.00 -1.48 0.76 103.07 110.75 2nr9 h GLY 101 Ca 0.21 -0.57 0.04 0.00 0.00 0.00 0.00 47.33 47.01 2nr9 h GLY 101 CO 0.00 0.53 0.04 -1.82 0.00 0.00 0.00 176.54 175.29 2nr9 h TYR 102 N 0.72 0.07 -0.17 5.60 3.20 -0.94 0.00 116.97 125.44 2nr9 h TYR 102 Ca 0.16 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.00 2nr9 h TYR 102 Cb 0.35 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.63 2nr9 h TYR 102 CO 0.02 0.00 -0.08 0.28 -1.64 0.00 0.00 178.16 176.75 2nr9 h VAL 103 N 0.14 1.31 -0.83 1.81 2.07 -1.07 -2.56 116.25 117.12 2nr9 h VAL 103 Ca 0.14 -1.12 0.01 0.00 0.82 0.00 0.00 66.70 66.54 2nr9 h VAL 103 Cb 0.15 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 2nr9 h VAL 103 CO -0.19 0.34 0.54 -0.61 0.02 0.00 0.00 177.57 177.66 2nr9 h GLN 104 N 0.05 1.09 -0.85 1.57 5.75 -0.76 -2.65 115.11 119.32 2nr9 h GLN 104 Ca 0.04 -0.07 0.01 0.00 -0.15 0.00 0.00 58.65 58.48 2nr9 h GLN 104 Cb 0.56 -0.24 -0.04 0.00 1.07 0.00 0.00 27.48 28.82 2nr9 h GLN 104 CO 0.02 0.73 0.56 -0.97 -2.65 0.00 0.00 178.83 176.53 2nr9 h ASN 105 N 1.12 0.97 -0.81 -0.69 -1.24 -0.89 -0.23 115.58 113.82 2nr9 h ASN 105 Ca 0.30 -0.03 -0.04 0.00 0.71 0.00 0.00 56.30 57.24 2nr9 h ASN 105 Cb -0.12 -0.24 -0.04 0.00 0.73 0.00 0.00 38.32 38.65 2nr9 h ASN 105 CO -0.06 0.71 0.34 0.22 -1.29 0.00 0.00 177.43 177.34 2nr9 h TYR 106 N 1.15 1.22 0.01 0.67 3.20 -1.10 0.04 116.97 122.16 2nr9 h TYR 106 Ca 0.31 -0.09 -0.28 0.00 3.14 0.00 0.00 58.73 61.82 2nr9 h TYR 106 Cb -0.13 -0.37 -0.04 0.00 1.54 0.00 0.00 36.73 37.73 2nr9 h TYR 106 CO -0.01 0.92 -1.55 -0.39 -1.64 0.00 0.00 178.16 175.49 2nr9 h VAL 107 N 1.18 1.05 0.00 1.81 -1.51 -1.29 -3.42 116.25 114.07 2nr9 h VAL 107 Ca 0.27 -2.86 0.00 0.00 -1.23 0.00 0.00 66.70 62.88 2nr9 h VAL 107 Cb 0.20 2.53 0.00 0.00 -2.13 0.00 0.00 31.29 31.89 2nr9 h VAL 107 CO -0.02 0.62 0.00 -1.20 -1.23 0.00 0.00 177.57 175.74 2nr9 n SER 108 N -3.14 0.22 0.00 4.19 7.64 -0.12 -5.13 113.62 117.28 2nr9 n SER 108 Ca -0.13 -0.59 0.00 0.00 1.01 0.00 0.00 58.87 59.16 2nr9 n SER 108 Cb 1.03 0.26 0.00 0.00 -1.01 0.00 0.00 64.21 64.49 2nr9 n SER 108 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2nr9 n GLY 109 N 0.26 0.17 0.16 0.23 0.00 -0.00 -4.62 105.19 101.39 2nr9 n GLY 109 Ca 0.00 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.14 2nr9 n GLY 109 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2nr9 n PRO 110 N 0.29 0.82 -2.85 1.61 -0.04 -1.26 -4.23 135.00 129.34 2nr9 n PRO 110 Ca 0.00 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 2nr9 n PRO 110 Cb 0.00 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 2nr9 n PRO 110 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2nr9 n ALA 111 N -0.31 4.84 -3.42 0.55 0.00 -1.26 -4.29 120.51 116.62 2nr9 n ALA 111 Ca 0.00 -4.53 -0.16 0.00 0.00 0.00 0.00 53.44 48.75 2nr9 n ALA 111 Cb 0.06 -2.69 -0.07 0.00 0.00 0.00 0.00 19.45 16.76 2nr9 n ALA 111 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2nr9 s PHE 112 N -0.79 -0.50 0.04 0.00 -0.12 -1.26 -4.83 117.98 110.53 2nr9 s PHE 112 Ca 0.36 0.90 -0.11 0.00 -0.05 0.00 0.00 56.93 58.03 2nr9 s PHE 112 Cb 0.02 0.28 0.01 0.00 -0.63 0.00 0.00 43.02 42.70 2nr9 s PHE 112 CO 0.02 -0.49 0.25 -0.06 -0.05 0.00 0.00 175.22 174.89 2nr9 s PHE 113 N -1.02 -0.02 0.00 3.49 0.40 -1.23 -4.69 117.98 114.91 2nr9 s PHE 113 Ca -0.10 -0.16 0.00 0.00 -0.60 0.00 0.00 56.93 56.07 2nr9 s PHE 113 Cb -0.02 0.03 0.00 0.00 0.51 0.00 0.00 43.02 43.54 2nr9 s PHE 113 CO 0.07 -0.47 0.00 0.41 0.70 0.00 0.00 175.22 175.93 2nr9 n GLY 114 N 0.63 3.13 0.76 4.36 0.00 0.13 -4.69 105.19 109.51 2nr9 n GLY 114 Ca -0.19 -2.00 0.12 0.00 0.00 0.00 0.00 46.02 43.96 2nr9 n GLY 114 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2nr9 n LEU 115 N 0.00 2.31 0.18 0.99 7.94 -1.17 -4.27 117.00 122.99 2nr9 n LEU 115 Ca 0.00 -0.90 0.05 0.00 -1.11 0.00 0.00 56.01 54.06 2nr9 n LEU 115 Cb 0.00 -0.09 0.51 0.00 0.53 0.00 0.00 43.42 44.37 2nr9 n LEU 115 CO 0.00 0.45 0.99 0.77 -1.11 0.00 0.00 177.39 178.49 2nr9 h SER 116 N 3.27 0.12 -0.21 1.96 4.64 -1.90 -0.35 113.55 121.07 2nr9 h SER 116 Ca 0.00 -0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.22 2nr9 h SER 116 Cb 0.71 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.75 2nr9 h SER 116 CO 0.00 0.19 -0.15 1.23 -0.87 0.00 0.00 176.83 177.23 2nr9 h GLY 117 N 0.41 0.67 1.43 -0.77 0.00 -1.80 -1.86 103.07 101.14 2nr9 h GLY 117 Ca 0.03 -0.50 -0.20 0.00 0.00 0.00 0.00 47.33 46.65 2nr9 h GLY 117 CO 0.01 0.46 -0.76 -2.08 0.00 0.00 0.00 176.54 174.17 2nr9 h VAL 118 N 0.56 1.34 -0.12 4.60 2.07 -1.57 -2.87 116.25 120.25 2nr9 h VAL 118 Ca 0.09 -2.09 0.02 0.00 0.82 0.00 0.00 66.70 65.54 2nr9 h VAL 118 Cb 0.58 2.08 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 2nr9 h VAL 118 CO 0.04 0.64 0.01 0.58 0.02 0.00 0.00 177.57 178.86 2nr9 h VAL 119 N 0.38 0.93 -0.83 2.57 2.07 -0.79 0.19 116.25 120.76 2nr9 h VAL 119 Ca -0.04 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 2nr9 h VAL 119 Cb 1.36 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.96 2nr9 h VAL 119 CO 0.14 0.01 0.46 1.88 0.02 0.00 0.00 177.57 180.08 2nr9 h TYR 120 N 0.06 1.13 -0.30 1.57 -1.99 -1.40 0.57 116.97 116.62 2nr9 h TYR 120 Ca 0.06 -0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.76 2nr9 h TYR 120 Cb 0.06 -0.36 -0.01 0.00 2.00 0.00 0.00 36.73 38.41 2nr9 h TYR 120 CO -0.13 0.78 0.17 0.00 -0.00 0.00 0.00 178.16 178.98 2nr9 h ALA 121 N 1.34 0.39 -0.34 3.88 0.00 -1.20 0.57 119.26 123.91 2nr9 h ALA 121 Ca 0.29 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2nr9 h ALA 121 Cb 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2nr9 h ALA 121 CO -0.05 -0.08 0.21 0.28 0.00 0.00 0.00 179.25 179.61 2nr9 h VAL 122 N 0.37 1.11 -0.76 0.00 2.07 0.04 0.11 116.25 119.18 2nr9 h VAL 122 Ca 0.11 -0.23 -0.06 0.00 0.82 0.00 0.00 66.70 67.34 2nr9 h VAL 122 Cb 0.06 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 2nr9 h VAL 122 CO -0.02 0.10 0.26 -0.07 0.02 0.00 0.00 177.57 177.87 2nr9 h LEU 123 N 0.45 1.09 -0.61 2.57 3.38 0.36 -1.73 115.31 120.82 2nr9 h LEU 123 Ca 0.12 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 2nr9 h LEU 123 Cb -0.01 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.42 2nr9 h LEU 123 CO -0.02 1.00 0.28 1.23 0.09 0.00 0.00 178.44 181.02 2nr9 h GLY 124 N 1.13 0.94 0.88 0.83 0.00 0.50 -0.60 103.07 106.75 2nr9 h GLY 124 Ca 0.25 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 2nr9 h GLY 124 CO -0.01 0.45 -0.06 -1.82 0.00 0.00 0.00 176.54 175.09 2nr9 h TYR 125 N 0.83 -0.17 -0.80 5.60 3.20 -0.51 -2.69 116.97 122.44 2nr9 h TYR 125 Ca 0.21 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.06 2nr9 h TYR 125 Cb 0.13 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 2nr9 h TYR 125 CO 0.00 0.00 0.43 0.28 -1.64 0.00 0.00 178.16 177.24 2nr9 h VAL 126 N -0.31 1.24 0.35 1.81 2.07 -1.29 -2.23 116.25 117.90 2nr9 h VAL 126 Ca -0.02 -0.60 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 2nr9 h VAL 126 Cb 0.25 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 2nr9 h VAL 126 CO 0.03 0.27 -0.36 0.15 0.02 0.00 0.00 177.57 177.67 2nr9 h PHE 127 N 1.10 -0.99 -0.04 1.57 3.57 -1.01 0.80 116.94 121.95 2nr9 h PHE 127 Ca 0.28 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.65 2nr9 h PHE 127 Cb 0.04 0.39 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 2nr9 h PHE 127 CO 0.00 -0.51 -0.58 0.97 -2.23 0.00 0.00 178.31 175.96 2nr9 h ILE 128 N -0.74 1.40 -0.05 1.41 2.10 -1.50 -0.84 117.51 119.28 2nr9 h ILE 128 Ca -0.02 -1.96 -0.00 0.00 1.08 0.00 0.00 64.86 63.96 2nr9 h ILE 128 Cb 0.67 2.01 -0.00 0.00 -1.09 0.00 0.00 36.82 38.42 2nr9 h ILE 128 CO -0.07 0.57 0.02 0.03 -1.08 0.00 0.00 178.15 177.62 2nr9 h ARG 129 N 0.10 0.08 -0.09 2.19 2.47 -1.27 0.02 114.38 117.88 2nr9 h ARG 129 Ca -0.00 -0.01 0.01 0.00 -1.26 0.00 0.00 59.98 58.71 2nr9 h ARG 129 Cb 1.05 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.35 2nr9 h ARG 129 CO 0.08 0.21 0.03 0.22 0.56 0.00 0.00 179.97 181.07 2nr9 h ASP 130 N -0.07 0.03 -0.98 7.04 -0.00 -0.77 -2.66 116.42 119.00 2nr9 h ASP 130 Ca 0.02 0.01 0.10 0.00 -0.00 0.00 0.00 57.03 57.16 2nr9 h ASP 130 Cb 0.16 0.01 -0.08 0.00 -0.00 0.00 0.00 39.33 39.42 2nr9 h ASP 130 CO -0.00 0.03 0.63 0.50 -0.00 0.00 0.00 179.24 180.39 2nr9 h LYS 131 N 0.07 0.98 0.00 0.28 1.63 -1.08 -2.84 116.57 115.61 2nr9 h LYS 131 Ca 0.04 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2nr9 h LYS 131 Cb 0.02 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.43 2nr9 h LYS 131 CO -0.04 0.65 0.00 1.28 -3.45 0.00 0.00 179.45 177.89 2nr9 n LEU 132 N -4.57 0.00 -1.21 5.20 4.77 -0.02 -4.44 117.00 116.74 2nr9 n LEU 132 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 2nr9 n LEU 132 Cb 0.31 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 2nr9 n LEU 132 CO 0.29 0.00 0.20 0.59 -1.33 0.00 0.00 177.39 177.14 2nr9 n ASN 133 N 0.00 1.15 -2.36 -1.43 5.03 -1.08 -4.86 115.26 111.70 2nr9 n ASN 133 Ca 0.00 -0.84 -0.21 0.00 0.87 0.00 0.00 54.58 54.39 2nr9 n ASN 133 Cb 0.00 -0.21 -0.08 0.00 -1.02 0.00 0.00 39.78 38.47 2nr9 n ASN 133 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2nr9 n HIS 134 N 1.09 0.29 0.07 3.10 1.44 -1.07 -4.12 115.22 116.01 2nr9 n HIS 134 Ca 0.00 0.19 0.00 0.00 -2.01 0.00 0.00 57.72 55.90 2nr9 n HIS 134 Cb 0.16 -1.22 0.00 0.00 0.12 0.00 0.00 29.99 29.05 2nr9 n HIS 134 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2nr9 n HIS 135 N 5.44 -2.81 0.00 -1.40 8.25 -1.26 -4.93 115.22 118.50 2nr9 n HIS 135 Ca 0.35 0.46 0.00 0.00 -0.26 0.00 0.00 57.72 58.27 2nr9 n HIS 135 Cb 0.02 1.45 0.00 0.00 1.12 0.00 0.00 29.99 32.57 2nr9 n HIS 135 CO 0.00 0.00 0.00 1.47 0.64 0.00 0.00 176.34 178.45 2nr9 n LEU 136 N -2.90 0.00 -4.06 2.41 -0.00 -1.26 -4.44 117.00 106.75 2nr9 n LEU 136 Ca 0.00 0.05 -0.08 0.00 -0.00 0.00 0.00 56.01 55.98 2nr9 n LEU 136 Cb 0.00 -0.05 -0.10 0.00 -0.00 0.00 0.00 43.42 43.27 2nr9 n LEU 136 CO 0.00 -0.05 -0.36 -0.36 -0.00 0.00 0.00 177.39 176.62 2nr9 s PHE 137 N -1.76 0.45 -0.38 1.47 0.40 -1.26 -5.00 117.98 111.90 2nr9 s PHE 137 Ca 0.00 -0.90 0.12 0.00 -0.60 0.00 0.00 56.93 55.55 2nr9 s PHE 137 Cb 0.00 -0.33 0.44 0.00 0.51 0.00 0.00 43.02 43.63 2nr9 s PHE 137 CO 0.00 -0.32 1.01 -0.25 0.70 0.00 0.00 175.22 176.37 2nr9 n ASP 138 N 0.55 2.88 -0.51 1.36 10.43 -1.26 -5.02 116.55 124.98 2nr9 n ASP 138 Ca -0.17 -3.17 0.00 0.00 2.57 0.00 0.00 54.79 54.02 2nr9 n ASP 138 Cb 0.59 -0.50 0.00 0.00 1.84 0.00 0.00 41.12 43.05 2nr9 n ASP 138 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 2nr9 n LEU 139 N -0.24 -1.13 0.00 0.64 4.77 -1.26 -4.92 117.00 114.86 2nr9 n LEU 139 Ca 0.23 0.97 0.00 0.00 -0.03 0.00 0.00 56.01 57.18 2nr9 n LEU 139 Cb 0.74 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2nr9 n LEU 139 CO 0.30 0.02 0.16 -2.65 -1.33 0.00 0.00 177.39 173.89 2nr9 n PRO 140 N -1.25 0.00 0.00 3.23 -0.02 -1.26 -4.96 135.00 130.75 2nr9 n PRO 140 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2nr9 n PRO 140 Cb 0.05 -0.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.71 2nr9 n PRO 140 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2nr9 n GLU 141 N -0.33 0.00 0.00 -0.52 1.02 -1.26 -5.00 120.64 114.55 2nr9 n GLU 141 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2nr9 n GLU 141 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2nr9 n GLU 141 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2nr9 n GLY 142 N -0.67 1.58 0.09 0.62 0.00 -1.26 -4.93 105.19 100.62 2nr9 n GLY 142 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2nr9 n GLY 142 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2nr9 n PHE 143 N 0.00 0.00 0.89 1.61 3.01 -1.26 -4.11 117.46 117.61 2nr9 n PHE 143 Ca 0.00 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.56 2nr9 n PHE 143 Cb 0.00 -0.72 0.49 0.00 -0.01 0.00 0.00 39.48 39.24 2nr9 n PHE 143 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 2nr9 n PHE 144 N -2.95 0.00 -0.02 1.38 3.01 -1.26 -1.53 117.46 116.09 2nr9 n PHE 144 Ca -0.31 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 57.99 2nr9 n PHE 144 Cb 0.87 -0.33 -0.14 0.00 -0.01 0.00 0.00 39.48 39.87 2nr9 n PHE 144 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 2nr9 n THR 145 N -1.33 1.69 0.13 4.37 -1.04 -1.26 -4.42 114.28 112.42 2nr9 n THR 145 Ca 0.08 -0.71 -0.11 0.00 -2.04 0.00 0.00 64.05 61.28 2nr9 n THR 145 Cb 0.18 -1.42 -0.07 0.00 -1.82 0.00 0.00 70.33 67.21 2nr9 n THR 145 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 2nr9 h MET 146 N 0.04 -0.39 -1.89 -2.82 2.86 -1.61 -3.26 114.93 107.86 2nr9 h MET 146 Ca -0.39 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.28 2nr9 h MET 146 Cb 2.03 0.09 0.00 0.00 0.06 0.00 0.00 31.60 33.78 2nr9 h MET 146 CO 0.07 -0.07 0.00 1.28 1.06 0.00 0.00 176.91 179.26 2nr9 n LEU 147 N -5.06 0.00 0.00 1.22 4.77 -0.58 0.15 117.00 117.50 2nr9 n LEU 147 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2nr9 n LEU 147 Cb 0.26 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 2nr9 n LEU 147 CO 0.24 0.00 -0.40 0.18 -1.33 0.00 0.00 177.39 176.08 2nr9 n LEU 148 N 1.25 0.00 -0.07 2.23 4.77 -1.23 -4.44 117.00 119.52 2nr9 n LEU 148 Ca 0.00 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.76 2nr9 n LEU 148 Cb 0.00 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 2nr9 n LEU 148 CO 0.00 0.00 -0.83 0.52 -1.33 0.00 0.00 177.39 175.75 2nr9 n VAL 149 N -1.63 1.63 1.31 4.08 0.31 0.12 -3.99 118.33 120.16 2nr9 n VAL 149 Ca 0.00 -0.38 0.01 0.00 -0.01 0.00 0.00 64.34 63.96 2nr9 n VAL 149 Cb 0.35 -1.84 0.04 0.00 -0.91 0.00 0.00 33.84 31.48 2nr9 n VAL 149 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2nr9 n GLY 150 N 1.72 0.43 0.00 2.92 0.00 -1.15 -2.76 105.19 106.35 2nr9 n GLY 150 Ca -0.36 -0.09 0.04 0.00 0.00 0.00 0.00 46.02 45.61 2nr9 n GLY 150 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2nr9 n ILE 151 N -0.11 0.00 0.44 -0.61 3.06 -1.26 -4.34 119.36 116.54 2nr9 n ILE 151 Ca 0.03 -0.26 0.12 0.00 -2.50 0.00 0.00 62.75 60.14 2nr9 n ILE 151 Cb 0.20 0.73 0.48 0.00 0.54 0.00 0.00 39.64 41.59 2nr9 n ILE 151 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2nr9 n ALA 152 N -1.43 1.76 0.86 1.51 0.00 -1.11 -1.10 120.51 120.99 2nr9 n ALA 152 Ca 0.00 0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.62 2nr9 n ALA 152 Cb 0.17 -1.40 0.06 0.00 0.00 0.00 0.00 19.45 18.28 2nr9 n ALA 152 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2nr9 n LEU 153 N -2.22 0.69 0.00 0.00 4.77 -1.26 -3.30 117.00 115.68 2nr9 n LEU 153 Ca 0.03 -0.17 0.09 0.00 -0.03 0.00 0.00 56.01 55.93 2nr9 n LEU 153 Cb 0.26 -0.12 0.55 0.00 -2.33 0.00 0.00 43.42 41.77 2nr9 n LEU 153 CO 0.21 0.14 0.75 0.61 -1.33 0.00 0.00 177.39 177.77 2nr9 n GLY 154 N 1.46 -0.62 0.00 -0.72 0.00 -0.26 -2.66 105.19 102.39 2nr9 n GLY 154 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2nr9 n GLY 154 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2nr9 n PHE 155 N -0.97 0.00 0.03 1.61 1.16 -1.26 -4.28 117.46 113.76 2nr9 n PHE 155 Ca 0.14 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.60 2nr9 n PHE 155 Cb 0.06 0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 37.84 2nr9 n PHE 155 CO 0.00 0.00 0.00 0.82 -1.87 0.00 0.00 176.76 175.71 2nr9 h ILE 156 N 0.00 1.11 -2.44 1.97 2.04 -1.65 -3.37 117.51 115.16 2nr9 h ILE 156 Ca 0.00 -1.12 -0.60 0.00 1.00 0.00 0.00 64.86 64.13 2nr9 h ILE 156 Cb 0.00 1.78 -0.42 0.00 -0.74 0.00 0.00 36.82 37.45 2nr9 h ILE 156 CO 0.00 0.26 -0.65 -1.54 0.00 0.00 0.00 178.15 176.22 2nr9 n SER 157 N -4.91 3.05 -0.17 1.72 3.41 -1.09 -5.07 113.62 110.57 2nr9 n SER 157 Ca -0.08 -3.27 -0.02 0.00 -0.26 0.00 0.00 58.87 55.23 2nr9 n SER 157 Cb 0.27 -0.69 -0.00 0.00 -0.26 0.00 0.00 64.21 63.53 2nr9 n SER 157 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2nr9 n PRO 158 N 1.30 0.00 -0.00 4.33 -0.02 -1.20 -4.64 135.00 134.77 2nr9 n PRO 158 Ca 0.26 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.79 2nr9 n PRO 158 Cb 0.41 -0.06 -0.06 0.00 -0.02 0.00 0.00 33.50 33.76 2nr9 n PRO 158 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2nr9 n LEU 159 N 0.28 0.27 0.00 2.45 4.77 -1.24 -4.97 117.00 118.57 2nr9 n LEU 159 Ca 0.02 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 2nr9 n LEU 159 Cb -0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2nr9 n LEU 159 CO 0.04 0.07 0.00 0.33 -1.33 0.00 0.00 177.39 176.49 2nr9 n PHE 160 N -1.47 0.00 0.00 -1.77 7.35 -1.26 -5.07 117.46 115.24 2nr9 n PHE 160 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2nr9 n PHE 160 Cb 0.19 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.02 2nr9 n PHE 160 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2nr9 n GLY 161 N 0.71 1.73 2.72 7.13 0.00 -1.26 -5.02 105.19 111.20 2nr9 n GLY 161 Ca 0.00 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 2nr9 n GLY 161 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2nr9 n VAL 162 N 0.00 4.30 -0.04 1.61 0.31 -1.26 -4.86 118.33 118.39 2nr9 n VAL 162 Ca 0.00 -3.93 0.00 0.00 -0.01 0.00 0.00 64.34 60.40 2nr9 n VAL 162 Cb 0.00 -2.39 0.00 0.00 -0.91 0.00 0.00 33.84 30.54 2nr9 n VAL 162 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 2nr9 n GLU 163 N 3.95 -0.00 0.11 5.55 0.00 -1.26 -3.80 120.64 125.19 2nr9 n GLU 163 Ca 0.50 -0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.65 2nr9 n GLU 163 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.78 2nr9 n GLU 163 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 2nr9 n MET 164 N -0.01 0.00 0.00 3.44 2.81 -1.26 -3.48 117.12 118.62 2nr9 n MET 164 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2nr9 n MET 164 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 2nr9 n MET 164 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2nr9 n GLY 165 N -1.42 3.71 0.02 3.03 0.00 -1.25 -4.92 105.19 104.36 2nr9 n GLY 165 Ca 0.00 -1.72 0.11 0.00 0.00 0.00 0.00 46.02 44.41 2nr9 n GLY 165 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2nr9 n ASN 166 N 0.00 0.11 -0.24 1.61 6.94 -1.26 -3.22 115.26 119.20 2nr9 n ASN 166 Ca 0.00 0.52 -0.05 0.00 -0.02 0.00 0.00 54.58 55.03 2nr9 n ASN 166 Cb 0.00 -0.55 0.11 0.00 -2.36 0.00 0.00 39.78 36.99 2nr9 n ASN 166 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2nr9 h ALA 167 N 2.71 1.12 -0.36 -2.53 0.00 -1.95 0.13 119.26 118.38 2nr9 h ALA 167 Ca 0.00 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.55 2nr9 h ALA 167 Cb 0.41 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2nr9 h ALA 167 CO 0.00 0.62 -0.42 0.00 0.00 0.00 0.00 179.25 179.45 2nr9 h ALA 168 N 1.24 0.56 -0.26 0.00 0.00 -1.78 -1.75 119.26 117.28 2nr9 h ALA 168 Ca 0.24 -0.47 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 2nr9 h ALA 168 Cb 0.23 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2nr9 h ALA 168 CO -0.02 0.68 -0.05 0.45 0.00 0.00 0.00 179.25 180.31 2nr9 h HIS 169 N 0.74 0.55 -0.16 0.00 3.86 -1.54 -0.91 115.15 117.68 2nr9 h HIS 169 Ca 0.05 -0.11 -0.06 0.00 -1.16 0.00 0.00 60.37 59.09 2nr9 h HIS 169 Cb 1.02 -0.13 -0.00 0.00 1.06 0.00 0.00 27.41 29.35 2nr9 h HIS 169 CO 0.06 0.70 -0.13 0.82 0.86 0.00 0.00 177.93 180.24 2nr9 h ILE 170 N 0.24 1.33 0.00 2.45 2.04 -0.80 -0.83 117.51 121.94 2nr9 h ILE 170 Ca 0.07 -1.25 -0.05 0.00 1.00 0.00 0.00 64.86 64.63 2nr9 h ILE 170 Cb 0.52 1.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.38 2nr9 h ILE 170 CO 0.02 0.37 -0.22 0.77 0.00 0.00 0.00 178.15 179.09 2nr9 h SER 171 N 0.03 0.00 -0.01 1.72 4.64 -1.36 -1.26 113.55 117.31 2nr9 h SER 171 Ca 0.03 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2nr9 h SER 171 Cb 0.64 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.73 2nr9 h SER 171 CO 0.03 0.22 -0.00 1.23 -0.87 0.00 0.00 176.83 177.45 2nr9 h GLY 172 N 0.71 0.02 0.72 -0.77 0.00 -0.89 -0.45 103.07 102.41 2nr9 h GLY 172 Ca -0.00 -0.01 0.05 0.00 0.00 0.00 0.00 47.33 47.36 2nr9 h GLY 172 CO 0.03 0.01 0.35 -2.00 0.00 0.00 0.00 176.54 174.94 2nr9 h LEU 173 N -0.31 0.53 -0.52 3.11 5.85 -0.84 -1.58 115.31 121.54 2nr9 h LEU 173 Ca 0.00 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 2nr9 h LEU 173 Cb 0.34 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 2nr9 h LEU 173 CO 0.00 0.35 0.23 0.40 -0.34 0.00 0.00 178.44 179.08 2nr9 h ILE 174 N 0.67 1.21 -0.38 4.05 2.04 -1.10 0.16 117.51 124.15 2nr9 h ILE 174 Ca 0.28 -0.61 0.04 0.00 1.00 0.00 0.00 64.86 65.56 2nr9 h ILE 174 Cb 0.15 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 36.84 2nr9 h ILE 174 CO -0.16 0.24 0.16 0.58 0.00 0.00 0.00 178.15 178.97 2nr9 h VAL 175 N 0.70 0.94 -0.27 1.67 2.07 -0.61 -1.21 116.25 119.54 2nr9 h VAL 175 Ca 0.18 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.56 2nr9 h VAL 175 Cb 0.16 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2nr9 h VAL 175 CO -0.02 0.06 0.08 1.23 0.02 0.00 0.00 177.57 178.94 2nr9 h GLY 176 N 0.34 0.45 1.00 2.17 0.00 -0.71 -1.10 103.07 105.23 2nr9 h GLY 176 Ca 0.17 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2nr9 h GLY 176 CO -0.14 0.26 0.23 1.41 0.00 0.00 0.00 176.54 178.29 2nr9 h LEU 177 N 0.27 0.40 -0.36 3.11 3.38 -0.55 -0.58 115.31 120.98 2nr9 h LEU 177 Ca 0.09 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 2nr9 h LEU 177 Cb 0.25 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2nr9 h LEU 177 CO -0.00 0.29 -0.02 0.40 0.09 0.00 0.00 178.44 179.20 2nr9 h ILE 178 N 0.47 1.26 -0.36 1.22 2.04 -1.18 -1.92 117.51 119.04 2nr9 h ILE 178 Ca 0.13 -1.02 -0.01 0.00 1.00 0.00 0.00 64.86 64.96 2nr9 h ILE 178 Cb -0.05 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 2nr9 h ILE 178 CO -0.03 0.34 0.17 -0.25 0.00 0.00 0.00 178.15 178.38 2nr9 h TRP 179 N 0.45 0.52 -0.49 1.37 2.91 -1.06 -1.72 115.95 117.92 2nr9 h TRP 179 Ca 0.10 -0.03 -0.05 0.00 1.13 0.00 0.00 58.89 60.04 2nr9 h TRP 179 Cb 0.49 -0.16 -0.02 0.00 -0.51 0.00 0.00 29.16 28.95 2nr9 h TRP 179 CO 0.04 0.44 0.10 0.78 -1.03 0.00 0.00 178.44 178.77 2nr9 h GLY 180 N 0.44 0.81 0.96 2.65 0.00 -1.09 -0.74 103.07 106.10 2nr9 h GLY 180 Ca 0.12 -0.47 -0.05 0.00 0.00 0.00 0.00 47.33 46.93 2nr9 h GLY 180 CO -0.02 0.44 0.07 -2.75 0.00 0.00 0.00 176.54 174.29 2nr9 h PHE 181 N 0.73 0.77 -0.15 5.60 3.57 -1.08 0.26 116.94 126.64 2nr9 h PHE 181 Ca 0.16 -0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 2nr9 h PHE 181 Cb 0.30 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 2nr9 h PHE 181 CO 0.02 0.73 0.07 0.82 -2.23 0.00 0.00 178.31 177.72 2nr9 h ILE 182 N 0.59 1.12 -0.82 1.41 2.04 -0.92 -0.73 117.51 120.20 2nr9 h ILE 182 Ca 0.13 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 2nr9 h ILE 182 Cb 0.38 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.50 2nr9 h ILE 182 CO 0.01 0.11 0.39 0.44 0.00 0.00 0.00 178.15 179.10 2nr9 h ASP 183 N 0.12 1.08 -0.54 1.72 3.32 -1.08 0.40 116.42 121.45 2nr9 h ASP 183 Ca 0.05 -0.14 0.02 0.00 0.02 0.00 0.00 57.03 56.99 2nr9 h ASP 183 Cb 0.11 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 2nr9 h ASP 183 CO -0.01 0.92 0.33 -1.28 -1.72 0.00 0.00 179.24 177.48 2nr9 h SER 184 N 1.17 0.54 0.17 6.45 0.87 -0.76 -1.04 113.55 120.96 2nr9 h SER 184 Ca 0.28 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.83 2nr9 h SER 184 Cb 0.13 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2nr9 h SER 184 CO -0.03 0.38 -0.08 0.50 -0.53 0.00 0.00 176.83 177.06 2nr9 h LYS 185 N 0.66 -0.22 -0.42 2.24 3.64 -0.48 -2.05 116.57 119.94 2nr9 h LYS 185 Ca 0.21 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.68 2nr9 h LYS 185 Cb 0.01 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 2nr9 h LYS 185 CO -0.09 -0.05 0.28 -0.07 -2.27 0.00 0.00 179.45 177.25 2nr9 h LEU 186 N -0.34 0.24 0.51 5.20 3.38 -0.80 -0.46 115.31 123.02 2nr9 h LEU 186 Ca -0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2nr9 h LEU 186 Cb 0.27 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2nr9 h LEU 186 CO 0.04 0.15 -0.24 -0.09 0.09 0.00 0.00 178.44 178.39 2nr9 h ARG 187 N 0.27 -0.65 -0.30 1.13 9.65 -0.91 -3.05 114.38 120.52 2nr9 h ARG 187 Ca 0.19 0.04 0.05 0.00 -1.10 0.00 0.00 59.98 59.16 2nr9 h ARG 187 Cb 0.39 0.15 -0.05 0.00 -1.39 0.00 0.00 29.97 29.08 2nr9 h ARG 187 CO -0.04 -0.35 0.01 -0.22 2.80 0.00 0.00 179.97 182.16 2nr9 h LYS 188 N -0.91 0.09 -1.00 0.20 3.64 -0.84 -2.33 116.57 115.42 2nr9 h LYS 188 Ca -0.07 -0.01 0.21 0.00 -1.27 0.00 0.00 60.65 59.52 2nr9 h LYS 188 Cb 0.60 -0.02 -0.11 0.00 -0.41 0.00 0.00 32.23 32.29 2nr9 h LYS 188 CO 0.11 0.06 0.61 -0.91 -2.27 0.00 0.00 179.45 177.06 2nr9 h ASN 189 N 0.10 0.71 0.85 4.20 2.35 -1.14 -2.09 115.58 120.55 2nr9 h ASN 189 Ca 0.14 0.10 -0.21 0.00 -0.55 0.00 0.00 56.30 55.78 2nr9 h ASN 189 Cb 0.19 -0.02 -0.03 0.00 0.05 0.00 0.00 38.32 38.50 2nr9 h ASN 189 CO -0.23 0.21 -1.23 0.28 -1.65 0.00 0.00 177.43 174.80 2nr9 h SER 190 N 0.67 0.00 1.18 5.81 0.02 -1.37 -3.28 113.55 116.58 2nr9 h SER 190 Ca 0.59 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.54 2nr9 h SER 190 Cb 1.05 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.59 2nr9 h SER 190 CO -0.39 0.86 -0.02 -0.07 -1.14 0.00 0.00 176.83 176.07 2nr9 h LEU 191 N 0.00 0.00 -1.34 5.07 3.38 -0.88 -3.26 115.31 118.28 2nr9 h LEU 191 Ca -0.13 0.00 0.30 0.00 0.09 0.00 0.00 57.88 58.15 2nr9 h LEU 191 Cb 1.76 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 42.41 2nr9 h LEU 191 CO 0.09 0.02 0.70 -0.08 0.09 0.00 0.00 178.44 179.25 2nr9 h GLU 192 N 0.00 0.33 -1.19 1.13 4.81 -1.46 -0.06 114.58 118.14 2nr9 h GLU 192 Ca -0.00 -0.02 -0.66 0.00 -0.13 0.00 0.00 59.36 58.55 2nr9 h GLU 192 Cb 0.61 -0.07 -0.33 0.00 0.63 0.00 0.00 28.75 29.58 2nr9 h GLU 192 CO 0.00 0.22 0.33 1.28 -0.73 0.00 0.00 179.01 180.11 2nr9 n LEU 193 N -4.67 6.68 -4.07 1.64 4.77 -1.23 -4.96 117.00 115.16 2nr9 n LEU 193 Ca 0.28 -4.61 -0.18 0.00 -0.03 0.00 0.00 56.01 51.47 2nr9 n LEU 193 Cb 0.99 -0.79 -0.13 0.00 -2.33 0.00 0.00 43.42 41.16 2nr9 n LEU 193 CO 0.23 1.77 -0.44 -0.69 -1.33 0.00 0.00 177.39 176.93 2nr9 s VAL 194 N -4.90 0.79 -2.00 4.08 1.01 -0.04 -5.16 120.40 114.18 2nr9 s VAL 194 Ca 0.57 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.85 2nr9 s VAL 194 Cb 0.46 -0.72 0.06 0.00 0.00 0.00 0.00 36.38 36.18 2nr9 s VAL 194 CO -0.10 0.01 0.61 -0.81 0.00 0.00 0.00 175.10 174.81