#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1of8 n ARG 24 N 0.00 2.88 -3.46 7.34 1.74 -1.26 -4.86 116.66 119.03 1of8 n ARG 24 Ca 0.00 -2.05 -0.41 0.00 -0.77 0.00 0.00 57.85 54.62 1of8 n ARG 24 Cb 0.00 -1.27 -0.10 0.00 -1.02 0.00 0.00 32.46 30.07 1of8 n ARG 24 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1of8 s ILE 25 N -1.02 5.23 0.14 0.55 -1.09 -1.26 -4.97 121.20 118.79 1of8 s ILE 25 Ca 0.23 -0.22 -0.09 0.00 -2.23 0.00 0.00 60.65 58.34 1of8 s ILE 25 Cb 0.12 -3.81 -0.08 0.00 -1.58 0.00 0.00 42.46 37.12 1of8 s ILE 25 CO 0.15 -0.11 1.44 -0.07 -1.23 0.00 0.00 174.94 175.12 1of8 h LEU 26 N 8.63 0.89 0.00 2.97 3.38 -2.11 -3.48 115.31 125.60 1of8 h LEU 26 Ca -0.30 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.20 1of8 h LEU 26 Cb 1.14 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1of8 h LEU 26 CO 0.68 1.25 0.00 0.61 0.09 0.00 0.00 178.44 181.07 1of8 n GLY 27 N 0.32 -0.92 3.24 0.83 0.00 -1.26 -5.15 105.19 102.25 1of8 n GLY 27 Ca -0.04 -1.05 -0.29 0.00 0.00 0.00 0.00 46.02 44.64 1of8 n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1of8 s TYR 28 N -2.00 2.12 0.11 1.61 1.51 -1.26 -5.14 117.35 114.30 1of8 s TYR 28 Ca 0.00 -0.50 0.09 0.00 -1.01 0.00 0.00 57.07 55.64 1of8 s TYR 28 Cb 0.00 -1.38 -0.04 0.00 -0.11 0.00 0.00 41.96 40.43 1of8 s TYR 28 CO 0.00 -0.11 -0.18 -0.51 -1.11 0.00 0.00 175.55 173.64 1of8 s ASP 29 N -0.34 3.90 0.48 2.29 1.01 -1.26 -5.11 116.67 117.64 1of8 s ASP 29 Ca 0.03 -0.55 -0.23 0.00 0.71 0.00 0.00 52.55 52.52 1of8 s ASP 29 Cb -0.11 -0.56 -0.07 0.00 1.01 0.00 0.00 42.92 43.20 1of8 s ASP 29 CO 0.01 0.18 1.23 -2.16 0.21 0.00 0.00 175.17 174.64 1of8 s PRO 30 N -2.10 3.60 -0.07 8.23 0.04 -1.26 -5.03 135.00 138.41 1of8 s PRO 30 Ca 0.18 1.92 0.02 0.00 0.04 0.00 0.00 61.00 63.16 1of8 s PRO 30 Cb -0.11 -2.39 0.02 0.00 0.04 0.00 0.00 34.50 32.07 1of8 s PRO 30 CO 0.10 -0.73 -0.10 -1.17 0.04 0.00 0.00 177.00 175.14 1of8 s LEU 31 N -3.13 1.52 0.45 -3.56 2.96 -1.26 -4.92 118.68 110.74 1of8 s LEU 31 Ca 0.65 -0.26 -0.25 0.00 -0.22 0.00 0.00 54.13 54.05 1of8 s LEU 31 Cb -0.32 -0.75 -0.08 0.00 0.50 0.00 0.00 46.19 45.54 1of8 s LEU 31 CO 0.39 -0.00 1.43 0.00 -1.32 0.00 0.00 176.35 176.84 1of8 s ALA 32 N 0.85 3.23 0.66 5.97 0.00 -1.26 -5.00 121.76 126.21 1of8 s ALA 32 Ca -0.11 1.46 -0.13 0.00 0.00 0.00 0.00 51.96 53.18 1of8 s ALA 32 Cb -0.15 -3.59 -0.01 0.00 0.00 0.00 0.00 23.12 19.37 1of8 s ALA 32 CO 0.01 -1.20 1.06 -1.54 0.00 0.00 0.00 175.76 174.10 1of8 s SER 33 N -0.51 5.51 0.20 0.00 1.04 -1.26 -4.88 113.70 113.79 1of8 s SER 33 Ca 0.61 1.70 -0.11 0.00 0.48 0.00 0.00 55.95 58.64 1of8 s SER 33 Cb -0.44 -2.51 0.24 0.00 0.10 0.00 0.00 66.02 63.41 1of8 s SER 33 CO 0.56 -1.36 1.73 -0.65 0.98 0.00 0.00 173.24 174.50 1of8 h PRO 34 N -0.27 0.32 -0.85 4.02 0.11 -1.83 -1.57 132.00 131.92 1of8 h PRO 34 Ca -0.45 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.65 1of8 h PRO 34 Cb 1.21 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 1of8 h PRO 34 CO 0.57 0.21 0.56 0.00 -0.21 0.00 0.00 178.00 179.13 1of8 h ALA 35 N 1.41 1.09 -0.27 -0.75 0.00 -1.49 -0.01 119.26 119.23 1of8 h ALA 35 Ca 0.28 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1of8 h ALA 35 Cb 0.37 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1of8 h ALA 35 CO -0.32 0.47 0.11 1.25 0.00 0.00 0.00 179.25 180.75 1of8 h LEU 36 N 1.14 0.38 -1.12 0.00 5.85 -1.70 -2.17 115.31 117.70 1of8 h LEU 36 Ca 0.32 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 1of8 h LEU 36 Cb -0.11 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 1of8 h LEU 36 CO -0.08 0.45 0.30 0.25 -0.34 0.00 0.00 178.44 179.03 1of8 h LEU 37 N 0.29 0.84 -1.24 2.25 5.85 -0.85 -1.16 115.31 121.30 1of8 h LEU 37 Ca 0.09 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 1of8 h LEU 37 Cb 0.19 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1of8 h LEU 37 CO -0.01 0.72 -0.18 1.56 -0.34 0.00 0.00 178.44 180.19 1of8 h GLN 38 N 0.92 0.30 -0.18 1.25 4.20 -0.80 0.16 115.11 120.96 1of8 h GLN 38 Ca 0.22 -0.09 -0.19 0.00 0.06 0.00 0.00 58.65 58.66 1of8 h GLN 38 Cb 0.11 -0.03 0.01 0.00 0.30 0.00 0.00 27.48 27.86 1of8 h GLN 38 CO -0.03 0.48 -0.62 0.28 -0.67 0.00 0.00 178.83 178.27 1of8 h VAL 39 N 0.28 1.30 -0.31 -0.54 2.07 -0.92 -3.17 116.25 114.95 1of8 h VAL 39 Ca 0.05 -1.84 -0.11 0.00 0.82 0.00 0.00 66.70 65.62 1of8 h VAL 39 Cb 0.49 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 1of8 h VAL 39 CO 0.03 0.58 -0.27 1.56 0.02 0.00 0.00 177.57 179.49 1of8 h GLN 40 N 0.46 0.64 -2.66 1.57 4.20 -0.87 -3.35 115.11 115.10 1of8 h GLN 40 Ca -0.03 -0.27 -0.60 0.00 0.06 0.00 0.00 58.65 57.81 1of8 h GLN 40 Cb 1.25 -0.02 -0.41 0.00 0.30 0.00 0.00 27.48 28.59 1of8 h GLN 40 CO 0.13 0.84 -0.72 -0.89 -0.67 0.00 0.00 178.83 177.52 1of8 n ILE 41 N -4.10 0.83 -2.41 2.54 5.41 0.01 -5.09 119.36 116.57 1of8 n ILE 41 Ca -0.00 -4.49 -0.37 0.00 1.00 0.00 0.00 62.75 58.89 1of8 n ILE 41 Cb 0.44 -2.02 -0.03 0.00 -0.71 0.00 0.00 39.64 37.33 1of8 n ILE 41 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1of8 s PRO 42 N -1.23 4.03 0.31 0.38 0.04 -1.20 -4.69 135.00 132.64 1of8 s PRO 42 Ca 0.30 1.66 -0.29 0.00 0.04 0.00 0.00 61.00 62.72 1of8 s PRO 42 Cb 0.03 -2.54 -0.10 0.00 0.04 0.00 0.00 34.50 31.93 1of8 s PRO 42 CO -0.15 -0.29 1.16 0.00 0.04 0.00 0.00 177.00 177.76 1of8 s ALA 43 N -1.57 3.40 0.66 8.56 0.00 -1.26 -5.03 121.76 126.53 1of8 s ALA 43 Ca 0.59 1.00 -0.11 0.00 0.00 0.00 0.00 51.96 53.44 1of8 s ALA 43 Cb -0.26 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.48 1of8 s ALA 43 CO 0.32 -0.32 1.05 0.95 0.00 0.00 0.00 175.76 177.76 1of8 s THR 44 N -1.19 4.33 0.31 0.00 -4.23 -1.26 -4.90 115.64 108.71 1of8 s THR 44 Ca 0.47 0.76 0.03 0.00 -1.18 0.00 0.00 61.69 61.78 1of8 s THR 44 Cb -0.34 -3.61 0.29 0.00 1.34 0.00 0.00 72.50 70.19 1of8 s THR 44 CO 0.44 -0.98 1.88 -0.65 -0.54 0.00 0.00 174.62 174.77 1of8 h PRO 45 N -0.51 0.89 -0.32 3.99 0.11 -1.99 -1.54 132.00 132.62 1of8 h PRO 45 Ca -0.44 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1of8 h PRO 45 Cb 1.20 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 1of8 h PRO 45 CO 0.59 0.59 0.15 1.15 -0.21 0.00 0.00 178.00 180.26 1of8 h THR 46 N 0.91 1.16 -0.60 -1.15 2.02 -1.92 -1.19 112.91 112.15 1of8 h THR 46 Ca 0.43 -0.47 0.10 0.00 0.77 0.00 0.00 66.41 67.25 1of8 h THR 46 Cb 0.43 0.89 -0.08 0.00 -1.74 0.00 0.00 68.15 67.65 1of8 h THR 46 CO -0.19 0.17 0.18 0.28 0.37 0.00 0.00 175.52 176.32 1of8 h SER 47 N 0.37 0.11 -0.29 4.18 0.02 -1.49 -0.02 113.55 116.43 1of8 h SER 47 Ca 0.11 0.10 -0.07 0.00 -0.84 0.00 0.00 61.79 61.09 1of8 h SER 47 Cb 0.13 0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 1of8 h SER 47 CO -0.01 0.07 -0.08 -0.07 -1.14 0.00 0.00 176.83 175.59 1of8 h LEU 48 N 0.33 0.58 -0.83 5.07 4.07 -0.97 -1.16 115.31 122.39 1of8 h LEU 48 Ca 0.31 -0.37 -0.06 0.00 0.08 0.00 0.00 57.88 57.84 1of8 h LEU 48 Cb 0.43 -0.16 -0.03 0.00 1.08 0.00 0.00 40.66 41.98 1of8 h LEU 48 CO -0.36 0.82 0.19 -0.08 -1.08 0.00 0.00 178.44 177.93 1of8 h GLU 49 N 0.33 1.06 -0.26 1.13 4.57 -1.06 -1.42 114.58 118.93 1of8 h GLU 49 Ca 0.07 -0.23 -0.01 0.00 -1.18 0.00 0.00 59.36 58.02 1of8 h GLU 49 Cb 0.57 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.99 1of8 h GLU 49 CO 0.03 0.92 0.14 1.15 -1.18 0.00 0.00 179.01 180.07 1of8 h THR 50 N 1.02 1.13 -0.76 0.32 2.02 -0.78 0.76 112.91 116.61 1of8 h THR 50 Ca 0.22 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 1of8 h THR 50 Cb 0.32 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 1of8 h THR 50 CO -0.00 0.13 0.42 0.00 0.37 0.00 0.00 175.52 176.43 1of8 h ALA 51 N 1.01 0.97 -0.39 6.16 0.00 -1.01 -0.66 119.26 125.35 1of8 h ALA 51 Ca 0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1of8 h ALA 51 Cb 0.08 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1of8 h ALA 51 CO -0.01 0.48 0.17 0.87 0.00 0.00 0.00 179.25 180.76 1of8 h LYS 52 N 1.05 0.57 -0.62 0.00 6.56 -1.00 -2.32 116.57 120.80 1of8 h LYS 52 Ca 0.27 -0.09 -0.02 0.00 -1.06 0.00 0.00 60.65 59.74 1of8 h LYS 52 Cb 0.03 -0.10 -0.03 0.00 -0.57 0.00 0.00 32.23 31.57 1of8 h LYS 52 CO -0.04 0.52 0.30 -0.09 -2.06 0.00 0.00 179.45 178.08 1of8 h ARG 53 N 0.48 0.89 -0.62 3.15 2.43 -0.61 -1.45 114.38 118.67 1of8 h ARG 53 Ca 0.13 -0.13 0.04 0.00 -0.81 0.00 0.00 59.98 59.21 1of8 h ARG 53 Cb 0.15 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.49 1of8 h ARG 53 CO -0.01 0.72 0.36 0.78 -1.51 0.00 0.00 179.97 180.31 1of8 h GLY 54 N 0.85 0.89 0.92 2.80 0.00 -0.99 0.20 103.07 107.74 1of8 h GLY 54 Ca 0.21 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1of8 h GLY 54 CO -0.03 0.20 -0.04 3.21 0.00 0.00 0.00 176.54 179.88 1of8 h ARG 55 N 0.70 -0.09 -0.62 4.80 3.08 -1.09 -1.36 114.38 119.80 1of8 h ARG 55 Ca 0.26 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.35 1of8 h ARG 55 Cb 0.09 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.12 1of8 h ARG 55 CO -0.13 -0.06 0.38 0.00 -1.07 0.00 0.00 179.97 179.09 1of8 h ARG 56 N -0.09 0.73 -0.49 0.04 3.08 -0.78 0.09 114.38 116.95 1of8 h ARG 56 Ca 0.01 -0.04 -0.12 0.00 0.07 0.00 0.00 59.98 59.89 1of8 h ARG 56 Cb 0.10 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1of8 h ARG 56 CO -0.02 0.48 -0.17 0.93 -1.07 0.00 0.00 179.97 180.11 1of8 h GLU 57 N 0.75 0.98 -0.35 0.04 5.08 -0.89 -1.14 114.58 119.04 1of8 h GLU 57 Ca 0.25 -0.39 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 1of8 h GLU 57 Cb 0.03 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1of8 h GLU 57 CO -0.11 1.06 0.09 0.00 -1.00 0.00 0.00 179.01 179.06 1of8 h ALA 58 N 0.94 0.46 -0.27 3.43 0.00 -0.86 -2.28 119.26 120.68 1of8 h ALA 58 Ca 0.12 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.89 1of8 h ALA 58 Cb 0.74 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1of8 h ALA 58 CO 0.06 0.12 0.05 0.82 0.00 0.00 0.00 179.25 180.30 1of8 h ILE 59 N 0.41 0.87 -0.48 0.00 2.04 -0.84 -0.99 117.51 118.52 1of8 h ILE 59 Ca 0.11 -0.05 0.01 0.00 1.00 0.00 0.00 64.86 65.93 1of8 h ILE 59 Cb 0.29 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1of8 h ILE 59 CO 0.00 0.03 0.32 0.44 0.00 0.00 0.00 178.15 178.94 1of8 h ASP 60 N 0.15 0.55 -0.00 1.72 3.32 -1.05 -1.37 116.42 119.75 1of8 h ASP 60 Ca 0.13 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 1of8 h ASP 60 Cb 0.13 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1of8 h ASP 60 CO -0.17 0.40 -0.01 0.40 -1.72 0.00 0.00 179.24 178.14 1of8 h ILE 61 N 0.65 1.58 0.00 0.35 2.04 -1.03 0.12 117.51 121.22 1of8 h ILE 61 Ca 0.18 -1.72 -0.01 0.00 1.00 0.00 0.00 64.86 64.31 1of8 h ILE 61 Cb -0.07 2.74 -0.00 0.00 -0.74 0.00 0.00 36.82 38.75 1of8 h ILE 61 CO -0.04 0.45 -0.06 0.16 0.00 0.00 0.00 178.15 178.66 1of8 h ILE 62 N -0.71 0.15 -0.69 -0.67 3.07 -1.00 -2.08 117.51 115.58 1of8 h ILE 62 Ca -0.00 -0.72 0.00 0.00 1.55 0.00 0.00 64.86 65.69 1of8 h ILE 62 Cb 0.74 1.62 0.00 0.00 -0.27 0.00 0.00 36.82 38.91 1of8 h ILE 62 CO 0.00 0.06 0.00 0.35 -1.05 0.00 0.00 178.15 177.51 1of8 n THR 63 N -3.17 1.38 -1.01 0.16 -2.24 -0.53 -0.89 114.28 107.98 1of8 n THR 63 Ca 0.01 -1.09 -0.00 0.00 -2.27 0.00 0.00 64.05 60.69 1of8 n THR 63 Cb 0.36 0.33 -0.00 0.00 -2.10 0.00 0.00 70.33 68.92 1of8 n THR 63 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1of8 n GLY 64 N 1.40 0.42 0.16 3.38 0.00 -0.78 -4.90 105.19 104.87 1of8 n GLY 64 Ca 0.25 -0.08 0.03 0.00 0.00 0.00 0.00 46.02 46.22 1of8 n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1of8 h LYS 65 N 0.72 0.00 -5.44 1.61 1.57 -1.04 -3.45 116.57 110.53 1of8 h LYS 65 Ca -0.01 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.26 1of8 h LYS 65 Cb 0.22 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 32.24 1of8 h LYS 65 CO 0.01 0.50 -0.82 0.34 -0.57 0.00 0.00 179.45 178.91 1of8 s ASP 66 N -6.52 1.81 0.00 0.86 2.15 -0.71 -4.99 116.67 109.27 1of8 s ASP 66 Ca 0.01 -0.29 0.22 0.00 0.43 0.00 0.00 52.55 52.92 1of8 s ASP 66 Cb 0.10 -0.20 0.55 0.00 -0.30 0.00 0.00 42.92 43.07 1of8 s ASP 66 CO 0.72 0.18 1.47 -0.90 -0.17 0.00 0.00 175.17 176.48 1of8 n ASP 67 N 2.66 3.47 -4.77 -0.34 3.85 -1.26 -4.52 116.55 115.64 1of8 n ASP 67 Ca -0.15 -1.98 -0.31 0.00 -0.71 0.00 0.00 54.79 51.65 1of8 n ASP 67 Cb 0.55 -0.36 0.09 0.00 -1.35 0.00 0.00 41.12 40.05 1of8 n ASP 67 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 1of8 s ARG 68 N -1.27 2.14 -0.13 0.11 0.52 -1.26 -4.98 118.95 114.08 1of8 s ARG 68 Ca 0.42 1.04 -0.07 0.00 -0.52 0.00 0.00 55.73 56.60 1of8 s ARG 68 Cb 0.23 -1.89 -0.04 0.00 0.52 0.00 0.00 34.95 33.77 1of8 s ARG 68 CO 0.31 -1.69 0.11 0.08 0.02 0.00 0.00 175.30 174.13 1of8 s VAL 69 N -2.95 5.24 -0.09 3.52 1.01 -0.94 -4.89 120.40 121.31 1of8 s VAL 69 Ca 0.61 0.11 -0.26 0.00 0.00 0.00 0.00 61.98 62.45 1of8 s VAL 69 Cb -0.17 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.89 1of8 s VAL 69 CO 0.56 0.57 0.82 -0.22 0.00 0.00 0.00 175.10 176.83 1of8 s LEU 70 N -0.65 4.27 -0.15 3.92 2.96 -0.12 -1.35 118.68 127.56 1of8 s LEU 70 Ca 0.12 1.30 0.01 0.00 -0.22 0.00 0.00 54.13 55.34 1of8 s LEU 70 Cb -0.12 -3.26 0.02 0.00 0.50 0.00 0.00 46.19 43.33 1of8 s LEU 70 CO 0.02 -0.26 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.95 1of8 s VAL 71 N 1.38 1.65 -0.40 1.68 1.01 -0.05 -0.73 120.40 124.94 1of8 s VAL 71 Ca 0.41 -0.69 -0.11 0.00 0.00 0.00 0.00 61.98 61.60 1of8 s VAL 71 Cb -0.18 -1.53 0.05 0.00 0.00 0.00 0.00 36.38 34.72 1of8 s VAL 71 CO 0.18 0.47 0.24 -0.63 0.00 0.00 0.00 175.10 175.37 1of8 s ILE 72 N 1.41 4.49 -0.01 2.22 -1.09 -0.34 -0.55 121.20 127.32 1of8 s ILE 72 Ca 0.04 -1.10 0.01 0.00 -2.23 0.00 0.00 60.65 57.37 1of8 s ILE 72 Cb -0.13 -3.62 0.01 0.00 -1.58 0.00 0.00 42.46 37.14 1of8 s ILE 72 CO -0.10 -0.38 -0.01 0.54 -1.23 0.00 0.00 174.94 173.76 1of8 s VAL 73 N 1.51 0.19 -5.00 2.92 0.11 -0.41 -1.24 120.40 118.48 1of8 s VAL 73 Ca 0.02 -0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 1of8 s VAL 73 Cb -0.21 -0.22 0.00 0.00 -1.53 0.00 0.00 36.38 34.42 1of8 s VAL 73 CO 0.05 0.10 0.00 0.61 -3.33 0.00 0.00 175.10 172.53 1of8 n GLY 74 N 3.53 -0.86 3.63 6.54 0.00 -0.93 -1.25 105.19 115.85 1of8 n GLY 74 Ca -0.19 -1.49 -0.36 0.00 0.00 0.00 0.00 46.02 43.98 1of8 n GLY 74 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1of8 n PRO 75 N -0.41 0.52 -0.25 1.61 -0.02 0.46 -1.02 135.00 135.90 1of8 n PRO 75 Ca 0.00 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 1of8 n PRO 75 Cb 0.00 -2.27 0.13 0.00 -0.02 0.00 0.00 33.50 31.34 1of8 n PRO 75 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1of8 s SER 77 N -5.55 -0.03 -0.23 0.00 1.04 -1.26 -4.65 113.70 103.01 1of8 s SER 77 Ca -0.13 -0.32 -0.10 0.00 0.48 0.00 0.00 55.95 55.89 1of8 s SER 77 Cb 0.17 0.33 -0.05 0.00 0.10 0.00 0.00 66.02 66.57 1of8 s SER 77 CO 0.76 -0.60 0.14 -0.63 0.98 0.00 0.00 173.24 173.89 1of8 s ILE 78 N -2.70 5.17 0.00 -1.02 -1.09 -0.92 -4.86 121.20 115.77 1of8 s ILE 78 Ca -0.04 0.11 0.00 0.00 -2.23 0.00 0.00 60.65 58.49 1of8 s ILE 78 Cb -0.00 -3.40 0.00 0.00 -1.58 0.00 0.00 42.46 37.47 1of8 s ILE 78 CO -0.04 0.36 0.20 0.00 -1.23 0.00 0.00 174.94 174.22 1of8 n HIS 79 N 4.28 0.00 -3.51 3.97 1.44 -1.26 -4.13 115.22 116.02 1of8 n HIS 79 Ca -0.15 0.00 -0.20 0.00 -2.01 0.00 0.00 57.72 55.36 1of8 n HIS 79 Cb 0.52 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.49 1of8 n HIS 79 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1of8 s ASP 80 N -0.41 1.65 0.31 4.39 -1.08 -1.26 -5.03 116.67 115.24 1of8 s ASP 80 Ca 0.00 -0.37 -0.00 0.00 -0.52 0.00 0.00 52.55 51.66 1of8 s ASP 80 Cb 0.00 0.25 0.48 0.00 -1.46 0.00 0.00 42.92 42.19 1of8 s ASP 80 CO 0.00 -0.34 1.91 -0.07 0.52 0.00 0.00 175.17 177.19 1of8 h LEU 81 N 8.33 0.79 -0.17 -1.34 4.07 -1.97 -1.00 115.31 124.03 1of8 h LEU 81 Ca -0.17 -0.08 -0.13 0.00 0.08 0.00 0.00 57.88 57.59 1of8 h LEU 81 Cb 1.14 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.68 1of8 h LEU 81 CO 0.29 0.67 -0.41 -0.33 -1.08 0.00 0.00 178.44 177.59 1of8 h GLU 82 N 0.88 0.57 -0.60 1.13 5.08 -1.99 -1.64 114.58 118.01 1of8 h GLU 82 Ca 0.22 -0.39 -0.06 0.00 -1.00 0.00 0.00 59.36 58.12 1of8 h GLU 82 Cb 0.09 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 1of8 h GLU 82 CO -0.03 1.01 0.11 0.00 -1.00 0.00 0.00 179.01 179.10 1of8 h ALA 83 N 0.56 1.07 -0.93 3.43 0.00 -1.98 -2.11 119.26 119.31 1of8 h ALA 83 Ca -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1of8 h ALA 83 Cb 1.02 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.53 1of8 h ALA 83 CO 0.09 0.61 0.55 0.00 0.00 0.00 0.00 179.25 180.49 1of8 h ALA 84 N 1.21 1.22 -0.52 0.00 0.00 -1.11 -1.54 119.26 118.53 1of8 h ALA 84 Ca 0.19 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1of8 h ALA 84 Cb 0.37 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1of8 h ALA 84 CO 0.01 0.66 0.02 0.37 0.00 0.00 0.00 179.25 180.31 1of8 h GLN 85 N 1.28 0.90 -0.35 0.00 5.75 -0.89 0.35 115.11 122.16 1of8 h GLN 85 Ca 0.33 -0.28 -0.00 0.00 -0.15 0.00 0.00 58.65 58.55 1of8 h GLN 85 Cb -0.04 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.41 1of8 h GLN 85 CO -0.06 0.92 0.20 1.49 -2.65 0.00 0.00 178.83 178.73 1of8 h GLU 86 N 0.77 0.48 -0.29 1.69 4.81 -1.15 -0.88 114.58 120.02 1of8 h GLU 86 Ca 0.15 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.36 1of8 h GLU 86 Cb 0.49 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.74 1of8 h GLU 86 CO 0.02 0.38 0.08 -0.92 -0.73 0.00 0.00 179.01 177.84 1of8 h TYR 87 N 0.44 0.14 -0.90 0.92 5.03 -1.12 -2.62 116.97 118.87 1of8 h TYR 87 Ca 0.12 0.02 0.04 0.00 2.58 0.00 0.00 58.73 61.49 1of8 h TYR 87 Cb 0.03 -0.02 -0.05 0.00 1.55 0.00 0.00 36.73 38.24 1of8 h TYR 87 CO -0.03 0.06 0.58 0.00 -1.32 0.00 0.00 178.16 177.44 1of8 h ALA 88 N 1.19 1.19 -0.48 1.82 0.00 -0.49 0.11 119.26 122.61 1of8 h ALA 88 Ca 0.13 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1of8 h ALA 88 Cb 0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1of8 h ALA 88 CO -0.15 0.43 -0.04 -0.07 0.00 0.00 0.00 179.25 179.42 1of8 h LEU 89 N 1.12 0.81 -0.39 0.00 3.38 -0.84 0.45 115.31 119.83 1of8 h LEU 89 Ca 0.36 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 1of8 h LEU 89 Cb 0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1of8 h LEU 89 CO -0.12 0.90 0.00 0.03 0.09 0.00 0.00 178.44 179.33 1of8 h ARG 90 N 0.76 0.70 -0.48 1.13 3.08 -1.05 -2.14 114.38 116.39 1of8 h ARG 90 Ca 0.14 -0.22 -0.10 0.00 0.07 0.00 0.00 59.98 59.87 1of8 h ARG 90 Cb 0.52 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 1of8 h ARG 90 CO 0.03 0.79 -0.12 1.25 -1.07 0.00 0.00 179.97 180.85 1of8 h LEU 91 N 0.52 0.87 -0.47 3.04 5.85 -0.58 -1.91 115.31 122.64 1of8 h LEU 91 Ca 0.11 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.51 1of8 h LEU 91 Cb 0.47 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1of8 h LEU 91 CO 0.02 1.00 0.12 0.50 -0.34 0.00 0.00 178.44 179.74 1of8 h LYS 92 N 0.79 0.76 -0.18 1.25 1.63 -0.88 0.25 116.57 120.19 1of8 h LYS 92 Ca 0.13 -0.18 0.01 0.00 -0.85 0.00 0.00 60.65 59.76 1of8 h LYS 92 Cb 0.63 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 32.15 1of8 h LYS 92 CO 0.04 0.74 0.09 -0.22 -3.45 0.00 0.00 179.45 176.65 1of8 h LYS 93 N 0.64 0.18 -0.64 1.90 3.64 -1.21 -0.99 116.57 120.09 1of8 h LYS 93 Ca 0.15 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.46 1of8 h LYS 93 Cb 0.33 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 1of8 h LYS 93 CO 0.00 0.12 0.18 1.25 -2.27 0.00 0.00 179.45 178.73 1of8 h LEU 94 N 0.19 0.93 -0.45 5.20 5.85 -1.19 -2.75 115.31 123.08 1of8 h LEU 94 Ca 0.07 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1of8 h LEU 94 Cb 0.02 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1of8 h LEU 94 CO -0.05 0.88 0.29 -1.28 -0.34 0.00 0.00 178.44 177.94 1of8 h SER 95 N 0.96 0.53 -0.83 1.25 0.87 -0.11 -0.97 113.55 115.24 1of8 h SER 95 Ca 0.21 -0.04 0.08 0.00 -1.23 0.00 0.00 61.79 60.82 1of8 h SER 95 Cb 0.30 -0.13 -0.06 0.00 -0.44 0.00 0.00 62.40 62.07 1of8 h SER 95 CO -0.00 0.41 0.54 0.44 -0.53 0.00 0.00 176.83 177.69 1of8 h ASP 96 N 0.61 0.76 0.12 6.23 3.32 -0.97 0.51 116.42 126.99 1of8 h ASP 96 Ca 0.16 0.01 -0.19 0.00 0.02 0.00 0.00 57.03 57.04 1of8 h ASP 96 Cb -0.04 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.36 1of8 h ASP 96 CO -0.03 0.47 -0.70 -0.08 -1.72 0.00 0.00 179.24 177.17 1of8 h GLU 97 N 0.85 0.52 -0.58 3.56 4.81 -1.14 -3.30 114.58 119.30 1of8 h GLU 97 Ca 0.37 -0.40 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1of8 h GLU 97 Cb 0.34 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1of8 h GLU 97 CO -0.14 1.03 0.00 1.28 -0.73 0.00 0.00 179.01 180.45 1of8 n LEU 98 N -3.88 3.77 0.30 1.64 4.77 -0.42 -4.64 117.00 118.53 1of8 n LEU 98 Ca -0.05 -2.11 0.19 0.00 -0.03 0.00 0.00 56.01 54.01 1of8 n LEU 98 Cb 0.69 -0.43 0.93 0.00 -2.33 0.00 0.00 43.42 42.29 1of8 n LEU 98 CO 0.49 0.87 1.08 0.07 -1.33 0.00 0.00 177.39 178.56 1of8 h LYS 99 N 3.44 0.00 0.00 3.23 2.10 -1.00 -0.90 116.57 123.44 1of8 h LYS 99 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1of8 h LYS 99 Cb 1.00 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.33 1of8 h LYS 99 CO 0.05 0.02 -0.02 0.78 -2.00 0.00 0.00 179.45 178.28 1of8 h GLY 100 N 0.93 0.00 0.00 0.07 0.00 -1.87 -3.35 103.07 98.85 1of8 h GLY 100 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1of8 h GLY 100 CO 0.00 0.00 -0.89 1.22 0.00 0.00 0.00 176.54 176.87 1of8 n ASP 101 N -3.18 4.45 -4.12 0.19 8.00 -0.50 -4.84 116.55 116.54 1of8 n ASP 101 Ca -0.01 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.26 1of8 n ASP 101 Cb 0.19 0.44 -0.15 0.00 -0.02 0.00 0.00 41.12 41.57 1of8 n ASP 101 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1of8 s LEU 102 N -3.70 2.03 -0.33 0.64 1.43 -0.46 -2.21 118.68 116.07 1of8 s LEU 102 Ca 0.00 -0.27 -0.09 0.00 -1.03 0.00 0.00 54.13 52.74 1of8 s LEU 102 Cb 0.00 -0.76 0.01 0.00 0.03 0.00 0.00 46.19 45.47 1of8 s LEU 102 CO 0.00 0.18 0.14 -0.55 0.23 0.00 0.00 176.35 176.35 1of8 s SER 103 N -0.34 5.46 -0.17 2.29 0.15 -0.46 -4.19 113.70 116.44 1of8 s SER 103 Ca 0.06 -0.80 -0.06 0.00 0.70 0.00 0.00 55.95 55.85 1of8 s SER 103 Cb -0.06 -1.96 -0.03 0.00 -1.71 0.00 0.00 66.02 62.26 1of8 s SER 103 CO -0.01 -0.27 0.01 -0.63 1.20 0.00 0.00 173.24 173.55 1of8 s ILE 104 N 1.54 4.33 -0.09 6.45 1.01 -1.26 -0.87 121.20 132.31 1of8 s ILE 104 Ca 0.02 -0.20 0.04 0.00 0.00 0.00 0.00 60.65 60.52 1of8 s ILE 104 Cb -0.18 -2.93 0.00 0.00 0.01 0.00 0.00 42.46 39.36 1of8 s ILE 104 CO 0.05 0.47 -0.23 -0.63 0.00 0.00 0.00 174.94 174.61 1of8 s ILE 105 N 0.39 1.95 0.15 2.92 1.01 0.28 -4.50 121.20 123.40 1of8 s ILE 105 Ca -0.00 -0.96 -0.30 0.00 0.00 0.00 0.00 60.65 59.38 1of8 s ILE 105 Cb -0.13 -1.69 -0.07 0.00 0.01 0.00 0.00 42.46 40.58 1of8 s ILE 105 CO 0.02 0.54 1.04 -0.32 0.00 0.00 0.00 174.94 176.22 1of8 s MET 106 N 0.31 4.64 -0.21 2.79 -2.45 0.10 -1.29 119.30 123.20 1of8 s MET 106 Ca -0.17 1.60 -0.29 0.00 -1.25 0.00 0.00 55.69 55.59 1of8 s MET 106 Cb -0.17 -3.32 -0.03 0.00 1.25 0.00 0.00 34.83 32.56 1of8 s MET 106 CO 0.08 0.13 1.64 1.03 1.05 0.00 0.00 175.02 178.95 1of8 s ARG 107 N -0.17 3.80 -0.55 4.11 0.52 -0.38 -0.88 118.95 125.39 1of8 s ARG 107 Ca 0.49 1.72 0.07 0.00 -0.52 0.00 0.00 55.73 57.48 1of8 s ARG 107 Cb -0.27 -4.05 0.28 0.00 0.52 0.00 0.00 34.95 31.43 1of8 s ARG 107 CO 0.32 -1.29 0.73 0.00 0.02 0.00 0.00 175.30 175.09 1of8 n ALA 108 N 8.47 3.63 -2.67 2.13 0.00 0.20 -3.86 120.51 128.42 1of8 n ALA 108 Ca 0.19 -4.33 -0.42 0.00 0.00 0.00 0.00 53.44 48.88 1of8 n ALA 108 Cb 0.45 -0.85 -0.03 0.00 0.00 0.00 0.00 19.45 19.02 1of8 n ALA 108 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1of8 s TYR 109 N -2.38 3.41 -0.47 0.00 1.51 -1.26 -4.56 117.35 113.60 1of8 s TYR 109 Ca 0.41 1.41 0.22 0.00 -1.01 0.00 0.00 57.07 58.10 1of8 s TYR 109 Cb 0.20 -3.15 -0.25 0.00 -0.11 0.00 0.00 41.96 38.64 1of8 s TYR 109 CO -0.06 -0.33 0.71 1.28 -1.11 0.00 0.00 175.55 176.03 1of8 n LEU 110 N 5.60 0.46 -3.73 -1.29 4.77 -1.26 -2.17 117.00 119.39 1of8 n LEU 110 Ca 0.08 -0.19 -0.18 0.00 -0.03 0.00 0.00 56.01 55.69 1of8 n LEU 110 Cb 0.48 -0.01 -0.17 0.00 -2.33 0.00 0.00 43.42 41.39 1of8 n LEU 110 CO 0.50 0.10 -0.35 -1.61 -1.33 0.00 0.00 177.39 174.70 1of8 s GLU 111 N -3.28 0.03 -0.17 3.23 2.02 -1.26 -2.22 118.70 117.05 1of8 s GLU 111 Ca -0.00 0.26 0.01 0.00 0.02 0.00 0.00 54.97 55.26 1of8 s GLU 111 Cb 0.15 -0.46 0.02 0.00 0.10 0.00 0.00 34.13 33.94 1of8 s GLU 111 CO 0.88 -0.25 -0.20 0.15 0.02 0.00 0.00 175.26 175.86 1of8 s LYS 112 N 1.68 2.90 -0.09 1.61 -0.14 0.62 -4.76 119.74 121.55 1of8 s LYS 112 Ca -0.01 -0.80 -0.29 0.00 -1.36 0.00 0.00 55.97 53.51 1of8 s LYS 112 Cb -0.13 -2.48 -0.02 0.00 -1.68 0.00 0.00 37.83 33.53 1of8 s LYS 112 CO -0.03 -0.17 0.99 -1.25 -0.76 0.00 0.00 175.35 174.12 1of8 s PRO 113 N 1.22 4.44 0.03 -1.68 0.04 -1.26 -4.62 135.00 133.17 1of8 s PRO 113 Ca 0.03 1.37 -0.01 0.00 0.04 0.00 0.00 61.00 62.42 1of8 s PRO 113 Cb -0.13 -3.53 -0.04 0.00 0.04 0.00 0.00 34.50 30.84 1of8 s PRO 113 CO -0.11 -0.27 0.19 1.03 0.04 0.00 0.00 177.00 177.89 1of8 s ARG 114 N 1.84 3.41 0.14 4.56 1.81 -1.26 -5.01 118.95 124.44 1of8 s ARG 114 Ca 0.48 -0.40 -0.17 0.00 -1.72 0.00 0.00 55.73 53.91 1of8 s ARG 114 Cb -0.19 -3.05 -0.01 0.00 -0.45 0.00 0.00 34.95 31.26 1of8 s ARG 114 CO 0.19 0.63 1.79 1.15 -0.68 0.00 0.00 175.30 178.39 1of8 h THR 115 N 2.40 1.05 0.00 0.02 2.02 -2.01 -3.43 112.91 112.96 1of8 h THR 115 Ca -0.47 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1of8 h THR 115 Cb 1.17 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 1of8 h THR 115 CO 0.73 0.07 0.00 0.35 0.37 0.00 0.00 175.52 177.04 1of8 n THR 116 N -4.90 0.00 -4.30 3.16 -2.24 -1.26 -5.16 114.28 99.58 1of8 n THR 116 Ca -0.01 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.61 1of8 n THR 116 Cb 0.04 -0.31 -0.10 0.00 -2.10 0.00 0.00 70.33 67.87 1of8 n THR 116 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1of8 s VAL 117 N 0.00 0.87 0.00 2.28 -7.23 -1.26 -5.15 120.40 109.91 1of8 s VAL 117 Ca 0.00 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.16 1of8 s VAL 117 Cb 0.00 -2.33 0.00 0.00 0.56 0.00 0.00 36.38 34.61 1of8 s VAL 117 CO 0.00 -0.32 0.00 0.61 -0.31 0.00 0.00 175.10 175.08 1of8 n GLY 118 N -0.38 1.57 3.67 2.32 0.00 -1.26 -4.96 105.19 106.15 1of8 n GLY 118 Ca -0.05 -1.50 -0.48 0.00 0.00 0.00 0.00 46.02 43.99 1of8 n GLY 118 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1of8 n TRP 119 N -1.49 2.24 1.19 1.61 -0.00 -1.26 -4.88 117.44 114.85 1of8 n TRP 119 Ca 0.00 0.18 0.12 0.00 -0.00 0.00 0.00 57.50 57.81 1of8 n TRP 119 Cb 0.00 -2.58 0.27 0.00 -0.00 0.00 0.00 31.31 29.00 1of8 n TRP 119 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1of8 n LYS 120 N 4.90 1.11 0.00 5.87 5.02 -1.26 -4.80 118.16 129.00 1of8 n LYS 120 Ca 0.20 -0.76 0.00 0.00 -2.02 0.00 0.00 58.31 55.73 1of8 n LYS 120 Cb 0.28 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 1of8 n LYS 120 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1of8 n GLY 121 N 1.35 0.79 0.33 0.72 0.00 -1.26 -0.28 105.19 106.83 1of8 n GLY 121 Ca 0.12 -2.24 -0.06 0.00 0.00 0.00 0.00 46.02 43.84 1of8 n GLY 121 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1of8 h LEU 122 N 0.00 1.03 -0.19 0.99 5.85 -1.60 -2.17 115.31 119.22 1of8 h LEU 122 Ca 0.00 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.48 1of8 h LEU 122 Cb 0.00 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 1of8 h LEU 122 CO 0.00 0.98 -0.04 0.40 -0.34 0.00 0.00 178.44 179.44 1of8 h ILE 123 N 1.05 1.28 -0.18 4.05 2.04 -1.75 -2.65 117.51 121.35 1of8 h ILE 123 Ca 0.22 -1.00 -0.14 0.00 1.00 0.00 0.00 64.86 64.95 1of8 h ILE 123 Cb 0.33 1.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 1of8 h ILE 123 CO -0.00 0.30 -0.48 -1.13 0.00 0.00 0.00 178.15 176.84 1of8 h ASN 124 N 0.08 0.51 -0.64 1.72 -0.73 -1.78 -3.37 115.58 111.38 1of8 h ASN 124 Ca 0.05 -0.25 -0.27 0.00 1.87 0.00 0.00 56.30 57.70 1of8 h ASN 124 Cb 0.47 -0.15 -0.19 0.00 0.27 0.00 0.00 38.32 38.73 1of8 h ASN 124 CO 0.02 0.91 -0.60 -0.67 -0.37 0.00 0.00 177.43 176.72 1of8 n ASP 125 N -3.98 -2.49 0.26 1.15 2.03 -0.83 -4.03 116.55 108.66 1of8 n ASP 125 Ca -0.02 -3.08 0.10 0.00 0.52 0.00 0.00 54.79 52.30 1of8 n ASP 125 Cb 0.56 1.35 0.68 0.00 -0.72 0.00 0.00 41.12 42.99 1of8 n ASP 125 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1of8 h PRO 126 N 4.33 0.00 -0.00 -0.67 0.13 -1.65 -0.68 132.00 133.46 1of8 h PRO 126 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1of8 h PRO 126 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1of8 h PRO 126 CO 0.27 0.06 -0.06 -0.25 -0.23 0.00 0.00 178.00 177.80 1of8 n ASP 127 N -4.20 0.23 -3.91 1.44 8.00 -1.26 -4.94 116.55 111.90 1of8 n ASP 127 Ca -0.03 -0.36 -0.29 0.00 0.71 0.00 0.00 54.79 54.82 1of8 n ASP 127 Cb 0.15 -0.17 0.02 0.00 -0.02 0.00 0.00 41.12 41.09 1of8 n ASP 127 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1of8 n VAL 128 N -1.13 -2.48 -2.13 2.53 0.31 -0.26 -4.68 118.33 110.49 1of8 n VAL 128 Ca 0.14 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1of8 n VAL 128 Cb 0.26 -2.88 -0.00 0.00 -0.91 0.00 0.00 33.84 30.30 1of8 n VAL 128 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1of8 n ASN 129 N -2.87 0.13 -2.70 4.52 6.94 -1.26 -4.56 115.26 115.47 1of8 n ASN 129 Ca -0.05 -1.80 -0.20 0.00 -0.02 0.00 0.00 54.58 52.52 1of8 n ASN 129 Cb 0.56 -0.12 0.04 0.00 -2.36 0.00 0.00 39.78 37.90 1of8 n ASN 129 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1of8 n ASN 130 N 0.13 -5.57 -0.02 0.53 3.02 -1.26 -4.91 115.26 107.18 1of8 n ASN 130 Ca -0.02 -0.27 0.09 0.00 -0.03 0.00 0.00 54.58 54.35 1of8 n ASN 130 Cb 0.78 -4.38 -0.16 0.00 -0.61 0.00 0.00 39.78 35.40 1of8 n ASN 130 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1of8 n THR 131 N -4.39 0.11 -3.57 3.41 -2.24 -1.26 -5.04 114.28 101.30 1of8 n THR 131 Ca -0.09 -0.51 -0.22 0.00 -2.27 0.00 0.00 64.05 60.97 1of8 n THR 131 Cb 0.60 -0.02 0.08 0.00 -2.10 0.00 0.00 70.33 68.88 1of8 n THR 131 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1of8 n PHE 132 N -2.27 -2.50 -2.62 4.78 3.72 -1.26 -4.86 117.46 112.45 1of8 n PHE 132 Ca -0.06 0.97 -0.43 0.00 -0.05 0.00 0.00 57.45 57.87 1of8 n PHE 132 Cb 0.59 -4.92 0.00 0.00 -0.94 0.00 0.00 39.48 34.21 1of8 n PHE 132 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1of8 n ASN 133 N -3.05 4.95 -0.02 4.37 2.85 -1.26 -4.80 115.26 118.31 1of8 n ASN 133 Ca -0.13 -2.94 -0.00 0.00 -0.11 0.00 0.00 54.58 51.40 1of8 n ASN 133 Cb 0.61 -1.66 0.29 0.00 1.24 0.00 0.00 39.78 40.25 1of8 n ASN 133 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1of8 h ILE 134 N 5.00 1.20 -0.63 -1.44 2.04 -1.77 0.16 117.51 122.06 1of8 h ILE 134 Ca 0.41 -0.76 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 1of8 h ILE 134 Cb 0.83 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 1of8 h ILE 134 CO 1.44 0.26 0.38 0.78 0.00 0.00 0.00 178.15 181.01 1of8 h ASN 135 N 0.54 0.76 -0.48 1.72 2.35 -1.87 0.36 115.58 118.96 1of8 h ASN 135 Ca 0.12 -0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 55.73 1of8 h ASN 135 Cb 0.30 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 1of8 h ASN 135 CO 0.01 0.60 0.04 0.50 -1.65 0.00 0.00 177.43 176.92 1of8 h LYS 136 N 0.85 0.88 -0.67 0.81 3.64 -1.77 -1.95 116.57 118.36 1of8 h LYS 136 Ca 0.23 -0.23 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1of8 h LYS 136 Cb -0.02 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.66 1of8 h LYS 136 CO -0.04 0.85 0.29 0.78 -2.27 0.00 0.00 179.45 179.06 1of8 h GLY 137 N 0.99 1.05 1.08 5.01 0.00 -0.30 0.15 103.07 111.06 1of8 h GLY 137 Ca 0.16 -0.55 -0.11 0.00 0.00 0.00 0.00 47.33 46.84 1of8 h GLY 137 CO 0.02 0.52 -0.06 1.41 0.00 0.00 0.00 176.54 178.42 1of8 h LEU 138 N 0.93 1.03 -0.32 3.11 3.38 -0.84 0.13 115.31 122.73 1of8 h LEU 138 Ca 0.23 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1of8 h LEU 138 Cb 0.17 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1of8 h LEU 138 CO -0.02 1.11 0.17 1.56 0.09 0.00 0.00 178.44 181.35 1of8 h GLN 139 N 0.92 0.44 -0.62 1.13 4.20 -0.95 -0.81 115.11 119.42 1of8 h GLN 139 Ca 0.15 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.77 1of8 h GLN 139 Cb 0.63 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.29 1of8 h GLN 139 CO 0.04 0.39 0.26 0.77 -0.67 0.00 0.00 178.83 179.61 1of8 h SER 140 N 0.39 0.84 -0.14 1.46 0.02 -0.51 -0.56 113.55 115.04 1of8 h SER 140 Ca 0.11 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1of8 h SER 140 Cb 0.08 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 1of8 h SER 140 CO -0.02 0.77 0.08 0.00 -1.14 0.00 0.00 176.83 176.53 1of8 h ALA 141 N 1.10 0.18 -0.48 3.77 0.00 -0.64 0.62 119.26 123.81 1of8 h ALA 141 Ca 0.21 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 1of8 h ALA 141 Cb 0.19 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1of8 h ALA 141 CO -0.02 -0.30 -0.17 -0.09 0.00 0.00 0.00 179.25 178.68 1of8 h ARG 142 N 0.14 0.96 -0.54 0.00 2.43 -0.99 -0.59 114.38 115.80 1of8 h ARG 142 Ca 0.05 -0.39 -0.00 0.00 -0.81 0.00 0.00 59.98 58.82 1of8 h ARG 142 Cb 0.05 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 1of8 h ARG 142 CO -0.01 1.06 0.32 0.37 -1.51 0.00 0.00 179.97 180.20 1of8 h GLN 143 N 0.81 0.73 -0.28 0.20 5.75 -1.01 -0.76 115.11 120.55 1of8 h GLN 143 Ca 0.12 -0.07 0.05 0.00 -0.15 0.00 0.00 58.65 58.59 1of8 h GLN 143 Cb 0.74 -0.15 -0.04 0.00 1.07 0.00 0.00 27.48 29.09 1of8 h GLN 143 CO 0.06 0.54 0.01 1.25 -2.65 0.00 0.00 178.83 178.04 1of8 h LEU 144 N 0.72 -0.08 -0.87 -2.39 5.85 -0.64 0.56 115.31 118.46 1of8 h LEU 144 Ca 0.19 0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.91 1of8 h LEU 144 Cb 0.00 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1of8 h LEU 144 CO -0.03 -0.01 0.18 -0.26 -0.34 0.00 0.00 178.44 177.98 1of8 h PHE 145 N 0.10 1.06 -0.28 1.25 -1.00 -0.69 -0.40 116.94 116.99 1of8 h PHE 145 Ca 0.13 -0.11 -0.02 0.00 2.81 0.00 0.00 57.97 60.79 1of8 h PHE 145 Cb 0.17 -0.31 -0.01 0.00 3.61 0.00 0.00 35.95 39.41 1of8 h PHE 145 CO -0.20 0.86 0.09 0.28 -1.61 0.00 0.00 178.31 177.73 1of8 h VAL 146 N 0.98 1.19 -0.55 -0.55 2.07 -0.92 -1.86 116.25 116.61 1of8 h VAL 146 Ca 0.21 -0.61 0.04 0.00 0.82 0.00 0.00 66.70 67.16 1of8 h VAL 146 Cb 0.32 1.07 -0.05 0.00 -1.52 0.00 0.00 31.29 31.11 1of8 h VAL 146 CO -0.00 0.20 0.29 0.78 0.02 0.00 0.00 177.57 178.86 1of8 h ASN 147 N 0.29 0.43 0.00 0.57 2.35 -0.13 0.14 115.58 119.24 1of8 h ASN 147 Ca 0.09 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1of8 h ASN 147 Cb 0.23 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1of8 h ASN 147 CO -0.00 0.29 -0.00 -0.07 -1.65 0.00 0.00 177.43 176.00 1of8 h LEU 148 N 0.56 -0.00 -1.62 1.61 3.38 -1.07 -3.24 115.31 114.92 1of8 h LEU 148 Ca 0.24 -0.58 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 1of8 h LEU 148 Cb 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1of8 h LEU 148 CO -0.15 0.58 -0.18 0.71 0.09 0.00 0.00 178.44 179.49 1of8 h THR 149 N -0.59 0.63 0.00 0.22 1.35 -1.25 -2.83 112.91 110.44 1of8 h THR 149 Ca -0.00 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 1of8 h THR 149 Cb 0.58 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 1of8 h THR 149 CO 0.00 0.17 0.00 -1.13 -0.25 0.00 0.00 175.52 174.31 1of8 h ASN 150 N 0.00 0.00 -0.25 5.36 -0.73 -0.99 -1.53 115.58 117.44 1of8 h ASN 150 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1of8 h ASN 150 Cb 0.49 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.08 1of8 h ASN 150 CO 0.02 0.00 0.00 2.30 -0.37 0.00 0.00 177.43 179.38 1of8 n ILE 151 N -2.89 0.32 -0.51 2.57 -5.35 -1.07 -4.73 119.36 107.69 1of8 n ILE 151 Ca 0.01 -0.47 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 1of8 n ILE 151 Cb 0.29 0.53 0.00 0.00 -1.74 0.00 0.00 39.64 38.71 1of8 n ILE 151 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1of8 n GLY 152 N 1.23 0.69 3.34 3.28 0.00 -0.57 -5.06 105.19 108.10 1of8 n GLY 152 Ca 0.17 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.34 1of8 n GLY 152 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1of8 s LEU 153 N 0.00 4.30 0.69 0.99 2.96 -1.22 -5.00 118.68 121.40 1of8 s LEU 153 Ca 0.00 -0.93 -0.15 0.00 -0.22 0.00 0.00 54.13 52.83 1of8 s LEU 153 Cb 0.00 -1.93 0.02 0.00 0.50 0.00 0.00 46.19 44.78 1of8 s LEU 153 CO 0.00 -0.30 1.16 -2.84 -1.32 0.00 0.00 176.35 173.05 1of8 s PRO 154 N 1.49 2.50 0.16 0.98 0.02 -1.26 -3.62 135.00 135.27 1of8 s PRO 154 Ca 0.01 1.58 0.07 0.00 0.02 0.00 0.00 61.00 62.68 1of8 s PRO 154 Cb -0.19 -1.90 -0.04 0.00 0.02 0.00 0.00 34.50 32.40 1of8 s PRO 154 CO 0.04 -1.52 -0.15 0.96 -0.33 0.00 0.00 177.00 176.00 1of8 s ILE 155 N -2.14 1.59 0.08 2.83 -4.36 -1.26 -0.72 121.20 117.23 1of8 s ILE 155 Ca 0.71 -1.94 0.02 0.00 -0.26 0.00 0.00 60.65 59.17 1of8 s ILE 155 Cb -0.25 -1.80 -0.04 0.00 1.25 0.00 0.00 42.46 41.63 1of8 s ILE 155 CO 0.43 -0.46 -0.07 -0.83 0.24 0.00 0.00 174.94 174.25 1of8 s GLY 156 N -2.81 0.70 0.07 6.27 0.00 -0.06 -1.07 107.32 110.41 1of8 s GLY 156 Ca 0.15 -1.19 -0.16 0.00 0.00 0.00 0.00 44.72 43.53 1of8 s GLY 156 CO 0.05 -1.28 0.36 -0.45 0.00 0.00 0.00 173.10 171.78 1of8 s SER 157 N -2.64 -0.19 0.02 1.64 0.15 -0.94 -0.63 113.70 111.11 1of8 s SER 157 Ca 0.06 -0.19 -0.30 0.00 0.70 0.00 0.00 55.95 56.21 1of8 s SER 157 Cb 0.01 0.41 -0.05 0.00 -1.71 0.00 0.00 66.02 64.68 1of8 s SER 157 CO -0.03 -0.71 1.22 -0.70 1.20 0.00 0.00 173.24 174.22 1of8 s GLU 158 N -2.98 4.39 -1.10 5.44 2.12 -1.26 -1.52 118.70 123.80 1of8 s GLU 158 Ca -0.02 1.77 -0.16 0.00 0.36 0.00 0.00 54.97 56.91 1of8 s GLU 158 Cb 0.00 -3.43 0.15 0.00 0.26 0.00 0.00 34.13 31.12 1of8 s GLU 158 CO -0.06 -0.34 1.34 -1.64 -0.54 0.00 0.00 175.26 174.02 1of8 s MET 159 N 1.51 3.89 -0.17 4.30 -1.94 0.34 -4.64 119.30 122.58 1of8 s MET 159 Ca 0.59 -2.20 -0.14 0.00 -1.71 0.00 0.00 55.69 52.22 1of8 s MET 159 Cb -0.28 -5.04 -0.09 0.00 2.01 0.00 0.00 34.83 31.42 1of8 s MET 159 CO 0.27 -1.81 -0.07 -0.11 -0.01 0.00 0.00 175.02 173.29 1of8 n LEU 160 N 6.22 1.84 -4.74 -0.03 7.94 -1.26 -4.76 117.00 122.21 1of8 n LEU 160 Ca 0.33 0.53 -0.41 0.00 -1.11 0.00 0.00 56.01 55.35 1of8 n LEU 160 Cb 0.46 -0.89 -0.03 0.00 0.53 0.00 0.00 43.42 43.48 1of8 n LEU 160 CO 0.59 -0.16 0.91 -0.62 -1.11 0.00 0.00 177.39 176.99 1of8 s ASP 161 N -6.20 7.03 0.00 1.96 -1.08 -1.26 -4.94 116.67 112.18 1of8 s ASP 161 Ca -0.22 2.30 0.27 0.00 -0.52 0.00 0.00 52.55 54.39 1of8 s ASP 161 Cb 0.04 -2.61 0.88 0.00 -1.46 0.00 0.00 42.92 39.77 1of8 s ASP 161 CO 0.37 -0.41 1.68 0.35 0.52 0.00 0.00 175.17 177.68 1of8 n THR 162 N 2.37 0.00 -0.11 1.71 -2.24 -1.26 -4.19 114.28 110.55 1of8 n THR 162 Ca 0.04 -0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.63 1of8 n THR 162 Cb 0.44 -0.13 -0.12 0.00 -2.10 0.00 0.00 70.33 68.41 1of8 n THR 162 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1of8 n ILE 163 N -1.50 1.53 0.19 2.28 5.41 -1.26 -4.59 119.36 121.42 1of8 n ILE 163 Ca 0.06 -0.58 0.11 0.00 1.00 0.00 0.00 62.75 63.34 1of8 n ILE 163 Cb 0.34 -1.48 0.64 0.00 -0.71 0.00 0.00 39.64 38.43 1of8 n ILE 163 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1of8 h SER 164 N -0.02 0.02 -0.48 4.38 4.64 -1.99 -2.50 113.55 117.61 1of8 h SER 164 Ca -0.56 -0.00 0.14 0.00 -0.47 0.00 0.00 61.79 60.90 1of8 h SER 164 Cb 1.91 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.98 1of8 h SER 164 CO -0.07 0.02 0.37 -0.65 -0.87 0.00 0.00 176.83 175.62 1of8 h PRO 165 N 0.03 0.00 0.00 4.77 0.11 -1.81 0.55 132.00 135.65 1of8 h PRO 165 Ca 0.06 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.17 1of8 h PRO 165 Cb 0.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.33 1of8 h PRO 165 CO -0.00 0.00 -0.00 1.96 -0.21 0.00 0.00 178.00 179.75 1of8 h GLN 166 N 0.00 0.00 0.00 1.05 1.08 -1.76 0.97 115.11 116.45 1of8 h GLN 166 Ca 0.23 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.43 1of8 h GLN 166 Cb 0.96 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.39 1of8 h GLN 166 CO -0.00 0.00 -0.37 1.88 -0.95 0.00 0.00 178.83 179.39 1of8 h TYR 167 N 0.00 0.00 0.00 2.96 -1.99 -1.07 -3.41 116.97 113.46 1of8 h TYR 167 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1of8 h TYR 167 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 1of8 h TYR 167 CO 0.00 0.00 -0.11 1.28 -0.00 0.00 0.00 178.16 179.33 1of8 n LEU 168 N -2.64 0.00 0.24 3.88 4.77 -0.85 -4.82 117.00 117.58 1of8 n LEU 168 Ca 0.03 -0.08 0.08 0.00 -0.03 0.00 0.00 56.01 56.02 1of8 n LEU 168 Cb 0.50 0.00 0.59 0.00 -2.33 0.00 0.00 43.42 42.18 1of8 n LEU 168 CO 0.35 0.00 0.92 0.00 -1.33 0.00 0.00 177.39 177.33 1of8 h ALA 169 N 0.00 1.50 0.00 -1.18 0.00 -1.07 -1.46 119.26 117.05 1of8 h ALA 169 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1of8 h ALA 169 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1of8 h ALA 169 CO 0.00 0.21 0.00 0.38 0.00 0.00 0.00 179.25 179.84 1of8 h ASP 170 N 0.00 0.00 -0.01 0.00 2.03 -1.91 -2.62 116.42 113.91 1of8 h ASP 170 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1of8 h ASP 170 Cb 0.35 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.85 1of8 h ASP 170 CO 0.02 0.00 -0.42 0.18 -1.03 0.00 0.00 179.24 178.00 1of8 n LEU 171 N -2.89 1.80 -4.82 0.15 4.77 -0.55 -4.86 117.00 110.60 1of8 n LEU 171 Ca -0.02 -0.76 -0.36 0.00 -0.03 0.00 0.00 56.01 54.84 1of8 n LEU 171 Cb 0.09 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.11 1of8 n LEU 171 CO 0.18 0.34 -0.15 -0.69 -1.33 0.00 0.00 177.39 175.74 1of8 s VAL 172 N -2.19 5.44 -0.34 4.08 1.01 -0.99 -4.56 120.40 122.85 1of8 s VAL 172 Ca 0.15 0.25 0.15 0.00 0.00 0.00 0.00 61.98 62.53 1of8 s VAL 172 Cb 0.15 -3.45 -0.20 0.00 0.00 0.00 0.00 36.38 32.88 1of8 s VAL 172 CO 0.49 0.54 0.47 -1.20 0.00 0.00 0.00 175.10 175.41 1of8 n SER 173 N 2.58 1.14 -3.71 3.32 7.64 -0.24 -4.88 113.62 119.47 1of8 n SER 173 Ca -0.18 -0.40 -0.13 0.00 1.01 0.00 0.00 58.87 59.17 1of8 n SER 173 Cb 0.54 1.37 -0.10 0.00 -1.01 0.00 0.00 64.21 65.01 1of8 n SER 173 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1of8 s PHE 174 N -2.74 -0.53 -0.03 1.43 2.19 -1.17 -4.15 117.98 112.98 1of8 s PHE 174 Ca -0.00 1.27 0.06 0.00 0.33 0.00 0.00 56.93 58.59 1of8 s PHE 174 Cb 0.10 0.20 -0.01 0.00 -1.31 0.00 0.00 43.02 42.00 1of8 s PHE 174 CO 0.62 -0.27 -0.23 0.20 1.83 0.00 0.00 175.22 177.37 1of8 s GLY 175 N 0.45 1.14 -0.01 13.12 0.00 -0.62 -2.22 107.32 119.18 1of8 s GLY 175 Ca -0.02 -0.97 -0.01 0.00 0.00 0.00 0.00 44.72 43.73 1of8 s GLY 175 CO -0.02 -0.71 0.09 0.00 0.00 0.00 0.00 173.10 172.46 1of8 s ALA 176 N -0.36 3.63 -0.21 3.20 0.00 -0.57 -0.91 121.76 126.53 1of8 s ALA 176 Ca 0.04 -0.85 -0.05 0.00 0.00 0.00 0.00 51.96 51.10 1of8 s ALA 176 Cb -0.11 -1.63 -0.02 0.00 0.00 0.00 0.00 23.12 21.37 1of8 s ALA 176 CO 0.01 0.69 -0.01 0.42 0.00 0.00 0.00 175.76 176.87 1of8 s ILE 177 N -1.19 3.76 0.83 0.00 -1.09 0.26 -0.50 121.20 123.26 1of8 s ILE 177 Ca 0.23 -0.37 -0.11 0.00 -2.23 0.00 0.00 60.65 58.17 1of8 s ILE 177 Cb -0.12 -2.71 0.09 0.00 -1.58 0.00 0.00 42.46 38.14 1of8 s ILE 177 CO 0.14 0.41 1.10 -0.83 -1.23 0.00 0.00 174.94 174.53 1of8 s GLY 178 N 1.28 1.67 0.37 6.18 0.00 -1.26 -1.78 107.32 113.78 1of8 s GLY 178 Ca 0.04 0.27 0.13 0.00 0.00 0.00 0.00 44.72 45.16 1of8 s GLY 178 CO 0.00 0.66 1.80 0.00 0.00 0.00 0.00 173.10 175.56 1of8 h ALA 179 N -1.37 2.00 0.00 3.20 0.00 -1.79 0.11 119.26 121.41 1of8 h ALA 179 Ca -0.45 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1of8 h ALA 179 Cb 1.25 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1of8 h ALA 179 CO 0.50 -0.35 0.00 0.54 0.00 0.00 0.00 179.25 179.94 1of8 n ARG 180 N -4.64 0.06 0.00 0.00 1.74 -1.26 -3.72 116.66 108.84 1of8 n ARG 180 Ca 0.23 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.36 1of8 n ARG 180 Cb 0.70 -1.57 0.00 0.00 -1.02 0.00 0.00 32.46 30.57 1of8 n ARG 180 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1of8 n THR 181 N -1.67 0.00 -0.06 0.55 -2.24 -0.22 -4.78 114.28 105.86 1of8 n THR 181 Ca 0.07 -0.39 0.11 0.00 -2.27 0.00 0.00 64.05 61.56 1of8 n THR 181 Cb 0.36 1.21 0.50 0.00 -2.10 0.00 0.00 70.33 70.30 1of8 n THR 181 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1of8 h THR 182 N 0.21 0.92 0.00 4.28 2.02 -0.94 -1.91 112.91 117.50 1of8 h THR 182 Ca 0.00 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.04 1of8 h THR 182 Cb 0.11 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1of8 h THR 182 CO 0.00 0.07 -0.02 -0.33 0.37 0.00 0.00 175.52 175.61 1of8 h GLU 183 N 0.41 0.00 -6.33 6.66 5.08 -1.84 -3.43 114.58 115.13 1of8 h GLU 183 Ca 0.25 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 58.07 1of8 h GLU 183 Cb 0.46 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1of8 h GLU 183 CO -0.07 0.00 0.86 0.45 -1.00 0.00 0.00 179.01 179.26 1of8 s SER 184 N -4.80 6.85 0.45 1.42 0.15 -0.72 -4.92 113.70 112.15 1of8 s SER 184 Ca 0.10 2.05 0.13 0.00 0.70 0.00 0.00 55.95 58.94 1of8 s SER 184 Cb 0.11 -2.55 1.03 0.00 -1.71 0.00 0.00 66.02 62.90 1of8 s SER 184 CO 0.61 -0.74 2.03 -0.61 1.20 0.00 0.00 173.24 175.73 1of8 h GLN 185 N 8.06 0.09 -0.54 5.44 4.15 -1.89 -1.81 115.11 128.61 1of8 h GLN 185 Ca -0.36 -0.01 -0.06 0.00 0.77 0.00 0.00 58.65 58.99 1of8 h GLN 185 Cb 1.17 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.82 1of8 h GLN 185 CO 0.92 0.18 0.10 -0.07 -1.93 0.00 0.00 178.83 178.03 1of8 h LEU 186 N 0.09 0.80 -0.04 -2.39 3.38 -1.93 -0.64 115.31 114.57 1of8 h LEU 186 Ca 0.02 -0.16 -0.23 0.00 0.09 0.00 0.00 57.88 57.60 1of8 h LEU 186 Cb 0.20 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1of8 h LEU 186 CO 0.01 0.80 -1.05 0.45 0.09 0.00 0.00 178.44 178.74 1of8 h HIS 187 N 0.81 0.28 -0.57 1.13 3.86 -1.65 -1.13 115.15 117.88 1of8 h HIS 187 Ca 0.17 -0.19 -0.06 0.00 -1.16 0.00 0.00 60.37 59.13 1of8 h HIS 187 Cb 0.34 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.77 1of8 h HIS 187 CO 0.02 1.10 0.11 0.00 0.86 0.00 0.00 177.93 180.02 1of8 h ARG 188 N 0.06 0.93 -0.14 2.45 3.08 -1.12 -0.94 114.38 118.69 1of8 h ARG 188 Ca -0.07 -0.24 0.02 0.00 0.07 0.00 0.00 59.98 59.76 1of8 h ARG 188 Cb 1.76 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 31.68 1of8 h ARG 188 CO 0.16 0.88 0.04 0.93 -1.07 0.00 0.00 179.97 180.91 1of8 h GLU 189 N 0.82 0.10 -0.18 0.04 5.08 -1.09 -1.98 114.58 117.38 1of8 h GLU 189 Ca 0.17 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.57 1of8 h GLU 189 Cb 0.39 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.57 1of8 h GLU 189 CO 0.01 0.07 -0.11 1.25 -1.00 0.00 0.00 179.01 179.23 1of8 h LEU 190 N 0.11 -0.35 -1.60 1.33 5.85 -1.04 -2.36 115.31 117.24 1of8 h LEU 190 Ca 0.06 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1of8 h LEU 190 Cb 0.05 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 1of8 h LEU 190 CO -0.07 -0.14 0.27 0.00 -0.34 0.00 0.00 178.44 178.15 1of8 h ALA 191 N 1.04 1.71 0.00 1.25 0.00 -1.00 -1.82 119.26 120.44 1of8 h ALA 191 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1of8 h ALA 191 Cb 0.25 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1of8 h ALA 191 CO -0.24 0.27 0.00 0.66 0.00 0.00 0.00 179.25 179.94 1of8 h SER 192 N 0.56 0.00 -0.15 0.00 4.64 -0.80 -2.47 113.55 115.33 1of8 h SER 192 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1of8 h SER 192 Cb -0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 1of8 h SER 192 CO -0.03 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.54 1of8 n GLY 193 N -0.66 1.31 3.79 -0.77 0.00 -0.69 -1.77 105.19 106.39 1of8 n GLY 193 Ca -0.00 -0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 1of8 n GLY 193 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1of8 s LEU 194 N -0.86 4.56 -0.23 0.99 1.43 -0.93 -4.97 118.68 118.67 1of8 s LEU 194 Ca 0.14 1.55 0.01 0.00 -1.03 0.00 0.00 54.13 54.80 1of8 s LEU 194 Cb 0.08 -3.24 0.30 0.00 0.03 0.00 0.00 46.19 43.36 1of8 s LEU 194 CO 0.11 0.21 1.52 -1.20 0.23 0.00 0.00 176.35 177.22 1of8 n SER 195 N 1.54 3.81 -3.83 2.29 7.64 -1.26 -4.86 113.62 118.96 1of8 n SER 195 Ca -0.06 -2.80 -0.09 0.00 1.01 0.00 0.00 58.87 56.92 1of8 n SER 195 Cb 0.49 -0.72 -0.05 0.00 -1.01 0.00 0.00 64.21 62.93 1of8 n SER 195 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1of8 s PHE 196 N -1.59 0.06 0.53 1.43 -0.12 -1.26 -5.06 117.98 111.96 1of8 s PHE 196 Ca 0.27 -0.41 -0.22 0.00 -0.05 0.00 0.00 56.93 56.52 1of8 s PHE 196 Cb 0.23 0.27 -0.05 0.00 -0.63 0.00 0.00 43.02 42.84 1of8 s PHE 196 CO 0.04 -0.89 1.31 -2.14 -0.05 0.00 0.00 175.22 173.50 1of8 s PRO 197 N -3.91 3.27 -0.07 1.99 0.02 -1.26 -4.83 135.00 130.21 1of8 s PRO 197 Ca 0.13 2.12 0.02 0.00 0.02 0.00 0.00 61.00 63.29 1of8 s PRO 197 Cb -0.00 -2.28 0.02 0.00 0.02 0.00 0.00 34.50 32.25 1of8 s PRO 197 CO -0.00 -1.05 -0.11 0.08 -0.33 0.00 0.00 177.00 175.59 1of8 s VAL 198 N -1.36 1.03 -0.21 3.83 1.01 -0.84 -1.59 120.40 122.26 1of8 s VAL 198 Ca 0.70 -0.41 -0.09 0.00 0.00 0.00 0.00 61.98 62.19 1of8 s VAL 198 Cb -0.38 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 1of8 s VAL 198 CO 0.44 0.34 0.10 -0.83 0.00 0.00 0.00 175.10 175.15 1of8 s GLY 199 N 0.79 1.91 -0.28 4.51 0.00 -0.09 -1.51 107.32 112.66 1of8 s GLY 199 Ca -0.12 -0.85 -0.11 0.00 0.00 0.00 0.00 44.72 43.63 1of8 s GLY 199 CO 0.02 0.25 0.20 -1.36 0.00 0.00 0.00 173.10 172.21 1of8 s PHE 200 N 0.80 3.22 0.40 1.90 0.08 0.19 -0.57 117.98 123.99 1of8 s PHE 200 Ca 0.05 0.14 -0.25 0.00 0.12 0.00 0.00 56.93 56.99 1of8 s PHE 200 Cb -0.13 -2.39 -0.09 0.00 -0.57 0.00 0.00 43.02 39.84 1of8 s PHE 200 CO 0.02 -0.16 1.14 0.15 -0.10 0.00 0.00 175.22 176.27 1of8 s LYS 201 N 1.78 4.10 1.04 0.44 -0.14 -0.73 -0.72 119.74 125.50 1of8 s LYS 201 Ca 0.08 1.76 -0.12 0.00 -1.36 0.00 0.00 55.97 56.33 1of8 s LYS 201 Cb -0.16 -2.66 0.22 0.00 -1.68 0.00 0.00 37.83 33.55 1of8 s LYS 201 CO 0.11 -0.26 1.08 0.54 -0.76 0.00 0.00 175.35 176.06 1of8 s ASN 202 N -1.23 1.93 0.87 2.83 4.22 -0.60 -4.51 114.94 118.45 1of8 s ASN 202 Ca 0.57 1.78 -0.11 0.00 -2.14 0.00 0.00 52.86 52.95 1of8 s ASN 202 Cb -0.29 -2.40 0.11 0.00 1.28 0.00 0.00 41.25 39.96 1of8 s ASN 202 CO 0.36 -3.65 1.09 -0.83 -2.04 0.00 0.00 177.10 172.03 1of8 s GLY 203 N -2.66 1.63 0.42 0.45 0.00 -0.89 -4.33 107.32 101.96 1of8 s GLY 203 Ca 0.67 0.04 0.30 0.00 0.00 0.00 0.00 44.72 45.73 1of8 s GLY 203 CO 0.61 0.49 1.89 -0.91 0.00 0.00 0.00 173.10 175.19 1of8 h THR 204 N -1.47 0.00 0.00 0.90 1.35 -1.86 0.14 112.91 111.97 1of8 h THR 204 Ca -0.48 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 1of8 h THR 204 Cb 1.27 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 1of8 h THR 204 CO 0.53 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.90 1of8 n ASP 205 N -2.64 0.00 0.00 5.36 5.75 -1.26 -1.48 116.55 122.27 1of8 n ASP 205 Ca 0.00 -0.12 0.00 0.00 -0.01 0.00 0.00 54.79 54.67 1of8 n ASP 205 Cb 0.20 -0.29 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 1of8 n ASP 205 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1of8 n GLY 206 N 1.17 0.78 3.74 6.12 0.00 0.04 -1.61 105.19 115.42 1of8 n GLY 206 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1of8 n GLY 206 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1of8 s THR 207 N -2.22 4.33 -1.13 2.61 -4.23 -1.26 -4.77 115.64 108.98 1of8 s THR 207 Ca 0.00 -0.88 0.21 0.00 -1.18 0.00 0.00 61.69 59.84 1of8 s THR 207 Cb 0.00 -3.09 -0.20 0.00 1.34 0.00 0.00 72.50 70.56 1of8 s THR 207 CO 0.00 0.10 0.93 0.00 -0.54 0.00 0.00 174.62 175.12 1of8 n LEU 208 N 0.43 1.12 -0.31 4.79 -0.00 -1.26 -2.09 117.00 119.68 1of8 n LEU 208 Ca -0.09 -0.52 0.08 0.00 -0.00 0.00 0.00 56.01 55.48 1of8 n LEU 208 Cb 0.52 -0.00 0.25 0.00 -0.00 0.00 0.00 43.42 44.18 1of8 n LEU 208 CO 0.42 0.26 1.13 0.78 -0.00 0.00 0.00 177.39 179.98 1of8 h ASN 209 N 0.31 0.61 0.23 1.45 4.21 -1.99 -0.54 115.58 119.86 1of8 h ASN 209 Ca 0.00 0.09 -0.07 0.00 1.21 0.00 0.00 56.30 57.53 1of8 h ASN 209 Cb 0.53 -0.01 -0.01 0.00 -1.12 0.00 0.00 38.32 37.71 1of8 h ASN 209 CO 0.00 0.25 -0.30 -0.37 -1.29 0.00 0.00 177.43 175.72 1of8 h VAL 210 N 0.68 1.24 -0.08 2.81 -1.51 -1.96 0.25 116.25 117.67 1of8 h VAL 210 Ca 0.49 -1.13 -0.22 0.00 -1.23 0.00 0.00 66.70 64.60 1of8 h VAL 210 Cb 0.69 1.52 0.01 0.00 -2.13 0.00 0.00 31.29 31.39 1of8 h VAL 210 CO -0.36 0.33 -0.85 0.00 -1.23 0.00 0.00 177.57 175.46 1of8 h ALA 211 N 1.60 0.34 -0.27 5.19 0.00 -1.35 -0.79 119.26 123.97 1of8 h ALA 211 Ca 0.01 -0.64 -0.00 0.00 0.00 0.00 0.00 54.91 54.28 1of8 h ALA 211 Cb 0.58 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1of8 h ALA 211 CO 0.04 0.72 0.16 0.28 0.00 0.00 0.00 179.25 180.45 1of8 h VAL 212 N 0.41 1.11 -0.74 0.00 2.07 -1.03 -1.34 116.25 116.74 1of8 h VAL 212 Ca -0.07 -0.27 0.01 0.00 0.82 0.00 0.00 66.70 67.19 1of8 h VAL 212 Cb 1.47 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 1of8 h VAL 212 CO 0.16 0.11 0.49 0.44 0.02 0.00 0.00 177.57 178.79 1of8 h ASP 213 N 0.33 0.84 -0.75 0.57 3.32 -0.95 -2.15 116.42 117.63 1of8 h ASP 213 Ca 0.10 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 1of8 h ASP 213 Cb 0.03 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 1of8 h ASP 213 CO -0.02 0.61 0.26 0.00 -1.72 0.00 0.00 179.24 178.37 1of8 h ALA 214 N 1.27 0.98 -0.75 3.45 0.00 -0.87 -0.56 119.26 122.79 1of8 h ALA 214 Ca 0.27 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1of8 h ALA 214 Cb -0.11 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.36 1of8 h ALA 214 CO -0.06 0.64 0.35 0.00 0.00 0.00 0.00 179.25 180.18 1of8 h GLN 216 N 1.05 -0.25 -0.40 0.00 5.75 -1.09 -2.23 115.11 117.94 1of8 h GLN 216 Ca 0.25 0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.77 1of8 h GLN 216 Cb 0.14 0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 1of8 h GLN 216 CO -0.03 -0.17 0.25 0.00 -2.65 0.00 0.00 178.83 176.23 1of8 h ALA 217 N 0.56 0.51 0.00 3.38 0.00 -0.73 -2.68 119.26 120.31 1of8 h ALA 217 Ca -0.02 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1of8 h ALA 217 Cb 0.22 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1of8 h ALA 217 CO 0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 179.25 179.26 1of8 h ALA 218 N 1.12 1.00 0.00 0.00 0.00 -0.78 -1.96 119.26 118.64 1of8 h ALA 218 Ca 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1of8 h ALA 218 Cb -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1of8 h ALA 218 CO -0.03 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.22 1of8 h ALA 219 N 2.00 1.00 -2.36 0.00 0.00 -1.04 0.10 119.26 118.97 1of8 h ALA 219 Ca -0.00 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.41 1of8 h ALA 219 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1of8 h ALA 219 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 179.25 178.24 1of8 s HIS 220 N -3.34 3.48 0.39 0.00 3.76 -0.74 -3.95 115.29 114.90 1of8 s HIS 220 Ca 0.05 0.83 -0.27 0.00 -0.15 0.00 0.00 55.06 55.52 1of8 s HIS 220 Cb 0.09 -2.27 -0.09 0.00 1.11 0.00 0.00 32.58 31.43 1of8 s HIS 220 CO 0.50 -0.00 1.30 0.45 -0.85 0.00 0.00 174.74 176.14 1of8 s SER 221 N -3.30 6.43 0.08 1.40 0.15 -1.25 -3.48 113.70 113.73 1of8 s SER 221 Ca 0.47 2.66 0.03 0.00 0.70 0.00 0.00 55.95 59.81 1of8 s SER 221 Cb -0.10 -2.64 -0.03 0.00 -1.71 0.00 0.00 66.02 61.53 1of8 s SER 221 CO 0.32 -0.77 -0.09 -1.00 1.20 0.00 0.00 173.24 172.91 1of8 s HIS 222 N -1.23 0.91 -0.09 3.44 3.76 -1.25 -4.93 115.29 115.90 1of8 s HIS 222 Ca 0.55 -0.67 0.02 0.00 -0.15 0.00 0.00 55.06 54.81 1of8 s HIS 222 Cb -0.38 -0.52 0.01 0.00 1.11 0.00 0.00 32.58 32.80 1of8 s HIS 222 CO 0.50 -0.06 -0.15 -1.01 -0.85 0.00 0.00 174.74 173.17 1of8 s HIS 223 N -2.41 1.83 0.08 1.40 3.76 -1.26 -1.09 115.29 117.60 1of8 s HIS 223 Ca 0.02 -0.78 -0.26 0.00 -0.15 0.00 0.00 55.06 53.90 1of8 s HIS 223 Cb -0.03 -1.31 0.08 0.00 1.11 0.00 0.00 32.58 32.43 1of8 s HIS 223 CO -0.01 -0.39 0.81 -0.59 -0.85 0.00 0.00 174.74 173.71 1of8 s PHE 224 N 0.80 -0.35 0.15 1.40 -0.12 -0.62 -4.98 117.98 114.25 1of8 s PHE 224 Ca -0.11 0.15 -0.30 0.00 -0.05 0.00 0.00 56.93 56.62 1of8 s PHE 224 Cb -0.16 0.57 -0.07 0.00 -0.63 0.00 0.00 43.02 42.74 1of8 s PHE 224 CO 0.02 -0.72 1.02 -1.64 -0.05 0.00 0.00 175.22 173.84 1of8 s MET 225 N -3.37 4.67 0.24 1.99 -1.94 -1.26 0.10 119.30 119.72 1of8 s MET 225 Ca 0.05 1.56 -0.14 0.00 -1.71 0.00 0.00 55.69 55.45 1of8 s MET 225 Cb -0.01 -3.33 0.00 0.00 2.01 0.00 0.00 34.83 33.50 1of8 s MET 225 CO -0.07 0.18 0.51 0.20 -0.01 0.00 0.00 175.02 175.82 1of8 s GLY 226 N -0.11 0.36 -0.12 -0.03 0.00 -0.12 -4.89 107.32 102.41 1of8 s GLY 226 Ca 0.48 -0.72 -0.15 0.00 0.00 0.00 0.00 44.72 44.33 1of8 s GLY 226 CO 0.32 -0.52 0.37 0.14 0.00 0.00 0.00 173.10 173.42 1of8 s VAL 227 N -3.98 5.23 0.81 1.40 1.01 -1.26 -0.34 120.40 123.27 1of8 s VAL 227 Ca 0.19 0.73 -0.05 0.00 0.00 0.00 0.00 61.98 62.85 1of8 s VAL 227 Cb -0.01 -3.70 0.17 0.00 0.00 0.00 0.00 36.38 32.83 1of8 s VAL 227 CO 0.07 0.40 1.11 0.42 0.00 0.00 0.00 175.10 177.10 1of8 s THR 228 N 0.24 2.02 0.46 3.92 -4.23 0.09 -4.93 115.64 113.21 1of8 s THR 228 Ca 0.21 -0.44 0.41 0.00 -1.18 0.00 0.00 61.69 60.68 1of8 s THR 228 Cb -0.14 -2.58 0.43 0.00 1.34 0.00 0.00 72.50 71.55 1of8 s THR 228 CO 0.08 0.00 2.24 0.11 -0.54 0.00 0.00 174.62 176.50 1of8 h LYS 229 N -0.92 0.00 -0.10 3.99 1.79 -1.93 -0.91 116.57 118.49 1of8 h LYS 229 Ca -0.37 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.10 1of8 h LYS 229 Cb 1.25 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.90 1of8 h LYS 229 CO 0.36 0.00 0.00 0.72 -1.08 0.00 0.00 179.45 179.45 1of8 n HIS 230 N -3.07 0.12 -0.98 -1.35 8.25 -1.26 -1.24 115.22 115.69 1of8 n HIS 230 Ca -0.02 -0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 1of8 n HIS 230 Cb 0.15 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.26 1of8 n HIS 230 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1of8 n GLY 231 N 1.09 0.49 3.63 -1.41 0.00 -0.35 -4.88 105.19 103.76 1of8 n GLY 231 Ca 0.17 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 1of8 n GLY 231 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1of8 s VAL 232 N -2.00 3.64 0.16 1.61 -7.23 -1.26 -4.85 120.40 110.46 1of8 s VAL 232 Ca 0.00 -1.23 -0.30 0.00 -1.81 0.00 0.00 61.98 58.64 1of8 s VAL 232 Cb 0.00 -2.74 -0.07 0.00 0.56 0.00 0.00 36.38 34.13 1of8 s VAL 232 CO 0.00 0.06 0.98 0.00 -0.31 0.00 0.00 175.10 175.82 1of8 s ALA 233 N -1.37 3.29 0.25 1.32 0.00 -1.26 -0.73 121.76 123.26 1of8 s ALA 233 Ca 0.24 0.62 -0.04 0.00 0.00 0.00 0.00 51.96 52.78 1of8 s ALA 233 Cb -0.11 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 19.72 1of8 s ALA 233 CO 0.16 0.01 0.31 0.00 0.00 0.00 0.00 175.76 176.24 1of8 s ALA 234 N -0.39 0.71 -0.30 0.00 0.00 0.54 -4.94 121.76 117.39 1of8 s ALA 234 Ca 0.46 -1.44 -0.21 0.00 0.00 0.00 0.00 51.96 50.77 1of8 s ALA 234 Cb -0.25 1.26 -0.01 0.00 0.00 0.00 0.00 23.12 24.12 1of8 s ALA 234 CO 0.31 -0.71 0.66 0.42 0.00 0.00 0.00 175.76 176.44 1of8 s ILE 235 N -3.89 4.92 -0.03 0.00 1.01 -1.26 -0.95 121.20 120.99 1of8 s ILE 235 Ca 0.33 0.93 -0.16 0.00 0.00 0.00 0.00 60.65 61.75 1of8 s ILE 235 Cb 0.03 -4.02 -0.05 0.00 0.01 0.00 0.00 42.46 38.43 1of8 s ILE 235 CO 0.14 -0.15 0.44 -0.89 0.00 0.00 0.00 174.94 174.48 1of8 s THR 236 N 2.66 5.06 -0.17 2.92 2.01 0.11 -4.93 115.64 123.31 1of8 s THR 236 Ca 0.26 0.89 0.00 0.00 0.31 0.00 0.00 61.69 63.16 1of8 s THR 236 Cb -0.15 -3.76 0.01 0.00 0.01 0.00 0.00 72.50 68.61 1of8 s THR 236 CO 0.12 0.49 -0.16 -0.89 -0.69 0.00 0.00 174.62 173.49 1of8 s THR 237 N -0.51 2.53 0.36 -0.82 2.01 -1.26 -1.59 115.64 116.37 1of8 s THR 237 Ca 0.24 -0.80 0.07 0.00 0.31 0.00 0.00 61.69 61.52 1of8 s THR 237 Cb -0.16 -2.08 -0.01 0.00 0.01 0.00 0.00 72.50 70.26 1of8 s THR 237 CO 0.13 0.51 0.47 0.42 -0.69 0.00 0.00 174.62 175.45 1of8 s THR 238 N 1.08 3.71 -0.17 -0.82 -4.23 -0.25 -4.98 115.64 109.99 1of8 s THR 238 Ca -0.00 -1.06 0.19 0.00 -1.18 0.00 0.00 61.69 59.65 1of8 s THR 238 Cb -0.14 -3.28 -0.09 0.00 1.34 0.00 0.00 72.50 70.33 1of8 s THR 238 CO -0.05 -0.12 0.89 1.17 -0.54 0.00 0.00 174.62 175.98 1of8 n LYS 239 N -1.65 0.62 0.00 3.99 4.81 -1.25 -3.76 118.16 120.91 1of8 n LYS 239 Ca 0.02 0.16 0.00 0.00 -0.87 0.00 0.00 58.31 57.62 1of8 n LYS 239 Cb 0.59 -1.80 0.00 0.00 0.02 0.00 0.00 35.03 33.83 1of8 n LYS 239 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1of8 n GLY 240 N 1.31 0.99 3.05 3.14 0.00 -0.73 -3.85 105.19 109.10 1of8 n GLY 240 Ca -0.06 -1.59 -0.32 0.00 0.00 0.00 0.00 46.02 44.06 1of8 n GLY 240 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1of8 s ASN 241 N -0.64 4.60 0.00 1.61 3.84 0.36 -4.86 114.94 119.86 1of8 s ASN 241 Ca 0.00 -1.72 0.26 0.00 0.21 0.00 0.00 52.86 51.62 1of8 s ASN 241 Cb 0.00 -1.59 1.58 0.00 -0.55 0.00 0.00 41.25 40.69 1of8 s ASN 241 CO 0.00 -0.27 2.01 -1.84 -2.79 0.00 0.00 177.10 174.20 1of8 n GLU 242 N 4.36 0.98 -1.63 0.43 0.00 -1.26 -3.72 120.64 119.80 1of8 n GLU 242 Ca -0.06 0.00 -0.27 0.00 0.00 0.00 0.00 57.16 56.83 1of8 n GLU 242 Cb 0.42 -1.42 0.06 0.00 0.00 0.00 0.00 31.44 30.50 1of8 n GLU 242 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1of8 n HIS 243 N -0.92 2.83 -3.89 -1.84 8.25 -1.26 -4.91 115.22 113.48 1of8 n HIS 243 Ca 0.20 -2.51 -0.33 0.00 -0.26 0.00 0.00 57.72 54.82 1of8 n HIS 243 Cb 0.09 -0.83 -0.05 0.00 1.12 0.00 0.00 29.99 30.33 1of8 n HIS 243 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1of8 s PHE 245 N -1.33 0.43 0.02 0.00 -0.71 -0.57 -4.46 117.98 111.36 1of8 s PHE 245 Ca 0.27 -0.81 -0.18 0.00 -1.04 0.00 0.00 56.93 55.17 1of8 s PHE 245 Cb -0.13 -0.13 -0.06 0.00 -1.21 0.00 0.00 43.02 41.50 1of8 s PHE 245 CO 0.19 -0.65 0.53 0.08 -1.34 0.00 0.00 175.22 174.02 1of8 s VAL 246 N -3.96 4.89 -0.16 -2.49 1.01 -1.26 -0.64 120.40 117.79 1of8 s VAL 246 Ca 0.16 1.11 -0.02 0.00 0.00 0.00 0.00 61.98 63.23 1of8 s VAL 246 Cb 0.04 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 1of8 s VAL 246 CO -0.02 0.50 -0.09 -0.63 0.00 0.00 0.00 175.10 174.86 1of8 s ILE 247 N -0.68 3.29 -0.33 2.22 1.01 0.10 -1.52 121.20 125.29 1of8 s ILE 247 Ca 0.28 -0.56 -0.18 0.00 0.00 0.00 0.00 60.65 60.19 1of8 s ILE 247 Cb -0.18 -2.43 -0.01 0.00 0.01 0.00 0.00 42.46 39.85 1of8 s ILE 247 CO 0.16 0.49 0.53 -0.76 0.00 0.00 0.00 174.94 175.36 1of8 s LEU 248 N 0.70 4.26 -0.04 2.97 1.43 0.03 -1.56 118.68 126.46 1of8 s LEU 248 Ca -0.04 0.13 0.08 0.00 -1.03 0.00 0.00 54.13 53.26 1of8 s LEU 248 Cb -0.15 -2.63 0.13 0.00 0.03 0.00 0.00 46.19 43.57 1of8 s LEU 248 CO 0.02 -0.45 1.06 -2.11 0.23 0.00 0.00 176.35 175.11 1of8 n ARG 249 N 5.73 0.43 0.00 1.70 -4.01 -1.26 -0.58 116.66 118.67 1of8 n ARG 249 Ca -0.04 -1.60 0.00 0.00 -1.04 0.00 0.00 57.85 55.17 1of8 n ARG 249 Cb 0.49 -0.80 0.00 0.00 -3.04 0.00 0.00 32.46 29.11 1of8 n ARG 249 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1of8 n GLY 250 N -0.43 -0.11 0.00 2.89 0.00 -1.26 -0.99 105.19 105.29 1of8 n GLY 250 Ca 0.06 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.10 1of8 n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1of8 n GLY 251 N 0.00 -0.15 0.35 -0.02 0.00 -0.89 -3.99 105.19 100.49 1of8 n GLY 251 Ca 0.00 -1.32 0.02 0.00 0.00 0.00 0.00 46.02 44.72 1of8 n GLY 251 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1of8 h LYS 252 N 0.13 0.92 0.00 1.61 1.57 -1.25 -1.14 116.57 118.41 1of8 h LYS 252 Ca 0.00 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1of8 h LYS 252 Cb 0.00 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.10 1of8 h LYS 252 CO 0.00 0.61 -0.03 0.87 -0.57 0.00 0.00 179.45 180.33 1of8 h LYS 253 N 0.95 0.00 0.00 3.15 1.79 -1.60 -3.49 116.57 117.37 1of8 h LYS 253 Ca 0.29 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.76 1of8 h LYS 253 Cb -0.02 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.63 1of8 h LYS 253 CO -0.07 0.03 0.00 0.41 -1.08 0.00 0.00 179.45 178.74 1of8 n GLY 254 N -0.47 0.85 3.84 3.86 0.00 -0.43 -5.08 105.19 107.76 1of8 n GLY 254 Ca -0.01 -2.09 -0.32 0.00 0.00 0.00 0.00 46.02 43.60 1of8 n GLY 254 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1of8 s THR 255 N -1.08 4.38 -0.15 2.61 -4.23 -1.26 -2.10 115.64 113.82 1of8 s THR 255 Ca 0.00 0.95 0.23 0.00 -1.18 0.00 0.00 61.69 61.68 1of8 s THR 255 Cb 0.00 -3.66 0.45 0.00 1.34 0.00 0.00 72.50 70.63 1of8 s THR 255 CO 0.00 -0.84 1.15 -0.46 -0.54 0.00 0.00 174.62 173.93 1of8 n ASN 256 N -2.32 1.07 -0.27 3.99 0.23 -1.26 -4.84 115.26 111.86 1of8 n ASN 256 Ca 0.07 -2.02 0.12 0.00 -0.53 0.00 0.00 54.58 52.21 1of8 n ASN 256 Cb 0.54 -0.31 0.12 0.00 -2.08 0.00 0.00 39.78 38.04 1of8 n ASN 256 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1of8 n TYR 257 N -0.17 0.00 -2.14 -2.53 0.18 -1.26 -4.47 117.16 106.76 1of8 n TYR 257 Ca 0.04 0.00 -0.27 0.00 1.88 0.00 0.00 57.90 59.55 1of8 n TYR 257 Cb 0.94 -0.07 0.07 0.00 -0.38 0.00 0.00 39.34 39.90 1of8 n TYR 257 CO 0.00 0.00 0.00 0.16 -2.08 0.00 0.00 176.86 174.94 1of8 s ASP 258 N -2.65 4.82 0.29 9.48 1.47 -1.26 -4.64 116.67 124.18 1of8 s ASP 258 Ca 0.17 0.56 -0.01 0.00 1.18 0.00 0.00 52.55 54.45 1of8 s ASP 258 Cb 0.18 -1.20 0.44 0.00 -0.34 0.00 0.00 42.92 42.00 1of8 s ASP 258 CO 0.63 -1.62 1.87 0.00 0.68 0.00 0.00 175.17 176.73 1of8 h ALA 259 N -0.67 1.29 -0.44 2.11 0.00 -1.94 0.11 119.26 119.72 1of8 h ALA 259 Ca -0.45 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.18 1of8 h ALA 259 Cb 1.31 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1of8 h ALA 259 CO 0.62 0.52 -0.20 0.87 0.00 0.00 0.00 179.25 181.06 1of8 h LYS 260 N 0.84 0.91 -0.63 0.00 1.57 -1.98 -0.08 116.57 117.20 1of8 h LYS 260 Ca 0.20 -0.39 -0.06 0.00 -1.87 0.00 0.00 60.65 58.53 1of8 h LYS 260 Cb 0.19 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 1of8 h LYS 260 CO -0.02 1.04 0.16 0.77 -0.57 0.00 0.00 179.45 180.84 1of8 h SER 261 N 0.74 0.95 -0.43 0.86 0.02 -1.74 -0.63 113.55 113.32 1of8 h SER 261 Ca 0.10 -0.23 -0.03 0.00 -0.84 0.00 0.00 61.79 60.79 1of8 h SER 261 Cb 0.76 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 1of8 h SER 261 CO 0.06 0.93 0.16 0.58 -1.14 0.00 0.00 176.83 177.41 1of8 h VAL 262 N 0.92 1.21 -0.73 2.27 2.07 -0.87 -0.69 116.25 120.43 1of8 h VAL 262 Ca 0.20 -0.66 0.05 0.00 0.82 0.00 0.00 66.70 67.11 1of8 h VAL 262 Cb 0.34 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 1of8 h VAL 262 CO 0.00 0.24 0.44 0.00 0.02 0.00 0.00 177.57 178.27 1of8 h ALA 263 N 1.00 0.97 -0.73 1.67 0.00 -0.79 -0.60 119.26 120.78 1of8 h ALA 263 Ca 0.14 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1of8 h ALA 263 Cb 0.22 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1of8 h ALA 263 CO -0.01 0.18 0.38 1.49 0.00 0.00 0.00 179.25 181.29 1of8 h GLU 264 N 0.83 1.04 -0.20 0.00 4.81 -0.76 -1.51 114.58 118.79 1of8 h GLU 264 Ca 0.31 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.39 1of8 h GLU 264 Cb 0.11 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 1of8 h GLU 264 CO -0.15 0.80 0.10 0.00 -0.73 0.00 0.00 179.01 179.02 1of8 h ALA 265 N 1.19 0.26 -0.93 2.92 0.00 -0.69 -2.88 119.26 119.14 1of8 h ALA 265 Ca 0.25 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.12 1of8 h ALA 265 Cb 0.08 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1of8 h ALA 265 CO -0.04 -0.17 0.61 0.87 0.00 0.00 0.00 179.25 180.52 1of8 h LYS 266 N 0.20 1.11 0.00 0.00 1.57 -0.85 -1.42 116.57 117.18 1of8 h LYS 266 Ca 0.07 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1of8 h LYS 266 Cb 0.13 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.18 1of8 h LYS 266 CO -0.01 0.73 -0.13 0.00 -0.57 0.00 0.00 179.45 179.47 1of8 h ALA 267 N 1.47 1.32 0.00 3.86 0.00 -1.09 -2.72 119.26 122.10 1of8 h ALA 267 Ca 0.37 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1of8 h ALA 267 Cb 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1of8 h ALA 267 CO -0.12 0.17 -0.78 1.96 0.00 0.00 0.00 179.25 180.47 1of8 h GLN 268 N 0.00 0.00 -6.49 0.00 4.20 -1.06 -3.47 115.11 108.29 1of8 h GLN 268 Ca -0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 1of8 h GLN 268 Cb 0.35 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.13 1of8 h GLN 268 CO 0.02 0.00 0.50 -0.51 -0.67 0.00 0.00 178.83 178.17 1of8 s LEU 269 N -5.29 4.39 0.92 1.46 1.43 -1.03 -5.02 118.68 115.54 1of8 s LEU 269 Ca 0.02 1.95 -0.12 0.00 -1.03 0.00 0.00 54.13 54.95 1of8 s LEU 269 Cb 0.10 -3.58 0.15 0.00 0.03 0.00 0.00 46.19 42.88 1of8 s LEU 269 CO 0.76 -0.39 1.09 -2.16 0.23 0.00 0.00 176.35 175.88 1of8 s PRO 270 N 0.84 1.03 0.45 1.29 0.04 -1.26 -4.92 135.00 132.46 1of8 s PRO 270 Ca 0.56 0.81 -0.24 0.00 0.04 0.00 0.00 61.00 62.17 1of8 s PRO 270 Cb -0.28 -1.78 -0.09 0.00 0.04 0.00 0.00 34.50 32.39 1of8 s PRO 270 CO 0.30 -2.40 1.08 0.00 0.04 0.00 0.00 177.00 176.02 1of8 n ALA 271 N -3.99 0.52 -0.31 8.56 0.00 -1.26 -2.07 120.51 121.97 1of8 n ALA 271 Ca 0.07 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1of8 n ALA 271 Cb 0.55 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.86 1of8 n ALA 271 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1of8 n GLY 272 N 1.09 1.08 3.76 0.00 0.00 -1.26 -5.02 105.19 104.84 1of8 n GLY 272 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1of8 n GLY 272 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1of8 s SER 273 N -3.01 5.40 0.65 1.61 0.01 -0.88 -5.04 113.70 112.44 1of8 s SER 273 Ca 0.00 2.31 -0.04 0.00 1.31 0.00 0.00 55.95 59.53 1of8 s SER 273 Cb 0.00 -2.59 0.05 0.00 0.21 0.00 0.00 66.02 63.69 1of8 s SER 273 CO 0.00 -1.44 0.93 0.20 0.41 0.00 0.00 173.24 173.34 1of8 s ASN 274 N -1.65 4.95 0.79 2.44 0.01 -1.26 -5.02 114.94 115.20 1of8 s ASN 274 Ca 0.76 0.26 -0.12 0.00 -0.71 0.00 0.00 52.86 53.04 1of8 s ASN 274 Cb -0.28 -0.98 0.07 0.00 0.41 0.00 0.00 41.25 40.47 1of8 s ASN 274 CO 0.31 -1.45 1.14 -0.83 -1.51 0.00 0.00 177.10 174.76 1of8 s GLY 275 N -4.49 1.92 0.27 0.66 0.00 -0.07 -4.85 107.32 100.77 1of8 s GLY 275 Ca 0.59 0.56 -0.14 0.00 0.00 0.00 0.00 44.72 45.73 1of8 s GLY 275 CO 0.42 0.94 0.68 1.08 0.00 0.00 0.00 173.10 176.22 1of8 s LEU 276 N -5.77 4.15 0.01 0.66 1.43 -0.21 -4.44 118.68 114.51 1of8 s LEU 276 Ca 0.67 1.20 0.07 0.00 -1.03 0.00 0.00 54.13 55.04 1of8 s LEU 276 Cb -0.22 -3.86 -0.03 0.00 0.03 0.00 0.00 46.19 42.11 1of8 s LEU 276 CO 0.52 -0.12 -0.21 -0.32 0.23 0.00 0.00 176.35 176.45 1of8 s MET 277 N -2.72 2.10 -0.21 1.70 -2.45 -0.58 -0.96 119.30 116.17 1of8 s MET 277 Ca 0.50 -0.95 -0.01 0.00 -1.25 0.00 0.00 55.69 53.98 1of8 s MET 277 Cb -0.12 -2.14 0.01 0.00 1.25 0.00 0.00 34.83 33.83 1of8 s MET 277 CO 0.19 0.55 -0.11 0.42 1.05 0.00 0.00 175.02 177.12 1of8 s ILE 278 N -0.80 2.70 -0.23 10.11 1.01 -0.31 -0.79 121.20 132.89 1of8 s ILE 278 Ca 0.12 -0.85 -0.29 0.00 0.00 0.00 0.00 60.65 59.63 1of8 s ILE 278 Cb -0.10 -2.25 0.01 0.00 0.01 0.00 0.00 42.46 40.12 1of8 s ILE 278 CO 0.02 0.39 1.07 -0.62 0.00 0.00 0.00 174.94 175.80 1of8 s ASP 279 N 1.35 7.07 0.44 3.58 3.68 0.25 -1.12 116.67 131.93 1of8 s ASP 279 Ca 0.03 1.40 0.29 0.00 2.13 0.00 0.00 52.55 56.40 1of8 s ASP 279 Cb -0.15 -2.54 0.99 0.00 -1.45 0.00 0.00 42.92 39.77 1of8 s ASP 279 CO -0.07 -0.69 1.82 1.88 0.13 0.00 0.00 175.17 178.24 1of8 h TYR 280 N 7.58 0.00 -3.10 -5.34 -1.99 -1.06 -3.42 116.97 109.64 1of8 h TYR 280 Ca -0.20 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.53 1of8 h TYR 280 Cb 1.07 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.80 1of8 h TYR 280 CO 0.76 0.00 0.00 0.45 -0.00 0.00 0.00 178.16 179.37 1of8 n SER 281 N -2.88 0.37 0.00 3.88 2.88 -1.26 -3.34 113.62 113.27 1of8 n SER 281 Ca 0.02 -0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.46 1of8 n SER 281 Cb 0.36 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 1of8 n SER 281 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1of8 n HIS 282 N -0.08 0.00 0.29 0.66 8.25 -1.26 -1.45 115.22 121.63 1of8 n HIS 282 Ca 0.00 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.62 1of8 n HIS 282 Cb 0.00 0.00 0.90 0.00 1.12 0.00 0.00 29.99 32.01 1of8 n HIS 282 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1of8 h GLY 283 N 0.00 0.00 1.99 -1.41 0.00 -1.34 -2.56 103.07 99.76 1of8 h GLY 283 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1of8 h GLY 283 CO 0.00 0.00 -0.01 0.70 0.00 0.00 0.00 176.54 177.23 1of8 n ASN 284 N -3.58 0.59 -0.96 0.19 3.02 -0.53 -3.11 115.26 110.89 1of8 n ASN 284 Ca -0.02 0.55 0.12 0.00 -0.03 0.00 0.00 54.58 55.20 1of8 n ASN 284 Cb 0.15 -0.71 0.12 0.00 -0.61 0.00 0.00 39.78 38.73 1of8 n ASN 284 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1of8 n SER 285 N -2.06 2.98 -3.77 6.41 7.64 -0.97 -4.86 113.62 119.00 1of8 n SER 285 Ca 0.06 -1.98 -0.26 0.00 1.01 0.00 0.00 58.87 57.70 1of8 n SER 285 Cb 0.41 -0.02 0.04 0.00 -1.01 0.00 0.00 64.21 63.63 1of8 n SER 285 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1of8 n ASN 286 N 1.32 -3.73 -1.14 6.43 3.02 -1.18 -1.45 115.26 118.54 1of8 n ASN 286 Ca 0.15 -0.75 -0.09 0.00 -0.03 0.00 0.00 54.58 53.86 1of8 n ASN 286 Cb 0.59 -4.19 0.00 0.00 -0.61 0.00 0.00 39.78 35.57 1of8 n ASN 286 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1of8 n LYS 287 N -4.57 -1.28 -3.24 3.52 0.00 -1.26 -5.03 118.16 106.30 1of8 n LYS 287 Ca -0.09 0.38 0.03 0.00 -0.00 0.00 0.00 58.31 58.64 1of8 n LYS 287 Cb 0.59 -4.23 -0.02 0.00 -0.00 0.00 0.00 35.03 31.37 1of8 n LYS 287 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1of8 s ASP 288 N -2.75 -1.06 0.58 -5.58 -1.08 -0.53 -5.03 116.67 101.23 1of8 s ASP 288 Ca 0.06 0.82 0.27 0.00 -0.52 0.00 0.00 52.55 53.18 1of8 s ASP 288 Cb -0.03 1.95 1.67 0.00 -1.46 0.00 0.00 42.92 45.06 1of8 s ASP 288 CO 0.07 -0.20 2.17 2.19 0.52 0.00 0.00 175.17 179.93 1of8 h PHE 289 N 7.95 0.00 0.00 -5.34 -5.15 -1.84 -0.94 116.94 111.63 1of8 h PHE 289 Ca -0.19 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.58 1of8 h PHE 289 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.32 1of8 h PHE 289 CO 0.11 0.00 0.00 0.00 -2.00 0.00 0.00 178.31 176.42 1of8 h ARG 290 N 0.00 0.00 0.00 6.09 3.08 -1.93 -2.22 114.38 119.40 1of8 h ARG 290 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1of8 h ARG 290 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 1of8 h ARG 290 CO -0.00 0.00 0.00 -0.91 -1.07 0.00 0.00 179.97 177.99 1of8 h ASN 291 N 0.00 0.00 -0.65 7.04 2.35 -1.44 -3.37 115.58 119.51 1of8 h ASN 291 Ca 0.00 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.76 1of8 h ASN 291 Cb 0.25 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.59 1of8 h ASN 291 CO 0.00 0.00 0.42 1.56 -1.65 0.00 0.00 177.43 177.76 1of8 h GLN 292 N 0.00 0.83 0.00 0.81 4.20 -1.57 -0.64 115.11 118.74 1of8 h GLN 292 Ca 0.00 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 1of8 h GLN 292 Cb 0.74 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 1of8 h GLN 292 CO 0.00 0.55 -0.18 -1.35 -0.67 0.00 0.00 178.83 177.18 1of8 h PRO 293 N 0.85 0.00 -0.37 1.46 0.11 -1.80 -1.32 132.00 130.94 1of8 h PRO 293 Ca 0.25 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.23 1of8 h PRO 293 Cb -0.06 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 1of8 h PRO 293 CO -0.07 0.18 -0.27 0.87 -0.21 0.00 0.00 178.00 178.49 1of8 h LYS 294 N 0.00 0.84 -0.68 1.05 1.57 -1.39 -1.45 116.57 116.51 1of8 h LYS 294 Ca -0.00 -0.41 -0.02 0.00 -1.87 0.00 0.00 60.65 58.35 1of8 h LYS 294 Cb 0.34 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.61 1of8 h LYS 294 CO 0.02 1.05 0.34 0.28 -0.57 0.00 0.00 179.45 180.56 1of8 h VAL 295 N 0.64 1.22 -0.91 0.50 2.07 -0.90 -2.64 116.25 116.23 1of8 h VAL 295 Ca 0.07 -0.62 0.05 0.00 0.82 0.00 0.00 66.70 67.03 1of8 h VAL 295 Cb 0.85 0.38 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 1of8 h VAL 295 CO 0.07 0.26 0.58 -1.13 0.02 0.00 0.00 177.57 177.37 1of8 h ASN 296 N 0.94 0.92 -0.56 0.57 -1.24 -0.98 -0.20 115.58 115.03 1of8 h ASN 296 Ca 0.23 0.01 -0.00 0.00 0.71 0.00 0.00 56.30 57.25 1of8 h ASN 296 Cb 0.10 -0.19 -0.03 0.00 0.73 0.00 0.00 38.32 38.94 1of8 h ASN 296 CO -0.03 0.60 0.35 0.44 -1.29 0.00 0.00 177.43 177.50 1of8 h ASP 297 N 1.07 0.67 -0.22 1.15 3.32 -0.91 0.18 116.42 121.67 1of8 h ASP 297 Ca 0.38 -0.05 -0.15 0.00 0.02 0.00 0.00 57.03 57.24 1of8 h ASP 297 Cb 0.12 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1of8 h ASP 297 CO -0.16 0.52 -0.39 0.58 -1.72 0.00 0.00 179.24 178.07 1of8 h VAL 298 N 0.76 1.29 -0.31 -1.35 2.07 -1.13 -1.77 116.25 115.81 1of8 h VAL 298 Ca 0.20 -1.57 -0.10 0.00 0.82 0.00 0.00 66.70 66.06 1of8 h VAL 298 Cb -0.04 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1of8 h VAL 298 CO -0.04 0.51 -0.19 0.58 0.02 0.00 0.00 177.57 178.45 1of8 h VAL 299 N 0.62 1.30 -0.91 2.57 2.07 -0.85 -2.68 116.25 118.37 1of8 h VAL 299 Ca 0.05 -1.32 0.03 0.00 0.82 0.00 0.00 66.70 66.28 1of8 h VAL 299 Cb 0.95 1.48 -0.05 0.00 -1.52 0.00 0.00 31.29 32.15 1of8 h VAL 299 CO 0.09 0.42 0.59 0.00 0.02 0.00 0.00 177.57 178.69 1of8 h GLU 301 N 1.17 0.32 -0.05 0.00 4.57 -1.20 0.13 114.58 119.52 1of8 h GLU 301 Ca 0.35 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.51 1of8 h GLU 301 Cb -0.05 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.46 1of8 h GLU 301 CO -0.10 0.21 0.03 1.96 -1.18 0.00 0.00 179.01 179.93 1of8 h GLN 302 N 0.33 0.07 0.11 1.92 4.20 -1.11 -2.18 115.11 118.46 1of8 h GLN 302 Ca 0.14 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1of8 h GLN 302 Cb 0.06 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1of8 h GLN 302 CO -0.10 0.15 -0.10 0.82 -0.67 0.00 0.00 178.83 178.93 1of8 h ILE 303 N -0.02 0.77 0.00 2.54 2.04 -0.99 -1.37 117.51 120.47 1of8 h ILE 303 Ca 0.02 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 1of8 h ILE 303 Cb 0.10 0.77 -0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1of8 h ILE 303 CO -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 178.15 178.12 1of8 h ALA 304 N 0.64 1.90 -0.16 1.87 0.00 -0.72 -1.13 119.26 121.65 1of8 h ALA 304 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1of8 h ALA 304 Cb 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1of8 h ALA 304 CO -0.02 0.04 0.00 0.09 0.00 0.00 0.00 179.25 179.36 1of8 n ASN 305 N -4.43 1.69 0.00 0.00 3.02 -0.83 -3.94 115.26 110.77 1of8 n ASN 305 Ca -0.03 -1.71 0.00 0.00 -0.03 0.00 0.00 54.58 52.81 1of8 n ASN 305 Cb 0.12 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 1of8 n ASN 305 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1of8 n GLY 306 N 1.14 1.53 3.58 7.41 0.00 -0.43 -5.05 105.19 113.37 1of8 n GLY 306 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1of8 n GLY 306 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1of8 s GLU 307 N -0.13 3.33 0.01 1.61 2.56 -0.54 -4.86 118.70 120.68 1of8 s GLU 307 Ca 0.00 0.62 0.24 0.00 0.00 0.00 0.00 54.97 55.83 1of8 s GLU 307 Cb 0.00 -4.12 0.36 0.00 2.00 0.00 0.00 34.13 32.37 1of8 s GLU 307 CO 0.00 -1.89 1.31 0.09 -0.56 0.00 0.00 175.26 174.21 1of8 n ASN 308 N 9.62 0.59 0.12 -1.70 3.02 -1.26 -4.05 115.26 121.59 1of8 n ASN 308 Ca 0.14 -0.32 0.13 0.00 -0.03 0.00 0.00 54.58 54.50 1of8 n ASN 308 Cb 0.49 0.38 0.35 0.00 -0.61 0.00 0.00 39.78 40.39 1of8 n ASN 308 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1of8 h ALA 309 N 2.93 0.96 -1.90 5.41 0.00 -1.96 -3.40 119.26 121.30 1of8 h ALA 309 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 1of8 h ALA 309 Cb 0.53 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.20 1of8 h ALA 309 CO 0.00 0.00 0.47 0.42 0.00 0.00 0.00 179.25 180.14 1of8 s ILE 310 N -3.12 4.50 -0.58 0.00 1.01 -1.26 -1.04 121.20 120.71 1of8 s ILE 310 Ca 0.10 0.28 0.09 0.00 0.00 0.00 0.00 60.65 61.11 1of8 s ILE 310 Cb 0.11 -4.46 -0.06 0.00 0.01 0.00 0.00 42.46 38.06 1of8 s ILE 310 CO 0.62 -0.97 0.46 0.35 0.00 0.00 0.00 174.94 175.40 1of8 n THR 311 N 6.15 0.00 -3.75 2.92 -2.24 -0.14 -4.93 114.28 112.28 1of8 n THR 311 Ca 0.01 -0.33 -0.11 0.00 -2.27 0.00 0.00 64.05 61.36 1of8 n THR 311 Cb 0.47 1.04 -0.07 0.00 -2.10 0.00 0.00 70.33 69.68 1of8 n THR 311 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1of8 s GLY 312 N -1.66 -0.11 0.05 3.38 0.00 -0.91 -0.94 107.32 107.13 1of8 s GLY 312 Ca 0.05 -0.12 -0.00 0.00 0.00 0.00 0.00 44.72 44.65 1of8 s GLY 312 CO 0.32 -0.34 -0.04 -1.34 0.00 0.00 0.00 173.10 171.71 1of8 s VAL 313 N -2.99 0.29 -0.03 1.40 -7.23 0.10 -1.16 120.40 110.77 1of8 s VAL 313 Ca -0.02 -1.60 0.03 0.00 -1.81 0.00 0.00 61.98 58.59 1of8 s VAL 313 Cb 0.01 -1.23 -0.00 0.00 0.56 0.00 0.00 36.38 35.72 1of8 s VAL 313 CO -0.06 -0.84 -0.12 -0.32 -0.31 0.00 0.00 175.10 173.45 1of8 s MET 314 N -3.26 1.23 -0.02 4.82 -2.45 -0.28 -1.19 119.30 118.15 1of8 s MET 314 Ca 0.02 -0.42 0.01 0.00 -1.25 0.00 0.00 55.69 54.04 1of8 s MET 314 Cb 0.03 -1.12 0.02 0.00 1.25 0.00 0.00 34.83 35.01 1of8 s MET 314 CO -0.07 0.18 -0.01 0.42 1.05 0.00 0.00 175.02 176.60 1of8 s ILE 315 N 0.07 0.17 -0.41 10.11 1.01 -0.38 -0.46 121.20 131.32 1of8 s ILE 315 Ca -0.02 0.03 -0.16 0.00 0.00 0.00 0.00 60.65 60.51 1of8 s ILE 315 Cb -0.09 -0.23 0.02 0.00 0.01 0.00 0.00 42.46 42.17 1of8 s ILE 315 CO 0.01 0.11 0.34 -1.61 0.00 0.00 0.00 174.94 173.79 1of8 s GLU 316 N 0.68 3.04 -0.00 2.79 2.02 -1.26 -2.19 118.70 123.77 1of8 s GLU 316 Ca -0.07 -0.91 0.00 0.00 0.02 0.00 0.00 54.97 54.02 1of8 s GLU 316 Cb -0.10 -3.97 0.00 0.00 0.10 0.00 0.00 34.13 30.17 1of8 s GLU 316 CO -0.01 -0.77 -0.00 0.45 0.02 0.00 0.00 175.26 174.95 1of8 s SER 317 N 1.72 0.07 0.33 -0.19 0.15 -0.19 -1.61 113.70 113.98 1of8 s SER 317 Ca 0.07 -0.01 0.06 0.00 0.70 0.00 0.00 55.95 56.78 1of8 s SER 317 Cb -0.18 -0.01 -0.03 0.00 -1.71 0.00 0.00 66.02 64.09 1of8 s SER 317 CO 0.11 0.00 0.25 0.21 1.20 0.00 0.00 173.24 175.02 1of8 s ASN 318 N 0.02 1.71 0.12 5.45 3.84 -0.15 -0.40 114.94 125.53 1of8 s ASN 318 Ca -0.00 -1.73 -0.24 0.00 0.21 0.00 0.00 52.86 51.10 1of8 s ASN 318 Cb -0.01 0.54 -0.06 0.00 -0.55 0.00 0.00 41.25 41.17 1of8 s ASN 318 CO -0.00 -1.04 1.67 0.40 -2.79 0.00 0.00 177.10 175.35 1of8 h ILE 319 N 2.13 0.61 -2.84 -5.21 2.04 -1.85 -0.82 117.51 111.58 1of8 h ILE 319 Ca -0.27 0.00 -0.63 0.00 1.00 0.00 0.00 64.86 64.96 1of8 h ILE 319 Cb 1.24 0.61 -0.16 0.00 -0.74 0.00 0.00 36.82 37.77 1of8 h ILE 319 CO 0.40 0.00 -0.78 0.20 0.00 0.00 0.00 178.15 177.97 1of8 s ASN 320 N -4.99 3.69 0.69 1.72 0.01 -0.48 -1.59 114.94 113.99 1of8 s ASN 320 Ca -0.15 -0.85 -0.11 0.00 -0.71 0.00 0.00 52.86 51.05 1of8 s ASN 320 Cb 0.09 -0.38 0.01 0.00 0.41 0.00 0.00 41.25 41.37 1of8 s ASN 320 CO 0.67 0.09 1.08 -1.83 -1.51 0.00 0.00 177.10 175.59 1of8 s GLU 321 N -2.99 2.93 1.53 -0.60 -1.05 -1.26 -4.42 118.70 112.84 1of8 s GLU 321 Ca 0.25 0.45 0.00 0.00 -0.15 0.00 0.00 54.97 55.52 1of8 s GLU 321 Cb -0.07 -2.05 0.00 0.00 -0.44 0.00 0.00 34.13 31.57 1of8 s GLU 321 CO 0.13 -0.97 0.00 0.41 0.95 0.00 0.00 175.26 175.78 1of8 n GLY 322 N -2.95 -1.37 2.78 -3.83 0.00 0.28 -4.86 105.19 95.23 1of8 n GLY 322 Ca 0.07 -1.49 -0.12 0.00 0.00 0.00 0.00 46.02 44.48 1of8 n GLY 322 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1of8 n ASN 323 N 0.13 -1.10 -3.75 1.61 6.94 -1.26 -2.27 115.26 115.57 1of8 n ASN 323 Ca 0.00 -2.58 -0.11 0.00 -0.02 0.00 0.00 54.58 51.87 1of8 n ASN 323 Cb 0.00 2.07 -0.07 0.00 -2.36 0.00 0.00 39.78 39.42 1of8 n ASN 323 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1of8 s GLN 324 N -2.68 0.85 0.75 -3.83 -2.07 -0.30 -4.90 119.66 107.47 1of8 s GLN 324 Ca 0.24 -0.56 -0.11 0.00 -1.82 0.00 0.00 55.36 53.11 1of8 s GLN 324 Cb -0.01 0.37 0.04 0.00 -1.09 0.00 0.00 33.01 32.32 1of8 s GLN 324 CO 0.18 -0.28 1.09 0.20 -1.32 0.00 0.00 175.29 175.15 1of8 s GLY 325 N -2.22 1.64 -0.31 2.60 0.00 -1.26 -4.45 107.32 103.32 1of8 s GLY 325 Ca -0.03 -0.18 -0.13 0.00 0.00 0.00 0.00 44.72 44.39 1of8 s GLY 325 CO -0.05 0.20 0.25 -0.42 0.00 0.00 0.00 173.10 173.08 1of8 s ILE 326 N -3.19 5.27 -0.12 0.90 1.01 -1.26 -4.97 121.20 118.84 1of8 s ILE 326 Ca 0.59 0.05 -0.19 0.00 0.00 0.00 0.00 60.65 61.10 1of8 s ILE 326 Cb -0.13 -3.65 -0.17 0.00 0.01 0.00 0.00 42.46 38.52 1of8 s ILE 326 CO 0.54 0.11 0.51 1.55 0.00 0.00 0.00 174.94 177.65 1of8 h PRO 327 N 8.41 -0.01 0.00 2.79 0.13 -1.94 -3.54 132.00 137.85 1of8 h PRO 327 Ca -0.33 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.53 1of8 h PRO 327 Cb 1.17 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 1of8 h PRO 327 CO 0.61 0.64 -2.02 1.17 -0.23 0.00 0.00 178.00 178.17 1of8 n LYS 331 N -4.68 0.43 0.25 0.86 4.81 -1.26 -5.11 118.16 113.46 1of8 n LYS 331 Ca -0.07 0.12 0.11 0.00 -0.87 0.00 0.00 58.31 57.61 1of8 n LYS 331 Cb 0.31 -1.31 0.67 0.00 0.02 0.00 0.00 35.03 34.72 1of8 n LYS 331 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1of8 h ALA 332 N -0.15 1.30 -0.49 3.14 0.00 -1.98 -2.70 119.26 118.38 1of8 h ALA 332 Ca -0.41 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1of8 h ALA 332 Cb 1.57 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1of8 h ALA 332 CO -0.11 0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.73 1of8 n GLY 333 N -0.63 1.83 3.81 0.00 0.00 -1.26 -4.95 105.19 103.99 1of8 n GLY 333 Ca -0.02 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.03 1of8 n GLY 333 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1of8 s LEU 334 N -1.33 4.45 0.33 0.99 1.43 -1.02 -4.91 118.68 118.62 1of8 s LEU 334 Ca 0.36 1.40 -0.27 0.00 -1.03 0.00 0.00 54.13 54.59 1of8 s LEU 334 Cb 0.22 -3.32 -0.09 0.00 0.03 0.00 0.00 46.19 43.03 1of8 s LEU 334 CO 0.20 0.14 1.13 -0.54 0.23 0.00 0.00 176.35 177.50 1of8 s LYS 335 N -1.57 4.39 0.19 1.70 3.01 -1.26 -5.00 119.74 121.20 1of8 s LYS 335 Ca 0.37 1.81 -0.30 0.00 -1.01 0.00 0.00 55.97 56.84 1of8 s LYS 335 Cb -0.19 -2.95 -0.08 0.00 -1.01 0.00 0.00 37.83 33.60 1of8 s LYS 335 CO 0.22 -0.01 1.24 -0.47 0.51 0.00 0.00 175.35 176.83 1of8 s TYR 336 N -1.30 3.36 -1.02 3.18 5.04 -1.26 -3.69 117.35 121.67 1of8 s TYR 336 Ca 0.50 1.35 0.00 0.00 -2.44 0.00 0.00 57.07 56.48 1of8 s TYR 336 Cb -0.31 -3.49 0.00 0.00 0.35 0.00 0.00 41.96 38.51 1of8 s TYR 336 CO 0.40 -1.45 0.00 0.41 -1.34 0.00 0.00 175.55 173.56 1of8 n GLY 337 N 2.27 0.90 3.19 8.97 0.00 -1.26 -4.80 105.19 114.46 1of8 n GLY 337 Ca 0.05 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 1of8 n GLY 337 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1of8 s VAL 338 N -2.40 1.82 0.39 1.61 1.01 -1.24 -1.38 120.40 120.21 1of8 s VAL 338 Ca 0.00 -0.90 -0.26 0.00 0.00 0.00 0.00 61.98 60.81 1of8 s VAL 338 Cb 0.00 -1.57 -0.11 0.00 0.00 0.00 0.00 36.38 34.70 1of8 s VAL 338 CO 0.00 0.51 1.29 -0.24 0.00 0.00 0.00 175.10 176.66 1of8 n SER 339 N 3.36 2.71 -0.97 3.32 2.88 -1.26 -4.77 113.62 118.90 1of8 n SER 339 Ca -0.19 1.15 0.09 0.00 -1.33 0.00 0.00 58.87 58.59 1of8 n SER 339 Cb 0.53 -1.50 0.21 0.00 -0.75 0.00 0.00 64.21 62.69 1of8 n SER 339 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1of8 n ILE 340 N 0.01 0.78 0.00 2.46 -5.35 -1.26 -1.16 119.36 114.84 1of8 n ILE 340 Ca 0.06 -0.89 0.00 0.00 -0.27 0.00 0.00 62.75 61.65 1of8 n ILE 340 Cb 0.38 0.70 0.00 0.00 -1.74 0.00 0.00 39.64 38.98 1of8 n ILE 340 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1of8 n THR 341 N 1.12 0.00 -2.25 7.28 -2.24 -1.26 -4.85 114.28 112.08 1of8 n THR 341 Ca 0.17 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.60 1of8 n THR 341 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 1of8 n THR 341 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1of8 s ASP 342 N 1.00 5.70 0.34 3.42 1.01 -1.26 -4.73 116.67 122.14 1of8 s ASP 342 Ca 0.00 2.19 -0.28 0.00 0.71 0.00 0.00 52.55 55.17 1of8 s ASP 342 Cb 0.00 -2.58 -0.10 0.00 1.01 0.00 0.00 42.92 41.25 1of8 s ASP 342 CO 0.00 -1.23 1.26 0.00 0.21 0.00 0.00 175.17 175.41 1of8 s ALA 343 N -1.76 3.42 0.22 5.23 0.00 -1.26 -4.68 121.76 122.93 1of8 s ALA 343 Ca 0.73 1.17 0.11 0.00 0.00 0.00 0.00 51.96 53.97 1of8 s ALA 343 Cb -0.24 -3.45 -0.05 0.00 0.00 0.00 0.00 23.12 19.39 1of8 s ALA 343 CO 0.27 -0.58 -0.18 0.00 0.00 0.00 0.00 175.76 175.27 1of8 s ILE 345 N -1.94 3.16 0.97 0.00 -4.36 -0.63 -0.56 121.20 117.84 1of8 s ILE 345 Ca 0.25 0.73 -0.15 0.00 -0.26 0.00 0.00 60.65 61.21 1of8 s ILE 345 Cb -0.07 -3.30 0.19 0.00 1.25 0.00 0.00 42.46 40.53 1of8 s ILE 345 CO 0.13 -0.15 1.25 -0.83 0.24 0.00 0.00 174.94 175.58 1of8 s GLY 346 N -1.76 1.70 0.19 6.27 0.00 -1.26 -0.97 107.32 111.49 1of8 s GLY 346 Ca 0.72 -1.01 -0.10 0.00 0.00 0.00 0.00 44.72 44.34 1of8 s GLY 346 CO 0.27 -0.29 1.72 -0.25 0.00 0.00 0.00 173.10 174.56 1of8 h TRP 347 N -1.68 1.09 -0.35 1.90 2.91 -0.12 -1.64 115.95 118.06 1of8 h TRP 347 Ca -0.45 -0.11 -0.06 0.00 1.13 0.00 0.00 58.89 59.39 1of8 h TRP 347 Cb 1.27 -0.31 -0.01 0.00 -0.51 0.00 0.00 29.16 29.59 1of8 h TRP 347 CO -0.93 0.88 -0.03 0.93 -1.03 0.00 0.00 178.44 178.26 1of8 h GLU 348 N 0.98 0.64 -0.97 2.65 3.07 -1.88 -0.71 114.58 118.37 1of8 h GLU 348 Ca 0.22 -0.22 0.01 0.00 -0.50 0.00 0.00 59.36 58.86 1of8 h GLU 348 Cb 0.30 -0.05 -0.05 0.00 -0.84 0.00 0.00 28.75 28.11 1of8 h GLU 348 CO -0.01 0.78 0.63 1.15 -1.40 0.00 0.00 179.01 180.16 1of8 h THR 349 N 0.45 1.25 -0.55 1.13 2.02 -1.92 -2.68 112.91 112.61 1of8 h THR 349 Ca 0.10 -0.48 0.01 0.00 0.77 0.00 0.00 66.41 66.80 1of8 h THR 349 Cb 0.51 -0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 66.72 1of8 h THR 349 CO 0.02 0.25 0.36 0.74 0.37 0.00 0.00 175.52 177.27 1of8 h THR 350 N 1.32 1.14 -0.56 3.16 2.02 -0.46 -1.00 112.91 118.53 1of8 h THR 350 Ca 0.35 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 67.27 1of8 h THR 350 Cb -0.13 0.33 -0.03 0.00 -1.74 0.00 0.00 68.15 66.58 1of8 h THR 350 CO -0.07 0.14 0.33 -0.08 0.37 0.00 0.00 175.52 176.20 1of8 h GLU 351 N 0.74 0.77 -0.41 6.66 4.81 -0.89 -0.38 114.58 125.88 1of8 h GLU 351 Ca 0.20 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1of8 h GLU 351 Cb -0.08 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.12 1of8 h GLU 351 CO -0.05 0.57 0.26 0.22 -0.73 0.00 0.00 179.01 179.28 1of8 h ASP 352 N 0.76 0.48 -0.41 1.04 -0.00 -1.18 -1.41 116.42 115.71 1of8 h ASP 352 Ca 0.20 -0.03 0.01 0.00 -0.00 0.00 0.00 57.03 57.20 1of8 h ASP 352 Cb 0.00 -0.12 -0.02 0.00 -0.00 0.00 0.00 39.33 39.19 1of8 h ASP 352 CO -0.04 0.37 0.26 0.58 -0.00 0.00 0.00 179.24 180.42 1of8 h VAL 353 N 0.55 1.09 -0.30 2.25 2.07 -0.79 -1.92 116.25 119.20 1of8 h VAL 353 Ca 0.15 -0.18 -0.14 0.00 0.82 0.00 0.00 66.70 67.34 1of8 h VAL 353 Cb -0.03 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1of8 h VAL 353 CO -0.03 0.10 -0.40 -0.07 0.02 0.00 0.00 177.57 177.19 1of8 h LEU 354 N 0.53 0.77 -0.79 2.57 3.38 -0.92 -0.78 115.31 120.08 1of8 h LEU 354 Ca 0.15 -0.35 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 1of8 h LEU 354 Cb -0.05 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 1of8 h LEU 354 CO -0.04 1.07 -0.06 0.03 0.09 0.00 0.00 178.44 179.54 1of8 h ARG 355 N 0.59 0.86 -0.54 1.13 3.08 -1.11 -0.49 114.38 117.90 1of8 h ARG 355 Ca 0.05 -0.27 -0.10 0.00 0.07 0.00 0.00 59.98 59.73 1of8 h ARG 355 Cb 0.94 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.89 1of8 h ARG 355 CO 0.09 0.89 -0.04 0.87 -1.07 0.00 0.00 179.97 180.71 1of8 h LYS 356 N 0.79 0.98 -0.45 0.04 1.57 -1.10 -1.73 116.57 116.67 1of8 h LYS 356 Ca 0.14 -0.33 -0.01 0.00 -1.87 0.00 0.00 60.65 58.57 1of8 h LYS 356 Cb 0.55 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 1of8 h LYS 356 CO 0.03 1.01 0.22 1.25 -0.57 0.00 0.00 179.45 181.39 1of8 h LEU 357 N 0.86 0.58 -0.77 2.94 5.85 -0.83 -1.65 115.31 122.29 1of8 h LEU 357 Ca 0.15 -0.12 0.06 0.00 0.84 0.00 0.00 57.88 58.81 1of8 h LEU 357 Cb 0.59 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 1of8 h LEU 357 CO 0.04 0.54 0.46 0.00 -0.34 0.00 0.00 178.44 179.13 1of8 h ALA 358 N 1.07 1.05 -0.89 1.25 0.00 -0.94 -1.56 119.26 119.24 1of8 h ALA 358 Ca 0.16 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1of8 h ALA 358 Cb 0.11 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1of8 h ALA 358 CO -0.02 0.16 0.58 0.00 0.00 0.00 0.00 179.25 179.98 1of8 h ALA 359 N 1.38 1.35 -0.46 0.00 0.00 -0.90 -1.89 119.26 118.74 1of8 h ALA 359 Ca 0.34 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.07 1of8 h ALA 359 Cb 0.19 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1of8 h ALA 359 CO -0.18 0.60 -0.15 0.00 0.00 0.00 0.00 179.25 179.51 1of8 h ALA 360 N 1.43 0.86 -0.72 0.00 0.00 -0.61 -1.31 119.26 118.91 1of8 h ALA 360 Ca 0.33 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1of8 h ALA 360 Cb -0.13 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.45 1of8 h ALA 360 CO -0.07 0.64 0.45 0.28 0.00 0.00 0.00 179.25 180.55 1of8 h VAL 361 N 0.78 1.20 -0.71 0.00 2.07 -0.81 -0.18 116.25 118.59 1of8 h VAL 361 Ca 0.12 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 1of8 h VAL 361 Cb 0.68 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1of8 h VAL 361 CO 0.05 0.20 0.30 0.03 0.02 0.00 0.00 177.57 178.17 1of8 h ARG 362 N 0.98 1.05 -0.40 1.57 3.08 -1.04 -2.24 114.38 117.38 1of8 h ARG 362 Ca 0.26 -0.18 -0.10 0.00 0.07 0.00 0.00 59.98 60.03 1of8 h ARG 362 Cb -0.07 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.79 1of8 h ARG 362 CO -0.05 0.85 -0.16 0.37 -1.07 0.00 0.00 179.97 179.91 1of8 h GLN 363 N 1.00 0.74 -1.00 0.04 5.75 -0.91 -2.72 115.11 118.02 1of8 h GLN 363 Ca 0.24 -0.26 0.02 0.00 -0.15 0.00 0.00 58.65 58.50 1of8 h GLN 363 Cb 0.18 -0.05 -0.05 0.00 1.07 0.00 0.00 27.48 28.63 1of8 h GLN 363 CO -0.02 0.85 0.66 -0.09 -2.65 0.00 0.00 178.83 177.58 1of8 h ARG 364 N 0.66 1.27 -0.99 1.69 2.43 -0.63 -1.38 114.38 117.43 1of8 h ARG 364 Ca 0.10 -0.08 0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1of8 h ARG 364 Cb 0.64 -0.29 -0.06 0.00 -0.42 0.00 0.00 29.97 29.84 1of8 h ARG 364 CO 0.04 0.84 0.64 0.00 -1.51 0.00 0.00 179.97 179.99 1of8 h ARG 365 N 1.31 1.18 -0.54 0.20 3.08 -1.10 -0.77 114.38 117.73 1of8 h ARG 365 Ca 0.38 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.32 1of8 h ARG 365 Cb -0.08 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 29.68 1of8 h ARG 365 CO -0.10 0.78 0.18 0.93 -1.07 0.00 0.00 179.97 180.69 1of8 h GLU 366 N 1.22 0.84 -0.54 0.04 4.39 -1.11 -2.12 114.58 117.30 1of8 h GLU 366 Ca 0.41 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.87 1of8 h GLU 366 Cb 0.06 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 1of8 h GLU 366 CO -0.14 0.76 0.10 0.28 -1.16 0.00 0.00 179.01 178.84 1of8 h VAL 367 N 0.75 1.23 0.00 3.13 2.07 -0.83 -2.74 116.25 119.86 1of8 h VAL 367 Ca 0.18 -0.88 -0.04 0.00 0.82 0.00 0.00 66.70 66.78 1of8 h VAL 367 Cb 0.26 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1of8 h VAL 367 CO -0.01 0.32 -0.19 0.78 0.02 0.00 0.00 177.57 178.50 1of8 h ASN 368 N 0.80 0.00 0.00 0.57 2.35 -0.84 -3.51 115.58 114.96 1of8 h ASN 368 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1of8 h ASN 368 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 1of8 h ASN 368 CO 0.00 0.19 0.00 0.29 -1.65 0.00 0.00 177.43 176.26