#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 2.66 -3.54 7.34 1.74 -1.26 -4.84 116.66 118.77 1of8 n ARG 24 Ca 0.00 -2.09 -0.41 0.00 -0.77 0.00 0.00 57.85 54.57 1of8 n ARG 24 Cb 0.00 -1.32 -0.11 0.00 -1.02 0.00 0.00 32.46 30.01 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 -1.01 4.89 0.24 0.55 -1.09 -1.26 -4.96 121.20 118.56 1of8 s ILE 25 Ca 0.27 -0.71 0.07 0.00 -2.23 0.00 0.00 60.65 58.04 1of8 s ILE 25 Cb 0.14 -3.70 -0.06 0.00 -1.58 0.00 0.00 42.46 37.27 1of8 s ILE 25 CO 0.19 -0.23 1.55 -0.07 -1.23 0.00 0.00 174.94 175.14 1of8 h LEU 26 N 8.51 0.16 0.00 2.97 3.38 -2.11 -3.48 115.31 124.74 1of8 h LEU 26 Ca -0.27 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1of8 h LEU 26 Cb 1.12 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1of8 h LEU 26 CO 0.69 0.77 0.00 0.61 0.09 0.00 0.00 178.44 180.60 1of8 n GLY 27 N 0.38 0.14 3.16 0.83 0.00 -1.26 -5.14 105.19 103.30 1of8 n GLY 27 Ca -0.02 -0.99 -0.26 0.00 0.00 0.00 0.00 46.02 44.75 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 1.72 0.11 1.61 1.51 -1.26 -5.15 117.35 113.89 1of8 s TYR 28 Ca 0.00 -0.41 0.10 0.00 -1.01 0.00 0.00 57.07 55.74 1of8 s TYR 28 Cb 0.00 -1.13 -0.04 0.00 -0.11 0.00 0.00 41.96 40.68 1of8 s TYR 28 CO 0.00 -0.10 -0.24 -0.51 -1.11 0.00 0.00 175.55 173.59 1of8 s ASP 29 N -0.20 3.50 0.51 2.29 1.01 -1.26 -5.12 116.67 117.40 1of8 s ASP 29 Ca 0.02 -0.65 -0.22 0.00 0.71 0.00 0.00 52.55 52.41 1of8 s ASP 29 Cb -0.09 -0.35 -0.06 0.00 1.01 0.00 0.00 42.92 43.42 1of8 s ASP 29 CO 0.01 0.19 1.20 -2.16 0.21 0.00 0.00 175.17 174.62 1of8 s PRO 30 N -1.94 3.47 -0.07 8.23 0.04 -1.26 -5.02 135.00 138.44 1of8 s PRO 30 Ca 0.15 1.83 0.01 0.00 0.04 0.00 0.00 61.00 63.03 1of8 s PRO 30 Cb -0.10 -2.24 0.02 0.00 0.04 0.00 0.00 34.50 32.22 1of8 s PRO 30 CO 0.07 -0.81 -0.07 -1.17 0.04 0.00 0.00 177.00 175.06 1of8 s LEU 31 N -3.39 1.25 0.41 -3.56 2.96 -1.26 -4.92 118.68 110.17 1of8 s LEU 31 Ca 0.69 -0.21 -0.27 0.00 -0.22 0.00 0.00 54.13 54.12 1of8 s LEU 31 Cb -0.30 -0.65 -0.09 0.00 0.50 0.00 0.00 46.19 45.64 1of8 s LEU 31 CO 0.35 -0.07 1.43 0.00 -1.32 0.00 0.00 176.35 176.74 1of8 s ALA 32 N 1.24 3.38 0.67 5.97 0.00 -1.26 -5.00 121.76 126.76 1of8 s ALA 32 Ca -0.05 1.47 -0.11 0.00 0.00 0.00 0.00 51.96 53.27 1of8 s ALA 32 Cb -0.14 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.39 1of8 s ALA 32 CO -0.02 -1.07 1.05 -1.54 0.00 0.00 0.00 175.76 174.18 1of8 s SER 33 N -0.40 5.64 0.24 0.00 1.04 -1.26 -4.89 113.70 114.07 1of8 s SER 33 Ca 0.57 1.57 -0.05 0.00 0.48 0.00 0.00 55.95 58.51 1of8 s SER 33 Cb -0.44 -2.49 0.37 0.00 0.10 0.00 0.00 66.02 63.56 1of8 s SER 33 CO 0.58 -1.27 1.81 -0.65 0.98 0.00 0.00 173.24 174.69 1of8 h PRO 34 N -0.56 0.77 -0.73 4.02 0.11 -1.82 -1.96 132.00 131.82 1of8 h PRO 34 Ca -0.44 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 1of8 h PRO 34 Cb 1.20 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 1of8 h PRO 34 CO 0.58 0.51 0.25 0.00 -0.21 0.00 0.00 178.00 179.14 1of8 h ALA 35 N 1.43 1.06 -0.19 -0.75 0.00 -1.38 -0.77 119.26 118.67 1of8 h ALA 35 Ca 0.38 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1of8 h ALA 35 Cb 0.31 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1of8 h ALA 35 CO -0.23 0.65 0.06 1.25 0.00 0.00 0.00 179.25 180.98 1of8 h LEU 36 N 1.08 0.28 -1.22 0.00 5.85 -1.72 -2.40 115.31 117.19 1of8 h LEU 36 Ca 0.24 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1of8 h LEU 36 Cb 0.26 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 1of8 h LEU 36 CO -0.01 0.41 0.34 0.25 -0.34 0.00 0.00 178.44 179.09 1of8 h LEU 37 N 0.13 0.79 -1.17 2.25 5.85 -1.04 -1.04 115.31 121.08 1of8 h LEU 37 Ca 0.06 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 1of8 h LEU 37 Cb 0.23 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1of8 h LEU 37 CO -0.00 0.64 -0.30 1.56 -0.34 0.00 0.00 178.44 180.00 1of8 h GLN 38 N 0.89 0.19 -0.08 1.25 4.20 -0.93 -0.31 115.11 120.33 1of8 h GLN 38 Ca 0.23 -0.07 -0.24 0.00 0.06 0.00 0.00 58.65 58.62 1of8 h GLN 38 Cb 0.04 -0.01 0.02 0.00 0.30 0.00 0.00 27.48 27.82 1of8 h GLN 38 CO -0.04 0.48 -0.91 0.28 -0.67 0.00 0.00 178.83 177.98 1of8 h VAL 39 N 0.17 1.28 -0.31 -0.54 2.07 -1.04 -3.17 116.25 114.72 1of8 h VAL 39 Ca 0.02 -2.10 -0.11 0.00 0.82 0.00 0.00 66.70 65.33 1of8 h VAL 39 Cb 0.63 2.17 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 1of8 h VAL 39 CO 0.05 0.66 -0.27 1.56 0.02 0.00 0.00 177.57 179.58 1of8 h GLN 40 N 0.47 0.63 -2.57 1.57 4.20 -0.94 -3.35 115.11 115.12 1of8 h GLN 40 Ca -0.09 -0.26 -0.60 0.00 0.06 0.00 0.00 58.65 57.76 1of8 h GLN 40 Cb 1.55 -0.03 -0.40 0.00 0.30 0.00 0.00 27.48 28.90 1of8 h GLN 40 CO 0.18 0.83 -0.78 -0.89 -0.67 0.00 0.00 178.83 177.51 1of8 n ILE 41 N -4.10 0.49 -2.46 2.54 5.41 -0.15 -5.09 119.36 116.01 1of8 n ILE 41 Ca -0.00 -4.33 -0.36 0.00 1.00 0.00 0.00 62.75 59.06 1of8 n ILE 41 Cb 0.44 -1.97 -0.03 0.00 -0.71 0.00 0.00 39.64 37.37 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 -1.08 3.96 0.38 0.38 0.04 -1.20 -4.68 135.00 132.81 1of8 s PRO 42 Ca 0.31 1.55 -0.25 0.00 0.04 0.00 0.00 61.00 62.65 1of8 s PRO 42 Cb 0.04 -2.40 -0.09 0.00 0.04 0.00 0.00 34.50 32.10 1of8 s PRO 42 CO -0.15 -0.33 1.10 0.00 0.04 0.00 0.00 177.00 177.66 1of8 s ALA 43 N -1.70 3.16 0.65 8.56 0.00 -1.26 -5.01 121.76 126.16 1of8 s ALA 43 Ca 0.62 0.82 -0.11 0.00 0.00 0.00 0.00 51.96 53.29 1of8 s ALA 43 Cb -0.22 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.57 1of8 s ALA 43 CO 0.28 -0.31 1.04 0.95 0.00 0.00 0.00 175.76 177.72 1of8 s THR 44 N -1.49 4.11 0.28 0.00 -4.23 -1.26 -4.92 115.64 108.12 1of8 s THR 44 Ca 0.55 0.60 0.01 0.00 -1.18 0.00 0.00 61.69 61.67 1of8 s THR 44 Cb -0.27 -3.67 0.27 0.00 1.34 0.00 0.00 72.50 70.17 1of8 s THR 44 CO 0.34 -0.86 1.81 -0.65 -0.54 0.00 0.00 174.62 174.72 1of8 h PRO 45 N -0.43 0.84 -0.53 3.99 0.11 -2.00 -1.79 132.00 132.20 1of8 h PRO 45 Ca -0.45 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 1of8 h PRO 45 Cb 1.22 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 1of8 h PRO 45 CO 0.63 0.56 0.26 1.15 -0.21 0.00 0.00 178.00 180.39 1of8 h THR 46 N 0.87 1.19 -0.39 -1.15 2.02 -1.92 -1.31 112.91 112.22 1of8 h THR 46 Ca 0.49 -0.54 0.03 0.00 0.77 0.00 0.00 66.41 67.16 1of8 h THR 46 Cb 0.55 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 1of8 h THR 46 CO -0.29 0.22 0.19 0.28 0.37 0.00 0.00 175.52 176.29 1of8 h SER 47 N 0.71 0.28 -0.50 4.18 0.02 -1.49 0.33 113.55 117.09 1of8 h SER 47 Ca 0.18 0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 61.02 1of8 h SER 47 Cb 0.10 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1of8 h SER 47 CO -0.02 0.21 -0.20 -0.07 -1.14 0.00 0.00 176.83 175.61 1of8 h LEU 48 N 0.40 1.04 -0.74 5.07 3.38 -1.16 -1.32 115.31 121.97 1of8 h LEU 48 Ca 0.16 -0.39 -0.10 0.00 0.09 0.00 0.00 57.88 57.65 1of8 h LEU 48 Cb 0.07 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1of8 h LEU 48 CO -0.11 1.19 -0.13 -0.08 0.09 0.00 0.00 178.44 179.39 1of8 h GLU 49 N 0.88 0.82 -0.24 1.13 4.57 -0.98 -1.85 114.58 118.89 1of8 h GLU 49 Ca 0.12 -0.29 -0.02 0.00 -1.18 0.00 0.00 59.36 57.99 1of8 h GLU 49 Cb 0.78 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.30 1of8 h GLU 49 CO 0.06 0.91 0.09 1.15 -1.18 0.00 0.00 179.01 180.04 1of8 h THR 50 N 0.73 1.18 -0.41 0.32 2.02 -0.68 0.13 112.91 116.20 1of8 h THR 50 Ca 0.12 -0.54 0.02 0.00 0.77 0.00 0.00 66.41 66.78 1of8 h THR 50 Cb 0.64 1.08 -0.03 0.00 -1.74 0.00 0.00 68.15 68.10 1of8 h THR 50 CO 0.04 0.18 0.23 0.00 0.37 0.00 0.00 175.52 176.34 1of8 h ALA 51 N 0.93 0.51 -0.43 6.16 0.00 -1.09 -0.99 119.26 124.35 1of8 h ALA 51 Ca 0.08 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1of8 h ALA 51 Cb 0.19 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1of8 h ALA 51 CO -0.01 -0.11 0.26 1.57 0.00 0.00 0.00 179.25 180.97 1of8 h LYS 52 N 0.47 0.58 -0.58 0.00 2.10 -1.17 -2.23 116.57 115.73 1of8 h LYS 52 Ca 0.17 -0.05 -0.01 0.00 -2.00 0.00 0.00 60.65 58.75 1of8 h LYS 52 Cb 0.03 -0.12 -0.03 0.00 -0.90 0.00 0.00 32.23 31.21 1of8 h LYS 52 CO -0.09 0.42 0.31 -0.09 -2.00 0.00 0.00 179.45 178.00 1of8 h ARG 53 N 0.57 0.82 -0.88 0.07 2.43 -0.74 -1.63 114.38 115.02 1of8 h ARG 53 Ca 0.15 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1of8 h ARG 53 Cb -0.01 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.34 1of8 h ARG 53 CO -0.03 0.64 0.46 0.78 -1.51 0.00 0.00 179.97 180.30 1of8 h GLY 54 N 0.79 1.33 0.94 2.80 0.00 -0.98 0.14 103.07 108.09 1of8 h GLY 54 Ca 0.20 -0.62 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 1of8 h GLY 54 CO -0.03 0.59 -0.03 3.21 0.00 0.00 0.00 176.54 180.29 1of8 h ARG 55 N 1.24 -0.07 -0.51 4.80 3.08 -1.10 -1.23 114.38 120.58 1of8 h ARG 55 Ca 0.31 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.42 1of8 h ARG 55 Cb 0.06 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.08 1of8 h ARG 55 CO -0.05 0.01 0.23 0.00 -1.07 0.00 0.00 179.97 179.09 1of8 h ARG 56 N -0.13 0.43 -0.46 0.04 3.08 -0.81 0.15 114.38 116.69 1of8 h ARG 56 Ca -0.01 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.91 1of8 h ARG 56 Cb 0.11 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1of8 h ARG 56 CO 0.01 0.29 -0.12 0.93 -1.07 0.00 0.00 179.97 180.01 1of8 h GLU 57 N 0.44 0.88 -0.34 0.04 5.08 -0.92 -1.34 114.58 118.43 1of8 h GLU 57 Ca 0.23 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 1of8 h GLU 57 Cb 0.18 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 1of8 h GLU 57 CO -0.19 0.98 0.15 0.00 -1.00 0.00 0.00 179.01 178.95 1of8 h ALA 58 N 0.87 0.44 -0.28 3.43 0.00 -0.89 -2.24 119.26 120.59 1of8 h ALA 58 Ca 0.11 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1of8 h ALA 58 Cb 0.66 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 1of8 h ALA 58 CO 0.05 0.02 0.02 0.82 0.00 0.00 0.00 179.25 180.16 1of8 h ILE 59 N 0.40 0.83 -0.46 0.00 2.04 -0.83 -0.90 117.51 118.59 1of8 h ILE 59 Ca 0.11 -0.04 -0.00 0.00 1.00 0.00 0.00 64.86 65.93 1of8 h ILE 59 Cb 0.15 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1of8 h ILE 59 CO -0.01 0.02 0.27 0.44 0.00 0.00 0.00 178.15 178.87 1of8 h ASP 60 N 0.12 0.55 0.03 1.72 3.32 -1.08 -1.40 116.42 119.67 1of8 h ASP 60 Ca 0.13 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 1of8 h ASP 60 Cb 0.16 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1of8 h ASP 60 CO -0.20 0.43 -0.01 0.40 -1.72 0.00 0.00 179.24 178.13 1of8 h ILE 61 N 0.64 1.43 0.00 0.35 2.04 -1.00 0.18 117.51 121.14 1of8 h ILE 61 Ca 0.17 -1.66 -0.03 0.00 1.00 0.00 0.00 64.86 64.34 1of8 h ILE 61 Cb -0.02 2.50 -0.00 0.00 -0.74 0.00 0.00 36.82 38.56 1of8 h ILE 61 CO -0.03 0.41 -0.13 0.16 0.00 0.00 0.00 178.15 178.56 1of8 h ILE 62 N -0.79 0.40 -0.58 -0.67 3.07 -1.04 -2.12 117.51 115.78 1of8 h ILE 62 Ca -0.00 -0.72 0.00 0.00 1.55 0.00 0.00 64.86 65.68 1of8 h ILE 62 Cb 0.70 1.52 0.00 0.00 -0.27 0.00 0.00 36.82 38.77 1of8 h ILE 62 CO 0.01 0.12 0.00 0.35 -1.05 0.00 0.00 178.15 177.58 1of8 n THR 63 N -3.38 0.77 -1.00 0.16 -2.24 -0.54 -0.95 114.28 107.09 1of8 n THR 63 Ca -0.01 -0.79 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 1of8 n THR 63 Cb 0.32 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 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 1.45 0.54 0.10 3.38 0.00 -0.80 -4.90 105.19 104.96 1of8 n GLY 64 Ca 0.20 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.18 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 1.19 0.00 -5.94 1.61 1.57 -0.92 -3.45 116.57 110.63 1of8 h LYS 65 Ca 0.00 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.17 1of8 h LYS 65 Cb 0.02 0.00 -0.30 0.00 0.08 0.00 0.00 32.23 32.03 1of8 h LYS 65 CO 0.00 0.81 -0.86 0.34 -0.57 0.00 0.00 179.45 179.17 1of8 s ASP 66 N -6.76 2.48 0.00 0.86 2.15 -0.66 -5.00 116.67 109.74 1of8 s ASP 66 Ca -0.00 -0.39 0.19 0.00 0.43 0.00 0.00 52.55 52.78 1of8 s ASP 66 Cb 0.11 -0.38 0.52 0.00 -0.30 0.00 0.00 42.92 42.88 1of8 s ASP 66 CO 0.79 0.24 1.43 -0.90 -0.17 0.00 0.00 175.17 176.56 1of8 n ASP 67 N 2.69 2.59 -4.78 -0.34 5.68 -1.26 -4.53 116.55 116.60 1of8 n ASP 67 Ca -0.16 -1.92 -0.31 0.00 -0.50 0.00 0.00 54.79 51.90 1of8 n ASP 67 Cb 0.53 -0.26 0.08 0.00 -1.14 0.00 0.00 41.12 40.33 1of8 n ASP 67 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1of8 s ARG 68 N -1.48 2.34 -0.14 0.11 0.52 -1.26 -4.98 118.95 114.05 1of8 s ARG 68 Ca 0.34 1.00 -0.09 0.00 -0.52 0.00 0.00 55.73 56.47 1of8 s ARG 68 Cb 0.19 -1.92 -0.04 0.00 0.52 0.00 0.00 34.95 33.69 1of8 s ARG 68 CO 0.26 -1.54 0.15 0.08 0.02 0.00 0.00 175.30 174.27 1of8 s VAL 69 N -2.98 5.45 -0.10 3.52 1.01 -0.88 -4.88 120.40 121.53 1of8 s VAL 69 Ca 0.60 0.24 -0.26 0.00 0.00 0.00 0.00 61.98 62.56 1of8 s VAL 69 Cb -0.16 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 1of8 s VAL 69 CO 0.56 0.55 0.86 -0.22 0.00 0.00 0.00 175.10 176.84 1of8 s LEU 70 N -0.50 4.26 -0.17 3.92 2.96 0.15 -1.08 118.68 128.21 1of8 s LEU 70 Ca 0.13 1.33 0.01 0.00 -0.22 0.00 0.00 54.13 55.38 1of8 s LEU 70 Cb -0.12 -3.31 0.02 0.00 0.50 0.00 0.00 46.19 43.28 1of8 s LEU 70 CO 0.02 -0.32 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.86 1of8 s VAL 71 N 1.60 1.93 -0.40 1.68 1.01 0.24 -0.73 120.40 125.74 1of8 s VAL 71 Ca 0.42 -0.86 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 1of8 s VAL 71 Cb -0.18 -1.76 0.05 0.00 0.00 0.00 0.00 36.38 34.49 1of8 s VAL 71 CO 0.17 0.52 0.24 -0.63 0.00 0.00 0.00 175.10 175.41 1of8 s ILE 72 N 1.29 4.53 -0.01 2.22 -1.09 -0.38 -0.57 121.20 127.18 1of8 s ILE 72 Ca 0.04 -1.05 0.00 0.00 -2.23 0.00 0.00 60.65 57.41 1of8 s ILE 72 Cb -0.13 -3.63 0.01 0.00 -1.58 0.00 0.00 42.46 37.14 1of8 s ILE 72 CO -0.11 -0.36 -0.01 0.54 -1.23 0.00 0.00 174.94 173.77 1of8 s VAL 73 N 1.52 0.14 -5.00 2.92 0.11 -0.41 -1.21 120.40 118.47 1of8 s VAL 73 Ca 0.02 0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.10 1of8 s VAL 73 Cb -0.21 -0.18 0.00 0.00 -1.53 0.00 0.00 36.38 34.46 1of8 s VAL 73 CO 0.05 0.09 0.00 0.61 -3.33 0.00 0.00 175.10 172.52 1of8 n GLY 74 N 3.61 -0.84 3.64 6.54 0.00 -0.89 -1.15 105.19 116.10 1of8 n GLY 74 Ca -0.20 -1.38 -0.35 0.00 0.00 0.00 0.00 46.02 44.09 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 0.00 0.32 -0.21 1.61 -0.02 0.20 -0.68 135.00 136.23 1of8 n PRO 75 Ca 0.00 0.18 -0.04 0.00 -2.02 0.00 0.00 63.50 61.62 1of8 n PRO 75 Cb 0.00 -2.30 0.06 0.00 -0.02 0.00 0.00 33.50 31.24 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 -5.65 0.04 -0.26 0.00 1.04 -1.26 -4.66 113.70 102.95 1of8 s SER 77 Ca -0.13 -0.37 -0.11 0.00 0.48 0.00 0.00 55.95 55.82 1of8 s SER 77 Cb 0.14 0.29 -0.05 0.00 0.10 0.00 0.00 66.02 66.50 1of8 s SER 77 CO 0.75 -0.55 0.20 -0.63 0.98 0.00 0.00 173.24 173.99 1of8 s ILE 78 N -2.55 5.32 0.00 -1.02 -1.09 -0.85 -4.87 121.20 116.14 1of8 s ILE 78 Ca -0.05 0.23 0.00 0.00 -2.23 0.00 0.00 60.65 58.59 1of8 s ILE 78 Cb -0.01 -3.54 0.00 0.00 -1.58 0.00 0.00 42.46 37.33 1of8 s ILE 78 CO -0.04 0.28 0.46 0.00 -1.23 0.00 0.00 174.94 174.42 1of8 n HIS 79 N 4.73 0.00 -3.39 3.97 1.44 -1.26 -4.18 115.22 116.53 1of8 n HIS 79 Ca -0.14 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.44 1of8 n HIS 79 Cb 0.52 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.54 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 -0.01 0.80 0.32 4.39 -1.08 -1.26 -5.03 116.67 114.79 1of8 s ASP 80 Ca 0.00 -0.12 0.03 0.00 -0.52 0.00 0.00 52.55 51.94 1of8 s ASP 80 Cb 0.00 0.82 0.54 0.00 -1.46 0.00 0.00 42.92 42.82 1of8 s ASP 80 CO 0.00 -0.33 1.85 -0.07 0.52 0.00 0.00 175.17 177.14 1of8 h LEU 81 N 8.23 0.55 -0.14 -1.34 4.07 -1.98 -1.44 115.31 123.26 1of8 h LEU 81 Ca -0.17 -0.11 -0.10 0.00 0.08 0.00 0.00 57.88 57.58 1of8 h LEU 81 Cb 1.14 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.74 1of8 h LEU 81 CO 0.29 0.62 -0.32 -0.08 -1.08 0.00 0.00 178.44 177.87 1of8 h GLU 82 N 0.55 0.46 -0.55 1.13 4.81 -1.99 -1.47 114.58 117.51 1of8 h GLU 82 Ca 0.12 -0.31 -0.03 0.00 -0.13 0.00 0.00 59.36 59.01 1of8 h GLU 82 Cb 0.37 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 1of8 h GLU 82 CO 0.01 0.92 0.22 0.00 -0.73 0.00 0.00 179.01 179.43 1of8 h ALA 83 N 0.53 1.34 -0.69 2.92 0.00 -1.98 -1.34 119.26 120.05 1of8 h ALA 83 Ca -0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1of8 h ALA 83 Cb 0.92 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1of8 h ALA 83 CO 0.07 0.49 0.16 0.00 0.00 0.00 0.00 179.25 179.97 1of8 h ALA 84 N 1.45 0.97 -0.54 0.00 0.00 -1.11 -1.47 119.26 118.56 1of8 h ALA 84 Ca 0.19 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1of8 h ALA 84 Cb 0.16 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1of8 h ALA 84 CO -0.02 0.66 -0.09 0.37 0.00 0.00 0.00 179.25 180.17 1of8 h GLN 85 N 1.05 1.00 -0.27 0.00 5.75 -0.50 0.45 115.11 122.58 1of8 h GLN 85 Ca 0.22 -0.36 -0.04 0.00 -0.15 0.00 0.00 58.65 58.32 1of8 h GLN 85 Cb 0.38 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.85 1of8 h GLN 85 CO 0.00 1.04 0.03 1.49 -2.65 0.00 0.00 178.83 178.74 1of8 h GLU 86 N 0.89 0.46 -0.61 1.69 4.81 -1.10 -0.80 114.58 119.92 1of8 h GLU 86 Ca 0.14 -0.13 0.06 0.00 -0.13 0.00 0.00 59.36 59.30 1of8 h GLU 86 Cb 0.65 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.92 1of8 h GLU 86 CO 0.04 0.59 0.32 -0.92 -0.73 0.00 0.00 179.01 178.31 1of8 h TYR 87 N 0.26 0.58 -0.70 0.92 3.20 -1.13 -2.29 116.97 117.82 1of8 h TYR 87 Ca 0.08 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 1of8 h TYR 87 Cb 0.36 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.43 1of8 h TYR 87 CO 0.03 0.26 0.38 0.00 -1.64 0.00 0.00 178.16 177.19 1of8 h ALA 88 N 1.33 0.89 -0.59 1.82 0.00 -0.48 -0.00 119.26 122.23 1of8 h ALA 88 Ca 0.28 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1of8 h ALA 88 Cb 0.20 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1of8 h ALA 88 CO -0.19 0.41 0.10 -0.07 0.00 0.00 0.00 179.25 179.50 1of8 h LEU 89 N 0.96 0.91 -0.01 0.00 3.38 -0.82 0.21 115.31 119.94 1of8 h LEU 89 Ca 0.24 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1of8 h LEU 89 Cb 0.04 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 1of8 h LEU 89 CO -0.04 0.91 0.01 0.03 0.09 0.00 0.00 178.44 179.43 1of8 h ARG 90 N 0.90 0.02 -0.43 1.13 3.08 -0.94 -2.54 114.38 115.59 1of8 h ARG 90 Ca 0.19 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.21 1of8 h ARG 90 Cb 0.39 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1of8 h ARG 90 CO 0.01 0.14 0.17 1.25 -1.07 0.00 0.00 179.97 180.47 1of8 h LEU 91 N -0.11 0.56 -0.47 3.04 5.85 -0.67 -1.93 115.31 121.57 1of8 h LEU 91 Ca 0.00 -0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.58 1of8 h LEU 91 Cb 0.13 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1of8 h LEU 91 CO -0.00 0.51 -0.05 0.50 -0.34 0.00 0.00 178.44 179.06 1of8 h LYS 92 N 0.61 0.86 -0.48 1.25 1.63 -0.48 0.14 116.57 120.10 1of8 h LYS 92 Ca 0.15 -0.30 -0.00 0.00 -0.85 0.00 0.00 60.65 59.65 1of8 h LYS 92 Cb 0.13 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.67 1of8 h LYS 92 CO -0.01 0.93 0.29 -0.22 -3.45 0.00 0.00 179.45 176.99 1of8 h LYS 93 N 0.71 0.65 -0.50 1.90 3.64 -1.22 -1.01 116.57 120.75 1of8 h LYS 93 Ca 0.13 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.39 1of8 h LYS 93 Cb 0.57 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.23 1of8 h LYS 93 CO 0.03 0.47 0.05 1.25 -2.27 0.00 0.00 179.45 178.98 1of8 h LEU 94 N 0.64 0.76 -0.56 5.20 6.46 -1.19 -2.19 115.31 124.44 1of8 h LEU 94 Ca 0.17 -0.17 -0.01 0.00 -0.12 0.00 0.00 57.88 57.76 1of8 h LEU 94 Cb -0.01 -0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 39.69 1of8 h LEU 94 CO -0.03 0.80 0.32 0.28 -0.62 0.00 0.00 178.44 179.19 1of8 h SER 95 N 0.76 0.68 -0.85 1.25 0.02 -0.29 -1.18 113.55 113.93 1of8 h SER 95 Ca 0.16 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.01 1of8 h SER 95 Cb 0.39 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.72 1of8 h SER 95 CO 0.01 0.56 0.46 0.44 -1.14 0.00 0.00 176.83 177.16 1of8 h ASP 96 N 0.75 1.07 -0.72 3.07 3.32 -0.83 -0.12 116.42 122.95 1of8 h ASP 96 Ca 0.20 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1of8 h ASP 96 Cb 0.01 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.25 1of8 h ASP 96 CO -0.04 0.86 0.46 -0.08 -1.72 0.00 0.00 179.24 178.73 1of8 h GLU 97 N 1.20 0.96 -0.46 3.56 4.81 -0.87 -3.28 114.58 120.50 1of8 h GLU 97 Ca 0.30 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1of8 h GLU 97 Cb 0.03 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.20 1of8 h GLU 97 CO -0.05 0.65 0.00 1.28 -0.73 0.00 0.00 179.01 180.17 1of8 n LEU 98 N -4.56 3.34 0.24 1.64 4.77 -0.50 -4.67 117.00 117.26 1of8 n LEU 98 Ca 0.06 -2.08 0.16 0.00 -0.03 0.00 0.00 56.01 54.13 1of8 n LEU 98 Cb 0.03 -0.33 0.77 0.00 -2.33 0.00 0.00 43.42 41.56 1of8 n LEU 98 CO 0.36 0.80 0.99 0.07 -1.33 0.00 0.00 177.39 178.28 1of8 h LYS 99 N 2.69 0.00 0.00 3.23 2.10 -1.10 -0.64 116.57 122.85 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 0.87 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.20 1of8 h LYS 99 CO 0.02 0.00 -0.02 0.78 -2.00 0.00 0.00 179.45 178.24 1of8 h GLY 100 N 1.15 0.00 0.00 0.07 0.00 -1.87 -3.36 103.07 99.05 1of8 h GLY 100 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1of8 h GLY 100 CO 0.00 0.00 -1.03 1.22 0.00 0.00 0.00 176.54 176.73 1of8 n ASP 101 N -3.12 4.88 -4.09 0.19 8.00 -0.38 -4.84 116.55 117.18 1of8 n ASP 101 Ca 0.00 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.29 1of8 n ASP 101 Cb 0.29 0.57 -0.15 0.00 -0.02 0.00 0.00 41.12 41.81 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 -3.93 2.03 -0.30 0.64 1.43 -0.41 -2.08 118.68 116.08 1of8 s LEU 102 Ca -0.00 -0.24 -0.07 0.00 -1.03 0.00 0.00 54.13 52.78 1of8 s LEU 102 Cb 0.00 -0.65 0.01 0.00 0.03 0.00 0.00 46.19 45.58 1of8 s LEU 102 CO 0.02 0.15 0.09 -0.55 0.23 0.00 0.00 176.35 176.28 1of8 s SER 103 N -0.35 5.16 -0.18 2.29 0.15 -0.24 -4.18 113.70 116.34 1of8 s SER 103 Ca 0.05 -0.69 -0.06 0.00 0.70 0.00 0.00 55.95 55.94 1of8 s SER 103 Cb -0.05 -1.89 -0.04 0.00 -1.71 0.00 0.00 66.02 62.33 1of8 s SER 103 CO -0.00 -0.19 0.04 -0.63 1.20 0.00 0.00 173.24 173.65 1of8 s ILE 104 N 1.51 4.47 -0.09 6.45 1.01 -1.26 -0.59 121.20 132.70 1of8 s ILE 104 Ca 0.03 -0.14 0.04 0.00 0.00 0.00 0.00 60.65 60.57 1of8 s ILE 104 Cb -0.17 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.29 1of8 s ILE 104 CO 0.03 0.45 -0.21 -0.63 0.00 0.00 0.00 174.94 174.58 1of8 s ILE 105 N 0.54 1.82 0.08 2.92 1.01 0.26 -4.51 121.20 123.33 1of8 s ILE 105 Ca 0.01 -0.89 -0.30 0.00 0.00 0.00 0.00 60.65 59.47 1of8 s ILE 105 Cb -0.13 -1.58 -0.05 0.00 0.01 0.00 0.00 42.46 40.70 1of8 s ILE 105 CO 0.02 0.51 1.04 -0.32 0.00 0.00 0.00 174.94 176.18 1of8 s MET 106 N 0.35 4.59 -0.19 2.79 -2.45 -0.22 -1.29 119.30 122.87 1of8 s MET 106 Ca -0.16 1.55 -0.29 0.00 -1.25 0.00 0.00 55.69 55.55 1of8 s MET 106 Cb -0.17 -3.37 -0.04 0.00 1.25 0.00 0.00 34.83 32.50 1of8 s MET 106 CO 0.07 0.03 1.73 1.03 1.05 0.00 0.00 175.02 178.93 1of8 s ARG 107 N 0.39 3.74 -0.55 4.11 0.52 -0.30 -1.02 118.95 125.85 1of8 s ARG 107 Ca 0.51 1.81 0.07 0.00 -0.52 0.00 0.00 55.73 57.59 1of8 s ARG 107 Cb -0.25 -4.09 0.28 0.00 0.52 0.00 0.00 34.95 31.41 1of8 s ARG 107 CO 0.30 -1.37 0.76 0.00 0.02 0.00 0.00 175.30 175.01 1of8 n ALA 108 N 8.78 3.72 -2.67 2.13 0.00 0.13 -3.83 120.51 128.77 1of8 n ALA 108 Ca 0.20 -4.36 -0.43 0.00 0.00 0.00 0.00 53.44 48.85 1of8 n ALA 108 Cb 0.45 -0.84 -0.03 0.00 0.00 0.00 0.00 19.45 19.03 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 -2.50 3.38 -0.53 0.00 1.51 -1.26 -4.55 117.35 113.41 1of8 s TYR 109 Ca 0.41 1.44 0.21 0.00 -1.01 0.00 0.00 57.07 58.12 1of8 s TYR 109 Cb 0.21 -3.20 -0.27 0.00 -0.11 0.00 0.00 41.96 38.58 1of8 s TYR 109 CO -0.07 -0.39 0.68 1.28 -1.11 0.00 0.00 175.55 175.95 1of8 n LEU 110 N 5.87 0.51 -3.74 -1.29 4.77 -1.26 -2.00 117.00 119.86 1of8 n LEU 110 Ca 0.10 -0.26 -0.17 0.00 -0.03 0.00 0.00 56.01 55.65 1of8 n LEU 110 Cb 0.47 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.39 1of8 n LEU 110 CO 0.51 0.13 -0.35 -1.61 -1.33 0.00 0.00 177.39 174.74 1of8 s GLU 111 N -3.20 -0.02 -0.16 3.23 2.02 -1.26 -2.13 118.70 117.18 1of8 s GLU 111 Ca 0.00 0.24 0.01 0.00 0.02 0.00 0.00 54.97 55.25 1of8 s GLU 111 Cb 0.15 -0.36 0.02 0.00 0.10 0.00 0.00 34.13 34.04 1of8 s GLU 111 CO 0.87 -0.22 -0.19 0.15 0.02 0.00 0.00 175.26 175.89 1of8 s LYS 112 N 1.44 2.80 -0.13 1.61 -0.14 0.12 -4.76 119.74 120.67 1of8 s LYS 112 Ca -0.04 -0.76 -0.28 0.00 -1.36 0.00 0.00 55.97 53.52 1of8 s LYS 112 Cb -0.13 -2.38 -0.01 0.00 -1.68 0.00 0.00 37.83 33.63 1of8 s LYS 112 CO -0.03 -0.15 0.97 -1.25 -0.76 0.00 0.00 175.35 174.13 1of8 s PRO 113 N 1.17 4.38 0.09 -1.68 0.04 -1.26 -4.60 135.00 133.15 1of8 s PRO 113 Ca 0.01 1.30 0.01 0.00 0.04 0.00 0.00 61.00 62.36 1of8 s PRO 113 Cb -0.14 -3.55 -0.04 0.00 0.04 0.00 0.00 34.50 30.81 1of8 s PRO 113 CO -0.09 -0.33 0.21 1.03 0.04 0.00 0.00 177.00 177.86 1of8 s ARG 114 N 2.11 3.36 0.13 4.56 1.81 -1.26 -5.01 118.95 124.64 1of8 s ARG 114 Ca 0.46 -0.53 -0.19 0.00 -1.72 0.00 0.00 55.73 53.75 1of8 s ARG 114 Cb -0.18 -2.97 -0.05 0.00 -0.45 0.00 0.00 34.95 31.31 1of8 s ARG 114 CO 0.16 0.58 1.76 1.15 -0.68 0.00 0.00 175.30 178.27 1of8 h THR 115 N 2.02 1.09 0.00 0.02 2.02 -2.00 -3.43 112.91 112.62 1of8 h THR 115 Ca -0.46 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.51 1of8 h THR 115 Cb 1.17 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 68.33 1of8 h THR 115 CO 0.72 0.09 0.00 0.35 0.37 0.00 0.00 175.52 177.05 1of8 n THR 116 N -4.88 0.00 -4.39 3.16 -2.24 -1.26 -5.15 114.28 99.52 1of8 n THR 116 Ca -0.02 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.57 1of8 n THR 116 Cb 0.05 -0.28 -0.10 0.00 -2.10 0.00 0.00 70.33 67.89 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 1.17 0.00 2.28 -7.23 -1.26 -5.14 120.40 110.22 1of8 s VAL 117 Ca 0.00 -2.04 0.00 0.00 -1.81 0.00 0.00 61.98 58.13 1of8 s VAL 117 Cb 0.00 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.41 1of8 s VAL 117 CO 0.00 -0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 1of8 n GLY 118 N -0.54 1.99 3.67 2.32 0.00 -1.26 -4.96 105.19 106.41 1of8 n GLY 118 Ca -0.04 -1.42 -0.47 0.00 0.00 0.00 0.00 46.02 44.09 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 -1.44 2.30 1.10 1.61 -0.00 -1.26 -4.89 117.44 114.86 1of8 n TRP 119 Ca 0.00 0.18 0.12 0.00 -0.00 0.00 0.00 57.50 57.80 1of8 n TRP 119 Cb 0.00 -2.58 0.15 0.00 -0.00 0.00 0.00 31.31 28.88 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 4.35 1.12 0.00 5.87 5.02 -1.26 -4.80 118.16 128.46 1of8 n LYS 120 Ca 0.18 -0.85 0.00 0.00 -2.02 0.00 0.00 58.31 55.63 1of8 n LYS 120 Cb 0.29 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 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 1.38 0.46 0.31 0.72 0.00 -1.26 0.13 105.19 106.93 1of8 n GLY 121 Ca 0.11 -2.26 -0.06 0.00 0.00 0.00 0.00 46.02 43.81 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 0.93 -0.07 0.99 5.85 -1.59 -2.22 115.31 119.20 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 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.78 1of8 h LEU 122 CO 0.00 0.93 -0.10 0.40 -0.34 0.00 0.00 178.44 179.33 1of8 h ILE 123 N 0.93 1.39 -0.23 4.05 2.04 -1.75 -2.63 117.51 121.30 1of8 h ILE 123 Ca 0.19 -1.31 -0.11 0.00 1.00 0.00 0.00 64.86 64.63 1of8 h ILE 123 Cb 0.39 2.08 -0.01 0.00 -0.74 0.00 0.00 36.82 38.54 1of8 h ILE 123 CO 0.01 0.37 -0.33 -1.13 0.00 0.00 0.00 178.15 177.07 1of8 h ASN 124 N -0.25 0.48 -0.60 1.72 -0.73 -1.78 -3.37 115.58 111.06 1of8 h ASN 124 Ca 0.01 -0.19 -0.24 0.00 1.87 0.00 0.00 56.30 57.75 1of8 h ASN 124 Cb 0.64 -0.13 -0.18 0.00 0.27 0.00 0.00 38.32 38.92 1of8 h ASN 124 CO 0.02 0.79 -0.56 -0.67 -0.37 0.00 0.00 177.43 176.64 1of8 n ASP 125 N -4.07 -2.78 0.26 1.15 2.03 -0.85 -4.08 116.55 108.21 1of8 n ASP 125 Ca -0.01 -3.09 0.08 0.00 0.52 0.00 0.00 54.79 52.30 1of8 n ASP 125 Cb 0.46 1.52 0.65 0.00 -0.72 0.00 0.00 41.12 43.03 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 4.43 0.00 0.00 -0.67 0.13 -1.64 -0.85 132.00 133.39 1of8 h PRO 126 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1of8 h PRO 126 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1of8 h PRO 126 CO 0.23 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.75 1of8 n ASP 127 N -4.52 0.00 -3.82 1.44 8.00 -1.26 -4.93 116.55 111.46 1of8 n ASP 127 Ca -0.03 0.45 -0.27 0.00 0.71 0.00 0.00 54.79 55.64 1of8 n ASP 127 Cb 0.10 -0.48 0.04 0.00 -0.02 0.00 0.00 41.12 40.75 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 -1.48 -2.70 -2.15 2.53 0.31 -0.33 -4.85 118.33 109.66 1of8 n VAL 128 Ca 0.07 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1of8 n VAL 128 Cb 0.32 -3.24 -0.00 0.00 -0.91 0.00 0.00 33.84 30.00 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 -2.91 0.19 -3.47 4.52 2.04 -1.26 -5.02 115.26 109.34 1of8 n ASN 129 Ca -0.03 -1.84 -0.25 0.00 -0.44 0.00 0.00 54.58 52.02 1of8 n ASN 129 Cb 0.56 -0.14 0.05 0.00 -2.53 0.00 0.00 39.78 37.72 1of8 n ASN 129 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1of8 n ASN 130 N 0.15 -5.92 -0.00 0.53 5.03 -1.26 -4.90 115.26 108.89 1of8 n ASN 130 Ca -0.01 -0.50 0.05 0.00 0.87 0.00 0.00 54.58 54.99 1of8 n ASN 130 Cb 0.81 -4.71 -0.08 0.00 -1.02 0.00 0.00 39.78 34.78 1of8 n ASN 130 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1of8 n THR 131 N -4.76 0.00 -3.40 3.41 -2.24 -1.26 -5.04 114.28 100.98 1of8 n THR 131 Ca -0.02 -0.25 -0.18 0.00 -2.27 0.00 0.00 64.05 61.33 1of8 n THR 131 Cb 0.57 0.46 0.08 0.00 -2.10 0.00 0.00 70.33 69.34 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 -1.71 -2.27 -2.65 4.78 3.01 -1.26 -4.88 117.46 112.48 1of8 n PHE 132 Ca -0.01 0.91 -0.43 0.00 1.01 0.00 0.00 57.45 58.93 1of8 n PHE 132 Cb 0.26 -4.87 0.00 0.00 -0.01 0.00 0.00 39.48 34.86 1of8 n PHE 132 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1of8 n ASN 133 N -2.92 4.99 -0.07 4.37 2.85 -1.26 -4.80 115.26 118.42 1of8 n ASN 133 Ca -0.18 -2.93 -0.04 0.00 -0.11 0.00 0.00 54.58 51.32 1of8 n ASN 133 Cb 0.63 -1.71 0.18 0.00 1.24 0.00 0.00 39.78 40.11 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 5.39 1.24 -0.67 -1.44 2.04 -1.78 0.40 117.51 122.70 1of8 h ILE 134 Ca 0.42 -1.04 0.01 0.00 1.00 0.00 0.00 64.86 65.26 1of8 h ILE 134 Cb 0.87 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 1of8 h ILE 134 CO 1.42 0.36 0.44 0.78 0.00 0.00 0.00 178.15 181.15 1of8 h ASN 135 N 0.65 0.76 -0.49 1.72 2.35 -1.87 0.13 115.58 118.84 1of8 h ASN 135 Ca 0.12 -0.02 -0.07 0.00 -0.55 0.00 0.00 56.30 55.78 1of8 h ASN 135 Cb 0.49 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 1of8 h ASN 135 CO 0.03 0.55 0.05 0.50 -1.65 0.00 0.00 177.43 176.91 1of8 h LYS 136 N 0.90 0.88 -0.62 0.81 3.64 -1.78 -1.94 116.57 118.46 1of8 h LYS 136 Ca 0.25 -0.22 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1of8 h LYS 136 Cb -0.10 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.58 1of8 h LYS 136 CO -0.06 0.84 0.30 0.78 -2.27 0.00 0.00 179.45 179.05 1of8 h GLY 137 N 1.00 0.95 1.07 5.01 0.00 -0.31 0.58 103.07 111.37 1of8 h GLY 137 Ca 0.17 -0.47 -0.10 0.00 0.00 0.00 0.00 47.33 46.93 1of8 h GLY 137 CO 0.01 0.45 -0.04 1.41 0.00 0.00 0.00 176.54 178.37 1of8 h LEU 138 N 0.85 1.01 -0.34 3.11 3.38 -0.83 0.76 115.31 123.25 1of8 h LEU 138 Ca 0.21 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1of8 h LEU 138 Cb 0.11 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1of8 h LEU 138 CO -0.03 1.09 0.19 1.56 0.09 0.00 0.00 178.44 181.34 1of8 h GLN 139 N 0.91 0.48 -0.55 1.13 4.20 -1.06 -0.59 115.11 119.63 1of8 h GLN 139 Ca 0.16 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 1of8 h GLN 139 Cb 0.59 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 1of8 h GLN 139 CO 0.04 0.39 0.19 0.77 -0.67 0.00 0.00 178.83 179.55 1of8 h SER 140 N 0.44 0.79 -0.17 1.46 0.02 -0.71 -0.82 113.55 114.57 1of8 h SER 140 Ca 0.12 -0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1of8 h SER 140 Cb 0.05 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 1of8 h SER 140 CO -0.02 0.77 0.10 0.00 -1.14 0.00 0.00 176.83 176.55 1of8 h ALA 141 N 1.05 0.21 -0.28 3.77 0.00 -0.67 0.89 119.26 124.24 1of8 h ALA 141 Ca 0.18 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 1of8 h ALA 141 Cb 0.25 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1of8 h ALA 141 CO -0.01 -0.28 -0.49 -0.09 0.00 0.00 0.00 179.25 178.38 1of8 h ARG 142 N 0.20 0.76 -0.54 0.00 2.43 -0.98 -0.21 114.38 116.03 1of8 h ARG 142 Ca 0.06 -0.44 -0.03 0.00 -0.81 0.00 0.00 59.98 58.76 1of8 h ARG 142 Cb 0.02 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1of8 h ARG 142 CO -0.01 1.07 0.24 0.37 -1.51 0.00 0.00 179.97 180.12 1of8 h GLN 143 N 0.60 0.80 -0.14 0.20 5.75 -0.98 -0.56 115.11 120.77 1of8 h GLN 143 Ca 0.03 -0.13 0.03 0.00 -0.15 0.00 0.00 58.65 58.43 1of8 h GLN 143 Cb 1.06 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 29.44 1of8 h GLN 143 CO 0.10 0.68 -0.06 1.25 -2.65 0.00 0.00 178.83 178.15 1of8 h LEU 144 N 0.73 -0.21 -1.00 -2.39 5.85 -0.56 0.37 115.31 118.10 1of8 h LEU 144 Ca 0.18 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 1of8 h LEU 144 Cb 0.16 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1of8 h LEU 144 CO -0.02 -0.08 0.29 -0.26 -0.34 0.00 0.00 178.44 178.03 1of8 h PHE 145 N -0.04 1.02 -0.31 1.25 -1.00 -0.67 -0.72 116.94 116.47 1of8 h PHE 145 Ca 0.08 -0.06 -0.04 0.00 2.81 0.00 0.00 57.97 60.76 1of8 h PHE 145 Cb 0.16 -0.31 -0.01 0.00 3.61 0.00 0.00 35.95 39.40 1of8 h PHE 145 CO -0.20 0.76 0.02 0.28 -1.61 0.00 0.00 178.31 177.57 1of8 h VAL 146 N 0.99 1.25 -0.66 -0.55 2.07 -0.91 -2.29 116.25 116.15 1of8 h VAL 146 Ca 0.24 -0.88 0.06 0.00 0.82 0.00 0.00 66.70 66.93 1of8 h VAL 146 Cb 0.16 1.22 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 1of8 h VAL 146 CO -0.02 0.29 0.37 0.78 0.02 0.00 0.00 177.57 179.00 1of8 h ASN 147 N 0.34 0.55 -0.02 0.57 2.35 -0.12 0.08 115.58 119.33 1of8 h ASN 147 Ca 0.09 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1of8 h ASN 147 Cb 0.39 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1of8 h ASN 147 CO 0.01 0.35 -0.03 -0.07 -1.65 0.00 0.00 177.43 176.04 1of8 h LEU 148 N 0.68 0.06 -1.37 1.61 3.38 -1.15 -3.21 115.31 115.31 1of8 h LEU 148 Ca 0.29 -0.56 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 1of8 h LEU 148 Cb 0.18 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1of8 h LEU 148 CO -0.18 0.61 -0.18 0.71 0.09 0.00 0.00 178.44 179.49 1of8 h THR 149 N -0.49 0.51 0.00 0.22 1.35 -1.30 -2.80 112.91 110.40 1of8 h THR 149 Ca 0.00 -0.91 0.00 0.00 -0.55 0.00 0.00 66.41 64.95 1of8 h THR 149 Cb 0.60 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 1of8 h THR 149 CO 0.01 0.18 0.00 -1.13 -0.25 0.00 0.00 175.52 174.32 1of8 h ASN 150 N 0.00 0.00 -0.30 5.36 -0.73 -0.98 -1.33 115.58 117.60 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 0.61 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.20 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 -2.64 0.39 -0.38 2.57 -5.35 -1.06 -4.75 119.36 108.14 1of8 n ILE 151 Ca 0.02 -0.55 0.00 0.00 -0.27 0.00 0.00 62.75 61.95 1of8 n ILE 151 Cb 0.29 0.60 0.00 0.00 -1.74 0.00 0.00 39.64 38.79 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 1.30 0.79 3.36 3.28 0.00 -0.50 -5.06 105.19 108.36 1of8 n GLY 152 Ca 0.17 -0.22 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 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 4.24 0.72 0.99 2.96 -1.21 -4.99 118.68 121.39 1of8 s LEU 153 Ca 0.00 -0.83 -0.14 0.00 -0.22 0.00 0.00 54.13 52.94 1of8 s LEU 153 Cb 0.00 -1.95 0.03 0.00 0.50 0.00 0.00 46.19 44.78 1of8 s LEU 153 CO 0.00 -0.27 1.16 -2.84 -1.32 0.00 0.00 176.35 173.07 1of8 s PRO 154 N 1.52 2.33 0.14 0.98 0.02 -1.26 -3.62 135.00 135.10 1of8 s PRO 154 Ca 0.02 1.56 0.06 0.00 0.02 0.00 0.00 61.00 62.65 1of8 s PRO 154 Cb -0.18 -1.88 -0.04 0.00 0.02 0.00 0.00 34.50 32.42 1of8 s PRO 154 CO 0.05 -1.65 -0.13 0.96 -0.33 0.00 0.00 177.00 175.90 1of8 s ILE 155 N -2.24 1.32 0.05 2.83 -4.36 -1.26 -1.06 121.20 116.48 1of8 s ILE 155 Ca 0.70 -1.88 -0.00 0.00 -0.26 0.00 0.00 60.65 59.21 1of8 s ILE 155 Cb -0.24 -1.68 -0.04 0.00 1.25 0.00 0.00 42.46 41.75 1of8 s ILE 155 CO 0.45 -0.55 -0.04 -0.83 0.24 0.00 0.00 174.94 174.22 1of8 s GLY 156 N -2.78 0.47 0.07 6.27 0.00 -0.19 -1.01 107.32 110.15 1of8 s GLY 156 Ca 0.13 -1.08 -0.14 0.00 0.00 0.00 0.00 44.72 43.63 1of8 s GLY 156 CO 0.03 -1.18 0.32 -0.45 0.00 0.00 0.00 173.10 171.82 1of8 s SER 157 N -2.56 -0.13 0.02 1.64 0.15 -0.95 -0.69 113.70 111.18 1of8 s SER 157 Ca 0.02 -0.27 -0.30 0.00 0.70 0.00 0.00 55.95 56.10 1of8 s SER 157 Cb 0.03 0.39 -0.05 0.00 -1.71 0.00 0.00 66.02 64.68 1of8 s SER 157 CO -0.07 -0.69 1.24 -0.70 1.20 0.00 0.00 173.24 174.22 1of8 s GLU 158 N -3.04 4.38 -1.18 5.44 2.12 -1.26 -1.28 118.70 123.88 1of8 s GLU 158 Ca -0.02 1.78 -0.15 0.00 0.36 0.00 0.00 54.97 56.94 1of8 s GLU 158 Cb 0.01 -3.45 0.15 0.00 0.26 0.00 0.00 34.13 31.10 1of8 s GLU 158 CO -0.06 -0.38 1.44 -1.64 -0.54 0.00 0.00 175.26 174.08 1of8 s MET 159 N 1.65 4.01 -0.19 4.30 -1.94 0.49 -4.64 119.30 122.98 1of8 s MET 159 Ca 0.59 -2.37 -0.16 0.00 -1.71 0.00 0.00 55.69 52.04 1of8 s MET 159 Cb -0.29 -5.12 -0.11 0.00 2.01 0.00 0.00 34.83 31.32 1of8 s MET 159 CO 0.26 -1.85 -0.03 -0.11 -0.01 0.00 0.00 175.02 173.28 1of8 n LEU 160 N 6.21 1.86 -4.75 -0.03 7.94 -1.26 -4.76 117.00 122.21 1of8 n LEU 160 Ca 0.37 0.49 -0.41 0.00 -1.11 0.00 0.00 56.01 55.35 1of8 n LEU 160 Cb 0.44 -0.90 -0.03 0.00 0.53 0.00 0.00 43.42 43.46 1of8 n LEU 160 CO 0.63 -0.02 0.88 -0.62 -1.11 0.00 0.00 177.39 177.15 1of8 s ASP 161 N -6.43 7.08 0.00 1.96 -1.08 -1.26 -4.95 116.67 112.00 1of8 s ASP 161 Ca -0.25 2.30 0.27 0.00 -0.52 0.00 0.00 52.55 54.35 1of8 s ASP 161 Cb 0.05 -2.62 0.88 0.00 -1.46 0.00 0.00 42.92 39.78 1of8 s ASP 161 CO 0.43 -0.35 1.66 0.35 0.52 0.00 0.00 175.17 177.78 1of8 n THR 162 N 2.07 0.00 -0.12 1.71 -2.24 -1.26 -4.21 114.28 110.22 1of8 n THR 162 Ca 0.03 -0.03 -0.16 0.00 -2.27 0.00 0.00 64.05 61.61 1of8 n THR 162 Cb 0.44 0.02 -0.11 0.00 -2.10 0.00 0.00 70.33 68.59 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 -1.24 1.34 0.03 2.28 5.41 -1.26 -4.58 119.36 121.34 1of8 n ILE 163 Ca 0.09 -0.51 0.16 0.00 1.00 0.00 0.00 62.75 63.49 1of8 n ILE 163 Cb 0.32 -1.34 0.63 0.00 -0.71 0.00 0.00 39.64 38.55 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 0.10 -0.15 4.38 4.64 -1.99 -2.23 113.55 118.27 1of8 h SER 164 Ca -0.52 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 60.84 1of8 h SER 164 Cb 1.80 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.87 1of8 h SER 164 CO -0.09 0.06 0.15 -0.65 -0.87 0.00 0.00 176.83 175.43 1of8 h PRO 165 N 0.11 0.00 -0.26 4.77 0.11 -1.81 -0.58 132.00 134.34 1of8 h PRO 165 Ca 0.21 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.37 1of8 h PRO 165 Cb 0.70 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 1of8 h PRO 165 CO -0.02 0.00 0.18 1.96 -0.21 0.00 0.00 178.00 179.91 1of8 h GLN 166 N 0.00 0.16 0.00 1.05 1.08 -1.71 0.42 115.11 116.11 1of8 h GLN 166 Ca 0.07 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 1of8 h GLN 166 Cb 0.38 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.77 1of8 h GLN 166 CO -0.00 0.10 -0.08 1.88 -0.95 0.00 0.00 178.83 179.78 1of8 h TYR 167 N 0.16 0.00 0.00 2.96 -1.99 -1.29 -3.41 116.97 113.40 1of8 h TYR 167 Ca 0.11 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.84 1of8 h TYR 167 Cb 0.25 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.98 1of8 h TYR 167 CO -0.00 0.06 -0.13 1.28 -0.00 0.00 0.00 178.16 179.38 1of8 n LEU 168 N -3.11 0.00 0.24 3.88 4.77 -0.83 -4.82 117.00 117.13 1of8 n LEU 168 Ca 0.04 -0.07 0.08 0.00 -0.03 0.00 0.00 56.01 56.03 1of8 n LEU 168 Cb 0.56 0.00 0.60 0.00 -2.33 0.00 0.00 43.42 42.25 1of8 n LEU 168 CO 0.35 0.00 0.97 0.00 -1.33 0.00 0.00 177.39 177.38 1of8 h ALA 169 N 0.00 1.69 0.00 -1.18 0.00 -1.18 -1.14 119.26 117.46 1of8 h ALA 169 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1of8 h ALA 169 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1of8 h ALA 169 CO 0.00 0.15 0.11 0.38 0.00 0.00 0.00 179.25 179.89 1of8 h ASP 170 N 0.00 0.00 -0.01 0.00 2.03 -1.91 -2.56 116.42 113.98 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 0.22 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.72 1of8 h ASP 170 CO 0.02 0.00 -0.17 0.18 -1.03 0.00 0.00 179.24 178.24 1of8 n LEU 171 N -2.79 1.87 -4.81 0.15 4.77 -0.43 -4.83 117.00 110.93 1of8 n LEU 171 Ca -0.02 -0.87 -0.36 0.00 -0.03 0.00 0.00 56.01 54.73 1of8 n LEU 171 Cb 0.16 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.18 1of8 n LEU 171 CO 0.15 0.35 -0.21 -0.69 -1.33 0.00 0.00 177.39 175.66 1of8 s VAL 172 N -1.56 5.18 -0.29 4.08 1.01 -0.96 -4.55 120.40 123.30 1of8 s VAL 172 Ca 0.15 0.09 0.13 0.00 0.00 0.00 0.00 61.98 62.34 1of8 s VAL 172 Cb 0.12 -3.25 -0.17 0.00 0.00 0.00 0.00 36.38 33.08 1of8 s VAL 172 CO 0.29 0.60 0.40 -1.20 0.00 0.00 0.00 175.10 175.19 1of8 n SER 173 N 2.20 1.35 -3.70 3.32 7.64 -0.18 -4.89 113.62 119.36 1of8 n SER 173 Ca -0.19 -0.39 -0.12 0.00 1.01 0.00 0.00 58.87 59.18 1of8 n SER 173 Cb 0.54 1.30 -0.09 0.00 -1.01 0.00 0.00 64.21 64.95 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 -2.53 -0.59 -0.04 1.43 2.19 -1.20 -4.16 117.98 113.09 1of8 s PHE 174 Ca -0.00 1.36 0.06 0.00 0.33 0.00 0.00 56.93 58.68 1of8 s PHE 174 Cb 0.09 0.23 -0.01 0.00 -1.31 0.00 0.00 43.02 42.02 1of8 s PHE 174 CO 0.52 -0.29 -0.22 0.20 1.83 0.00 0.00 175.22 177.26 1of8 s GLY 175 N 0.57 1.12 -0.09 13.12 0.00 -0.64 -2.24 107.32 119.16 1of8 s GLY 175 Ca -0.03 -0.92 -0.04 0.00 0.00 0.00 0.00 44.72 43.73 1of8 s GLY 175 CO -0.03 -0.63 0.09 0.00 0.00 0.00 0.00 173.10 172.53 1of8 s ALA 176 N -0.25 3.67 -0.23 3.20 0.00 -0.40 -1.01 121.76 126.72 1of8 s ALA 176 Ca 0.01 -0.72 -0.07 0.00 0.00 0.00 0.00 51.96 51.18 1of8 s ALA 176 Cb -0.11 -1.77 -0.03 0.00 0.00 0.00 0.00 23.12 21.21 1of8 s ALA 176 CO 0.02 0.62 0.05 0.42 0.00 0.00 0.00 175.76 176.87 1of8 s ILE 177 N -1.01 4.26 0.82 0.00 -1.09 0.29 -0.38 121.20 124.09 1of8 s ILE 177 Ca 0.16 -0.20 -0.11 0.00 -2.23 0.00 0.00 60.65 58.27 1of8 s ILE 177 Cb -0.12 -2.97 0.08 0.00 -1.58 0.00 0.00 42.46 37.88 1of8 s ILE 177 CO 0.05 0.37 1.09 -0.83 -1.23 0.00 0.00 174.94 174.39 1of8 s GLY 178 N 1.37 1.65 0.37 6.18 0.00 -1.26 -1.58 107.32 114.05 1of8 s GLY 178 Ca 0.05 0.11 0.12 0.00 0.00 0.00 0.00 44.72 45.00 1of8 s GLY 178 CO 0.03 0.52 1.83 0.00 0.00 0.00 0.00 173.10 175.48 1of8 h ALA 179 N -1.28 1.97 0.00 3.20 0.00 -1.79 0.09 119.26 121.45 1of8 h ALA 179 Ca -0.46 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1of8 h ALA 179 Cb 1.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1of8 h ALA 179 CO 0.53 -0.27 0.00 0.54 0.00 0.00 0.00 179.25 180.05 1of8 n ARG 180 N -4.60 0.03 0.00 0.00 1.74 -1.26 -3.86 116.66 108.72 1of8 n ARG 180 Ca 0.20 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.30 1of8 n ARG 180 Cb 0.62 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.56 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 -1.48 0.00 0.00 0.55 -2.24 -0.45 -4.78 114.28 105.88 1of8 n THR 181 Ca 0.07 -0.36 0.11 0.00 -2.27 0.00 0.00 64.05 61.60 1of8 n THR 181 Cb 0.32 1.22 0.54 0.00 -2.10 0.00 0.00 70.33 70.31 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 0.22 0.93 0.00 4.28 2.02 -1.14 -1.53 112.91 117.69 1of8 h THR 182 Ca 0.00 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1of8 h THR 182 Cb 0.11 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1of8 h THR 182 CO 0.00 0.06 0.00 -0.33 0.37 0.00 0.00 175.52 175.62 1of8 h GLU 183 N 0.31 0.00 -6.33 6.66 5.08 -1.84 -3.43 114.58 115.03 1of8 h GLU 183 Ca 0.20 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 58.02 1of8 h GLU 183 Cb 0.41 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1of8 h GLU 183 CO -0.04 0.00 0.87 0.45 -1.00 0.00 0.00 179.01 179.29 1of8 s SER 184 N -4.87 6.84 0.45 1.42 0.15 -0.58 -4.91 113.70 112.20 1of8 s SER 184 Ca 0.09 2.06 0.16 0.00 0.70 0.00 0.00 55.95 58.97 1of8 s SER 184 Cb 0.10 -2.55 1.06 0.00 -1.71 0.00 0.00 66.02 62.92 1of8 s SER 184 CO 0.59 -0.75 1.99 -0.61 1.20 0.00 0.00 173.24 175.66 1of8 h GLN 185 N 8.11 0.00 -0.41 5.44 4.15 -1.89 -2.00 115.11 128.51 1of8 h GLN 185 Ca -0.36 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 58.97 1of8 h GLN 185 Cb 1.17 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.84 1of8 h GLN 185 CO 0.92 0.19 -0.08 -0.07 -1.93 0.00 0.00 178.83 177.86 1of8 h LEU 186 N 0.00 0.69 -0.29 -2.39 3.38 -1.94 -1.19 115.31 113.59 1of8 h LEU 186 Ca -0.00 -0.19 -0.20 0.00 0.09 0.00 0.00 57.88 57.58 1of8 h LEU 186 Cb 0.35 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1of8 h LEU 186 CO 0.02 0.81 -0.87 0.45 0.09 0.00 0.00 178.44 178.95 1of8 h HIS 187 N 0.66 0.31 -0.54 1.13 3.86 -1.67 -0.20 115.15 118.70 1of8 h HIS 187 Ca 0.12 -0.17 -0.07 0.00 -1.16 0.00 0.00 60.37 59.09 1of8 h HIS 187 Cb 0.52 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.94 1of8 h HIS 187 CO 0.02 0.98 0.06 0.00 0.86 0.00 0.00 177.93 179.86 1of8 h ARG 188 N 0.12 0.91 -0.05 2.45 3.08 -1.25 -0.70 114.38 118.94 1of8 h ARG 188 Ca -0.04 -0.26 0.01 0.00 0.07 0.00 0.00 59.98 59.76 1of8 h ARG 188 Cb 1.50 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.44 1of8 h ARG 188 CO 0.13 0.90 -0.02 0.93 -1.07 0.00 0.00 179.97 180.84 1of8 h GLU 189 N 0.80 -0.02 -0.07 0.04 5.08 -1.17 -1.94 114.58 117.30 1of8 h GLU 189 Ca 0.16 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.56 1of8 h GLU 189 Cb 0.44 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.65 1of8 h GLU 189 CO 0.02 -0.01 -0.22 1.25 -1.00 0.00 0.00 179.01 179.04 1of8 h LEU 190 N -0.02 -0.67 -1.52 1.33 5.85 -0.85 -2.43 115.31 117.00 1of8 h LEU 190 Ca 0.03 0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.92 1of8 h LEU 190 Cb 0.06 0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 1of8 h LEU 190 CO -0.06 -0.28 0.41 0.00 -0.34 0.00 0.00 178.44 178.16 1of8 h ALA 191 N 0.61 1.83 0.00 1.25 0.00 -0.97 -1.70 119.26 120.28 1of8 h ALA 191 Ca 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1of8 h ALA 191 Cb 0.43 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1of8 h ALA 191 CO -0.25 0.07 0.00 0.66 0.00 0.00 0.00 179.25 179.73 1of8 h SER 192 N 0.58 0.00 -0.12 0.00 4.64 -0.83 -2.59 113.55 115.22 1of8 h SER 192 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1of8 h SER 192 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1of8 h SER 192 CO -0.08 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.49 1of8 n GLY 193 N -0.85 0.87 3.79 -0.77 0.00 -0.65 -1.74 105.19 105.83 1of8 n GLY 193 Ca -0.02 -0.26 -0.38 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.83 4.45 -0.22 0.99 1.43 -0.98 -4.96 118.68 118.56 1of8 s LEU 194 Ca 0.13 1.64 0.02 0.00 -1.03 0.00 0.00 54.13 54.89 1of8 s LEU 194 Cb 0.08 -3.60 0.32 0.00 0.03 0.00 0.00 46.19 43.02 1of8 s LEU 194 CO 0.11 0.08 1.45 -1.20 0.23 0.00 0.00 176.35 177.02 1of8 n SER 195 N 1.03 3.41 -3.75 2.29 7.64 -1.26 -4.86 113.62 118.12 1of8 n SER 195 Ca -0.02 -2.77 -0.10 0.00 1.01 0.00 0.00 58.87 56.99 1of8 n SER 195 Cb 0.50 -0.67 -0.04 0.00 -1.01 0.00 0.00 64.21 62.99 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 -1.58 -0.09 0.53 1.43 -0.12 -1.26 -5.06 117.98 111.82 1of8 s PHE 196 Ca 0.27 -0.25 -0.22 0.00 -0.05 0.00 0.00 56.93 56.68 1of8 s PHE 196 Cb 0.23 0.38 -0.05 0.00 -0.63 0.00 0.00 43.02 42.95 1of8 s PHE 196 CO 0.05 -0.92 1.33 -2.14 -0.05 0.00 0.00 175.22 173.49 1of8 s PRO 197 N -3.88 3.25 -0.07 1.99 0.02 -1.26 -4.83 135.00 130.22 1of8 s PRO 197 Ca 0.10 2.18 0.02 0.00 0.02 0.00 0.00 61.00 63.32 1of8 s PRO 197 Cb -0.01 -2.29 0.01 0.00 0.02 0.00 0.00 34.50 32.23 1of8 s PRO 197 CO -0.02 -1.09 -0.12 0.08 -0.33 0.00 0.00 177.00 175.52 1of8 s VAL 198 N -1.33 1.16 -0.22 3.83 1.01 -0.72 -1.63 120.40 122.51 1of8 s VAL 198 Ca 0.70 -0.48 -0.08 0.00 0.00 0.00 0.00 61.98 62.13 1of8 s VAL 198 Cb -0.39 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 1of8 s VAL 198 CO 0.46 0.36 0.07 -0.83 0.00 0.00 0.00 175.10 175.17 1of8 s GLY 199 N 0.78 1.84 -0.31 4.51 0.00 -0.18 -1.31 107.32 112.65 1of8 s GLY 199 Ca -0.12 -0.94 -0.12 0.00 0.00 0.00 0.00 44.72 43.53 1of8 s GLY 199 CO 0.02 0.30 0.24 -1.36 0.00 0.00 0.00 173.10 172.31 1of8 s PHE 200 N 1.01 3.22 0.45 1.90 0.40 0.16 -0.55 117.98 124.57 1of8 s PHE 200 Ca 0.04 0.00 -0.24 0.00 -0.60 0.00 0.00 56.93 56.14 1of8 s PHE 200 Cb -0.14 -2.46 -0.08 0.00 0.51 0.00 0.00 43.02 40.85 1of8 s PHE 200 CO 0.03 -0.27 1.19 0.15 0.70 0.00 0.00 175.22 177.02 1of8 s LYS 201 N 1.80 3.80 0.96 0.44 -0.14 -0.61 -0.91 119.74 125.07 1of8 s LYS 201 Ca 0.08 1.86 -0.11 0.00 -1.36 0.00 0.00 55.97 56.44 1of8 s LYS 201 Cb -0.17 -2.49 0.17 0.00 -1.68 0.00 0.00 37.83 33.66 1of8 s LYS 201 CO 0.11 -0.54 1.11 0.54 -0.76 0.00 0.00 175.35 175.80 1of8 s ASN 202 N -1.22 2.66 0.97 2.83 4.22 -0.52 -4.49 114.94 119.39 1of8 s ASN 202 Ca 0.62 1.92 -0.12 0.00 -2.14 0.00 0.00 52.86 53.14 1of8 s ASN 202 Cb -0.31 -2.46 0.17 0.00 1.28 0.00 0.00 41.25 39.93 1of8 s ASN 202 CO 0.38 -3.22 1.08 -0.83 -2.04 0.00 0.00 177.10 172.47 1of8 s GLY 203 N -2.79 1.60 0.48 0.45 0.00 -0.92 -4.35 107.32 101.80 1of8 s GLY 203 Ca 0.66 -0.06 0.32 0.00 0.00 0.00 0.00 44.72 45.64 1of8 s GLY 203 CO 0.59 0.49 1.93 -0.91 0.00 0.00 0.00 173.10 175.21 1of8 h THR 204 N -1.86 0.00 0.00 0.90 1.35 -1.87 -0.54 112.91 110.89 1of8 h THR 204 Ca -0.52 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 64.94 1of8 h THR 204 Cb 1.30 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 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 -2.86 0.00 0.00 5.36 3.85 -1.26 -1.51 116.55 120.13 1of8 n ASP 205 Ca 0.01 -0.05 0.00 0.00 -0.71 0.00 0.00 54.79 54.04 1of8 n ASP 205 Cb 0.27 -0.26 0.00 0.00 -1.35 0.00 0.00 41.12 39.78 1of8 n ASP 205 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1of8 n GLY 206 N 0.37 0.75 3.72 6.12 0.00 -0.21 -0.80 105.19 115.13 1of8 n GLY 206 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.23 4.03 -0.53 2.61 -4.23 -1.26 -4.76 115.64 109.28 1of8 s THR 207 Ca 0.00 -1.29 0.22 0.00 -1.18 0.00 0.00 61.69 59.44 1of8 s THR 207 Cb 0.00 -3.04 -0.17 0.00 1.34 0.00 0.00 72.50 70.64 1of8 s THR 207 CO 0.00 -0.11 0.90 0.18 -0.54 0.00 0.00 174.62 175.05 1of8 n LEU 208 N -0.21 0.56 -0.22 4.79 4.32 -1.26 -2.15 117.00 122.82 1of8 n LEU 208 Ca -0.09 -0.06 0.02 0.00 -0.02 0.00 0.00 56.01 55.86 1of8 n LEU 208 Cb 0.55 -0.06 0.13 0.00 -1.62 0.00 0.00 43.42 42.42 1of8 n LEU 208 CO 0.41 0.05 0.92 0.78 -1.22 0.00 0.00 177.39 178.32 1of8 h ASN 209 N 0.00 -0.02 -0.01 -1.43 4.21 -1.99 -0.11 115.58 116.23 1of8 h ASN 209 Ca 0.00 0.13 -0.05 0.00 1.21 0.00 0.00 56.30 57.59 1of8 h ASN 209 Cb 0.77 0.18 -0.01 0.00 -1.12 0.00 0.00 38.32 38.13 1of8 h ASN 209 CO 0.00 -0.02 -0.12 -0.37 -1.29 0.00 0.00 177.43 175.63 1of8 h VAL 210 N 0.25 1.19 -0.07 2.81 -1.51 -1.96 -0.03 116.25 116.93 1of8 h VAL 210 Ca 0.35 -0.82 -0.23 0.00 -1.23 0.00 0.00 66.70 64.77 1of8 h VAL 210 Cb 0.56 1.19 0.01 0.00 -2.13 0.00 0.00 31.29 30.91 1of8 h VAL 210 CO -0.45 0.26 -0.89 0.00 -1.23 0.00 0.00 177.57 175.26 1of8 h ALA 211 N 1.60 0.30 -0.28 5.19 0.00 -1.31 0.07 119.26 124.84 1of8 h ALA 211 Ca 0.06 -0.65 -0.00 0.00 0.00 0.00 0.00 54.91 54.31 1of8 h ALA 211 Cb 0.39 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1of8 h ALA 211 CO 0.02 0.72 0.17 0.28 0.00 0.00 0.00 179.25 180.44 1of8 h VAL 212 N 0.41 1.10 -0.69 0.00 2.07 -0.95 -1.32 116.25 116.86 1of8 h VAL 212 Ca -0.08 -0.24 0.04 0.00 0.82 0.00 0.00 66.70 67.24 1of8 h VAL 212 Cb 1.52 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 32.00 1of8 h VAL 212 CO 0.17 0.10 0.42 0.44 0.02 0.00 0.00 177.57 178.72 1of8 h ASP 213 N 0.35 0.67 -0.62 0.57 3.32 -0.99 -2.25 116.42 117.47 1of8 h ASP 213 Ca 0.10 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1of8 h ASP 213 Cb 0.01 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.40 1of8 h ASP 213 CO -0.02 0.46 0.35 0.00 -1.72 0.00 0.00 179.24 178.31 1of8 h ALA 214 N 1.31 0.79 -0.83 3.45 0.00 -0.66 0.00 119.26 123.34 1of8 h ALA 214 Ca 0.29 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1of8 h ALA 214 Cb 0.07 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 1of8 h ALA 214 CO -0.13 0.30 0.44 0.00 0.00 0.00 0.00 179.25 179.86 1of8 h GLN 216 N 1.16 -0.06 -0.70 0.00 1.08 -1.05 -2.46 115.11 113.08 1of8 h GLN 216 Ca 0.29 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.49 1of8 h GLN 216 Cb 0.04 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.45 1of8 h GLN 216 CO -0.04 0.06 0.42 0.00 -0.95 0.00 0.00 178.83 178.32 1of8 h ALA 217 N 0.79 0.89 0.00 3.87 0.00 -0.55 -2.63 119.26 121.62 1of8 h ALA 217 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1of8 h ALA 217 Cb 0.15 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1of8 h ALA 217 CO 0.01 0.36 0.00 0.00 0.00 0.00 0.00 179.25 179.62 1of8 h ALA 218 N 1.22 1.00 0.00 0.00 0.00 -0.73 -2.22 119.26 118.52 1of8 h ALA 218 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1of8 h ALA 218 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1of8 h ALA 218 CO -0.05 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.20 1of8 h ALA 219 N 2.16 1.00 -2.33 0.00 0.00 -1.05 0.01 119.26 119.05 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 0.63 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.43 1of8 h ALA 219 CO 0.00 0.00 0.04 -1.01 0.00 0.00 0.00 179.25 178.28 1of8 s HIS 220 N -3.34 3.51 0.30 0.00 3.76 -0.84 -3.97 115.29 114.70 1of8 s HIS 220 Ca 0.05 0.82 -0.29 0.00 -0.15 0.00 0.00 55.06 55.49 1of8 s HIS 220 Cb 0.09 -2.28 -0.10 0.00 1.11 0.00 0.00 32.58 31.40 1of8 s HIS 220 CO 0.51 -0.10 1.27 0.45 -0.85 0.00 0.00 174.74 176.03 1of8 s SER 221 N -3.58 6.89 0.12 1.40 0.15 -1.25 -3.51 113.70 113.91 1of8 s SER 221 Ca 0.47 2.56 0.05 0.00 0.70 0.00 0.00 55.95 59.74 1of8 s SER 221 Cb -0.10 -2.64 -0.04 0.00 -1.71 0.00 0.00 66.02 61.53 1of8 s SER 221 CO 0.36 -0.46 -0.13 -1.00 1.20 0.00 0.00 173.24 173.22 1of8 s HIS 222 N -0.93 1.32 -0.10 3.44 3.76 -1.25 -4.93 115.29 116.60 1of8 s HIS 222 Ca 0.49 -0.58 0.03 0.00 -0.15 0.00 0.00 55.06 54.85 1of8 s HIS 222 Cb -0.38 -0.70 0.01 0.00 1.11 0.00 0.00 32.58 32.63 1of8 s HIS 222 CO 0.48 0.11 -0.19 -1.01 -0.85 0.00 0.00 174.74 173.28 1of8 s HIS 223 N -2.23 2.21 0.04 1.40 3.76 -1.26 -0.74 115.29 118.47 1of8 s HIS 223 Ca 0.08 -0.97 -0.27 0.00 -0.15 0.00 0.00 55.06 53.75 1of8 s HIS 223 Cb -0.04 -1.53 0.09 0.00 1.11 0.00 0.00 32.58 32.21 1of8 s HIS 223 CO 0.02 -0.44 0.80 -0.59 -0.85 0.00 0.00 174.74 173.68 1of8 s PHE 224 N 0.65 -0.41 0.19 1.40 -0.12 -0.63 -4.99 117.98 114.08 1of8 s PHE 224 Ca -0.13 0.26 -0.30 0.00 -0.05 0.00 0.00 56.93 56.71 1of8 s PHE 224 Cb -0.16 0.54 -0.08 0.00 -0.63 0.00 0.00 43.02 42.69 1of8 s PHE 224 CO 0.03 -0.64 1.00 -1.64 -0.05 0.00 0.00 175.22 173.93 1of8 s MET 225 N -3.27 4.73 0.19 1.99 -1.94 -1.26 -0.05 119.30 119.69 1of8 s MET 225 Ca 0.04 1.56 -0.18 0.00 -1.71 0.00 0.00 55.69 55.39 1of8 s MET 225 Cb -0.01 -3.30 0.03 0.00 2.01 0.00 0.00 34.83 33.56 1of8 s MET 225 CO -0.10 0.29 0.53 0.20 -0.01 0.00 0.00 175.02 175.92 1of8 s GLY 226 N -0.51 -0.12 -0.03 -0.03 0.00 -0.18 -4.89 107.32 101.56 1of8 s GLY 226 Ca 0.45 -0.18 -0.20 0.00 0.00 0.00 0.00 44.72 44.79 1of8 s GLY 226 CO 0.33 -0.24 0.57 0.14 0.00 0.00 0.00 173.10 173.90 1of8 s VAL 227 N -3.87 4.98 0.74 1.40 1.01 -1.26 -0.87 120.40 122.54 1of8 s VAL 227 Ca 0.09 1.18 -0.02 0.00 0.00 0.00 0.00 61.98 63.22 1of8 s VAL 227 Cb -0.01 -3.90 0.14 0.00 0.00 0.00 0.00 36.38 32.60 1of8 s VAL 227 CO -0.03 0.40 1.02 0.42 0.00 0.00 0.00 175.10 176.91 1of8 s THR 228 N -0.03 2.11 0.36 3.92 -4.23 -0.05 -4.94 115.64 112.78 1of8 s THR 228 Ca 0.30 -0.55 0.38 0.00 -1.18 0.00 0.00 61.69 60.64 1of8 s THR 228 Cb -0.17 -2.56 0.39 0.00 1.34 0.00 0.00 72.50 71.49 1of8 s THR 228 CO 0.16 0.00 2.15 0.11 -0.54 0.00 0.00 174.62 176.50 1of8 h LYS 229 N -0.63 0.00 -0.03 3.99 1.57 -1.92 -0.64 116.57 118.90 1of8 h LYS 229 Ca -0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 1of8 h LYS 229 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.57 1of8 h LYS 229 CO 0.40 0.00 0.00 0.72 -0.57 0.00 0.00 179.45 180.00 1of8 n HIS 230 N -2.91 0.03 -1.02 -1.35 8.25 -1.26 -0.96 115.22 115.99 1of8 n HIS 230 Ca -0.02 -0.01 -0.01 0.00 -0.26 0.00 0.00 57.72 57.42 1of8 n HIS 230 Cb 0.12 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.22 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 1.12 0.48 3.48 -1.41 0.00 -0.25 -4.89 105.19 103.72 1of8 n GLY 231 Ca 0.19 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.01 2.75 0.20 1.61 -7.23 -1.26 -4.87 120.40 109.60 1of8 s VAL 232 Ca 0.00 -1.62 -0.30 0.00 -1.81 0.00 0.00 61.98 58.25 1of8 s VAL 232 Cb 0.00 -2.28 -0.08 0.00 0.56 0.00 0.00 36.38 34.58 1of8 s VAL 232 CO 0.00 0.05 1.04 0.00 -0.31 0.00 0.00 175.10 175.87 1of8 s ALA 233 N -1.26 3.35 0.26 1.32 0.00 -1.26 -0.87 121.76 123.29 1of8 s ALA 233 Ca 0.19 0.74 -0.06 0.00 0.00 0.00 0.00 51.96 52.82 1of8 s ALA 233 Cb -0.10 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 19.71 1of8 s ALA 233 CO 0.10 -0.06 0.37 0.00 0.00 0.00 0.00 175.76 176.17 1of8 s ALA 234 N -0.63 0.47 -0.23 0.00 0.00 -0.04 -4.94 121.76 116.39 1of8 s ALA 234 Ca 0.46 -1.30 -0.21 0.00 0.00 0.00 0.00 51.96 50.91 1of8 s ALA 234 Cb -0.28 1.20 -0.02 0.00 0.00 0.00 0.00 23.12 24.02 1of8 s ALA 234 CO 0.35 -0.76 0.64 0.42 0.00 0.00 0.00 175.76 176.41 1of8 s ILE 235 N -3.81 4.99 -0.06 0.00 1.01 -1.26 -1.01 121.20 121.06 1of8 s ILE 235 Ca 0.30 1.18 -0.12 0.00 0.00 0.00 0.00 60.65 62.01 1of8 s ILE 235 Cb 0.02 -3.95 -0.05 0.00 0.01 0.00 0.00 42.46 38.49 1of8 s ILE 235 CO 0.13 0.05 0.31 -0.89 0.00 0.00 0.00 174.94 174.54 1of8 s THR 236 N 2.31 5.22 -0.16 2.92 2.01 0.93 -4.93 115.64 123.94 1of8 s THR 236 Ca 0.28 0.61 0.01 0.00 0.31 0.00 0.00 61.69 62.90 1of8 s THR 236 Cb -0.16 -3.61 0.01 0.00 0.01 0.00 0.00 72.50 68.76 1of8 s THR 236 CO 0.09 0.56 -0.19 -0.89 -0.69 0.00 0.00 174.62 173.50 1of8 s THR 237 N -0.84 2.28 0.38 -0.82 2.01 -1.26 -1.60 115.64 115.78 1of8 s THR 237 Ca 0.20 -0.90 0.07 0.00 0.31 0.00 0.00 61.69 61.38 1of8 s THR 237 Cb -0.15 -1.94 -0.01 0.00 0.01 0.00 0.00 72.50 70.41 1of8 s THR 237 CO 0.09 0.53 0.45 0.42 -0.69 0.00 0.00 174.62 175.42 1of8 s THR 238 N 0.94 3.28 -0.18 -0.82 -4.23 0.08 -4.97 115.64 109.74 1of8 s THR 238 Ca -0.04 -1.15 0.21 0.00 -1.18 0.00 0.00 61.69 59.54 1of8 s THR 238 Cb -0.15 -3.13 -0.09 0.00 1.34 0.00 0.00 72.50 70.47 1of8 s THR 238 CO -0.04 -0.07 0.89 1.17 -0.54 0.00 0.00 174.62 176.03 1of8 n LYS 239 N -1.64 0.62 0.00 3.99 4.81 -1.25 -3.75 118.16 120.94 1of8 n LYS 239 Ca 0.03 0.09 0.00 0.00 -0.87 0.00 0.00 58.31 57.56 1of8 n LYS 239 Cb 0.60 -1.77 0.00 0.00 0.02 0.00 0.00 35.03 33.88 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 1.25 0.26 3.05 3.14 0.00 -0.71 -3.97 105.19 108.20 1of8 n GLY 240 Ca -0.03 -1.52 -0.32 0.00 0.00 0.00 0.00 46.02 44.15 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 -1.01 4.56 0.00 1.61 3.84 -0.01 -4.88 114.94 119.05 1of8 s ASN 241 Ca 0.00 -1.69 0.31 0.00 0.21 0.00 0.00 52.86 51.69 1of8 s ASN 241 Cb 0.00 -1.57 1.73 0.00 -0.55 0.00 0.00 41.25 40.86 1of8 s ASN 241 CO 0.00 -0.27 2.15 -1.84 -2.79 0.00 0.00 177.10 174.35 1of8 n GLU 242 N 4.37 0.73 -1.58 0.43 0.00 -1.26 -3.63 120.64 119.69 1of8 n GLU 242 Ca -0.07 0.00 -0.31 0.00 0.00 0.00 0.00 57.16 56.78 1of8 n GLU 242 Cb 0.42 -1.50 0.06 0.00 0.00 0.00 0.00 31.44 30.42 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 -1.13 3.05 -3.96 -1.84 8.25 -1.26 -4.91 115.22 113.42 1of8 n HIS 243 Ca 0.19 -2.73 -0.34 0.00 -0.26 0.00 0.00 57.72 54.58 1of8 n HIS 243 Cb 0.17 -1.04 -0.06 0.00 1.12 0.00 0.00 29.99 30.18 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 -1.23 0.64 0.03 0.00 -0.71 -0.43 -4.50 117.98 111.79 1of8 s PHE 245 Ca 0.24 -1.00 -0.18 0.00 -1.04 0.00 0.00 56.93 54.94 1of8 s PHE 245 Cb -0.12 -0.27 -0.06 0.00 -1.21 0.00 0.00 43.02 41.36 1of8 s PHE 245 CO 0.14 -0.63 0.52 0.08 -1.34 0.00 0.00 175.22 173.99 1of8 s VAL 246 N -4.01 4.87 -0.19 -2.49 1.01 -1.26 -0.66 120.40 117.67 1of8 s VAL 246 Ca 0.21 1.09 -0.02 0.00 0.00 0.00 0.00 61.98 63.26 1of8 s VAL 246 Cb 0.05 -3.84 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 1of8 s VAL 246 CO 0.01 0.53 -0.08 -0.63 0.00 0.00 0.00 175.10 174.94 1of8 s ILE 247 N -0.90 3.25 -0.30 2.22 1.01 -0.09 -1.46 121.20 124.93 1of8 s ILE 247 Ca 0.27 -0.55 -0.22 0.00 0.00 0.00 0.00 60.65 60.15 1of8 s ILE 247 Cb -0.18 -2.44 -0.00 0.00 0.01 0.00 0.00 42.46 39.85 1of8 s ILE 247 CO 0.17 0.47 0.72 -0.76 0.00 0.00 0.00 174.94 175.54 1of8 s LEU 248 N 1.03 4.11 -0.04 2.97 1.43 0.27 -1.43 118.68 127.02 1of8 s LEU 248 Ca -0.00 0.59 0.05 0.00 -1.03 0.00 0.00 54.13 53.74 1of8 s LEU 248 Cb -0.15 -2.97 0.08 0.00 0.03 0.00 0.00 46.19 43.18 1of8 s LEU 248 CO -0.01 -0.55 1.02 -2.11 0.23 0.00 0.00 176.35 174.93 1of8 n ARG 249 N 6.05 0.42 0.00 1.70 -4.01 -1.26 -0.66 116.66 118.90 1of8 n ARG 249 Ca 0.02 -1.43 0.00 0.00 -1.04 0.00 0.00 57.85 55.40 1of8 n ARG 249 Cb 0.48 -0.79 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 -0.41 -0.34 0.00 2.89 0.00 -1.26 -0.89 105.19 105.18 1of8 n GLY 250 Ca 0.05 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 0.31 0.35 -0.02 0.00 -1.09 -3.92 105.19 100.82 1of8 n GLY 251 Ca 0.00 -1.58 0.04 0.00 0.00 0.00 0.00 46.02 44.48 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 0.83 0.85 0.00 1.61 1.57 -1.20 -0.84 116.57 119.40 1of8 h LYS 252 Ca 0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1of8 h LYS 252 Cb 0.00 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.12 1of8 h LYS 252 CO 0.00 0.56 0.00 1.63 -0.57 0.00 0.00 179.45 181.07 1of8 n LYS 253 N -4.46 0.14 0.00 3.15 5.02 0.02 -4.96 118.16 117.06 1of8 n LYS 253 Ca 0.10 0.26 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 1of8 n LYS 253 Cb 0.15 -1.71 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 1of8 n LYS 253 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1of8 n GLY 254 N 0.59 0.94 3.79 0.72 0.00 -0.32 -5.06 105.19 105.85 1of8 n GLY 254 Ca 0.04 -2.16 -0.31 0.00 0.00 0.00 0.00 46.02 43.59 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 -1.00 3.68 -0.31 2.61 -4.23 -1.26 -2.66 115.64 112.47 1of8 s THR 255 Ca 0.00 0.57 0.18 0.00 -1.18 0.00 0.00 61.69 61.27 1of8 s THR 255 Cb 0.00 -3.18 0.47 0.00 1.34 0.00 0.00 72.50 71.13 1of8 s THR 255 CO 0.00 -0.68 1.14 -0.46 -0.54 0.00 0.00 174.62 174.07 1of8 n ASN 256 N -3.18 0.77 -0.21 3.99 0.23 -1.26 -4.86 115.26 110.74 1of8 n ASN 256 Ca 0.08 -2.34 0.07 0.00 -0.53 0.00 0.00 54.58 51.87 1of8 n ASN 256 Cb 0.53 -0.19 -0.03 0.00 -2.08 0.00 0.00 39.78 38.01 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 -0.53 0.00 -2.26 -2.53 0.18 -1.26 -4.61 117.16 106.16 1of8 n TYR 257 Ca 0.04 0.00 -0.26 0.00 1.88 0.00 0.00 57.90 59.55 1of8 n TYR 257 Cb 0.82 0.00 0.12 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 -1.89 4.16 0.26 9.48 -4.77 -1.26 -4.59 116.67 118.06 1of8 s ASP 258 Ca 0.09 0.12 -0.05 0.00 -3.30 0.00 0.00 52.55 49.41 1of8 s ASP 258 Cb 0.11 -0.50 0.30 0.00 -1.09 0.00 0.00 42.92 41.73 1of8 s ASP 258 CO 0.42 -2.01 1.93 0.00 0.70 0.00 0.00 175.17 176.20 1of8 h ALA 259 N -0.87 1.29 -0.38 2.11 0.00 -1.96 -0.53 119.26 118.92 1of8 h ALA 259 Ca -0.42 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 1of8 h ALA 259 Cb 1.28 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1of8 h ALA 259 CO 0.47 0.64 0.13 -0.22 0.00 0.00 0.00 179.25 180.27 1of8 h LYS 260 N 1.29 0.58 -0.80 0.00 1.63 -1.99 0.47 116.57 117.75 1of8 h LYS 260 Ca 0.34 -0.12 -0.01 0.00 -0.85 0.00 0.00 60.65 60.02 1of8 h LYS 260 Cb -0.12 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.38 1of8 h LYS 260 CO -0.07 0.58 0.47 0.77 -3.45 0.00 0.00 179.45 177.76 1of8 h SER 261 N 0.47 0.98 -0.37 4.20 0.02 -1.74 -0.24 113.55 116.86 1of8 h SER 261 Ca 0.12 -0.07 -0.13 0.00 -0.84 0.00 0.00 61.79 60.87 1of8 h SER 261 Cb 0.24 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 1of8 h SER 261 CO -0.01 0.77 -0.27 0.58 -1.14 0.00 0.00 176.83 176.76 1of8 h VAL 262 N 1.11 1.27 -0.38 2.27 2.07 -0.84 -0.31 116.25 121.45 1of8 h VAL 262 Ca 0.29 -1.42 -0.02 0.00 0.82 0.00 0.00 66.70 66.37 1of8 h VAL 262 Cb -0.02 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1of8 h VAL 262 CO -0.05 0.48 0.17 0.00 0.02 0.00 0.00 177.57 178.19 1of8 h ALA 263 N 0.93 0.49 -0.95 1.67 0.00 -0.56 -0.29 119.26 120.54 1of8 h ALA 263 Ca 0.09 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1of8 h ALA 263 Cb 0.82 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 1of8 h ALA 263 CO 0.07 0.06 0.62 0.93 0.00 0.00 0.00 179.25 180.94 1of8 h GLU 264 N 0.46 1.26 -0.23 0.00 5.08 -0.84 -1.89 114.58 118.43 1of8 h GLU 264 Ca 0.13 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1of8 h GLU 264 Cb 0.15 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1of8 h GLU 264 CO -0.01 0.85 0.09 0.00 -1.00 0.00 0.00 179.01 178.93 1of8 h ALA 265 N 1.34 0.30 -0.34 3.43 0.00 -0.68 -2.90 119.26 120.42 1of8 h ALA 265 Ca 0.35 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1of8 h ALA 265 Cb -0.13 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1of8 h ALA 265 CO -0.07 -0.10 0.06 0.87 0.00 0.00 0.00 179.25 180.00 1of8 h LYS 266 N 0.22 0.50 0.00 0.00 1.57 -0.80 -1.69 116.57 116.37 1of8 h LYS 266 Ca 0.08 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 1of8 h LYS 266 Cb 0.18 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1of8 h LYS 266 CO -0.01 0.49 -0.26 0.00 -0.57 0.00 0.00 179.45 179.10 1of8 h ALA 267 N 1.58 1.33 -0.01 3.86 0.00 -1.15 -2.85 119.26 122.02 1of8 h ALA 267 Ca 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1of8 h ALA 267 Cb 0.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1of8 h ALA 267 CO 0.00 0.33 -0.35 0.00 0.00 0.00 0.00 179.25 179.23 1of8 n GLN 268 N -3.88 0.78 -2.53 0.00 10.64 -0.66 -4.91 117.38 116.83 1of8 n GLN 268 Ca -0.02 -0.51 -0.42 0.00 -1.83 0.00 0.00 57.00 54.22 1of8 n GLN 268 Cb 0.34 -1.49 -0.03 0.00 -0.86 0.00 0.00 30.24 28.21 1of8 n GLN 268 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1of8 s LEU 269 N -2.57 4.31 0.91 2.61 1.43 -1.07 -5.03 118.68 119.27 1of8 s LEU 269 Ca 0.21 1.79 -0.11 0.00 -1.03 0.00 0.00 54.13 54.99 1of8 s LEU 269 Cb 0.19 -3.56 0.14 0.00 0.03 0.00 0.00 46.19 42.98 1of8 s LEU 269 CO 0.56 -0.49 1.09 -2.84 0.23 0.00 0.00 176.35 174.90 1of8 s PRO 270 N 1.74 1.13 0.38 1.29 0.02 -1.26 -4.93 135.00 133.37 1of8 s PRO 270 Ca 0.55 0.87 -0.26 0.00 0.02 0.00 0.00 61.00 62.18 1of8 s PRO 270 Cb -0.24 -1.79 -0.12 0.00 0.02 0.00 0.00 34.50 32.37 1of8 s PRO 270 CO 0.24 -2.34 1.03 0.00 -0.33 0.00 0.00 177.00 175.59 1of8 n ALA 271 N -3.96 0.16 -0.52 -1.55 0.00 -1.26 -1.99 120.51 111.40 1of8 n ALA 271 Ca 0.07 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1of8 n ALA 271 Cb 0.55 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.92 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 1.16 1.14 3.76 0.00 0.00 -1.26 -5.02 105.19 104.97 1of8 n GLY 272 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.09 5.53 0.70 1.61 0.01 -0.84 -5.04 113.70 112.58 1of8 s SER 273 Ca 0.00 2.33 -0.07 0.00 1.31 0.00 0.00 55.95 59.52 1of8 s SER 273 Cb 0.00 -2.60 0.06 0.00 0.21 0.00 0.00 66.02 63.69 1of8 s SER 273 CO 0.00 -1.36 1.02 0.20 0.41 0.00 0.00 173.24 173.51 1of8 s ASN 274 N -1.58 4.88 0.76 2.44 0.01 -1.26 -5.02 114.94 115.17 1of8 s ASN 274 Ca 0.73 0.53 -0.11 0.00 -0.71 0.00 0.00 52.86 53.29 1of8 s ASN 274 Cb -0.28 -1.20 0.05 0.00 0.41 0.00 0.00 41.25 40.23 1of8 s ASN 274 CO 0.32 -1.56 1.10 -0.83 -1.51 0.00 0.00 177.10 174.62 1of8 s GLY 275 N -4.50 1.78 0.33 0.66 0.00 -0.13 -4.84 107.32 100.62 1of8 s GLY 275 Ca 0.60 0.35 -0.14 0.00 0.00 0.00 0.00 44.72 45.52 1of8 s GLY 275 CO 0.45 0.70 0.73 1.08 0.00 0.00 0.00 173.10 176.07 1of8 s LEU 276 N -5.75 4.04 -0.00 0.66 1.43 0.12 -4.45 118.68 114.73 1of8 s LEU 276 Ca 0.63 1.25 0.07 0.00 -1.03 0.00 0.00 54.13 55.05 1of8 s LEU 276 Cb -0.18 -4.06 -0.03 0.00 0.03 0.00 0.00 46.19 41.95 1of8 s LEU 276 CO 0.53 -0.22 -0.21 -0.32 0.23 0.00 0.00 176.35 176.36 1of8 s MET 277 N -3.07 2.15 -0.23 1.70 -2.45 -0.53 -1.17 119.30 115.69 1of8 s MET 277 Ca 0.54 -0.91 -0.03 0.00 -1.25 0.00 0.00 55.69 54.03 1of8 s MET 277 Cb -0.10 -2.16 0.00 0.00 1.25 0.00 0.00 34.83 33.82 1of8 s MET 277 CO 0.19 0.56 -0.05 0.42 1.05 0.00 0.00 175.02 177.20 1of8 s ILE 278 N -0.76 3.21 -0.16 10.11 1.01 -0.19 -0.56 121.20 133.86 1of8 s ILE 278 Ca 0.12 -0.67 -0.29 0.00 0.00 0.00 0.00 60.65 59.81 1of8 s ILE 278 Cb -0.10 -2.51 -0.01 0.00 0.01 0.00 0.00 42.46 39.85 1of8 s ILE 278 CO 0.02 0.35 1.08 -0.62 0.00 0.00 0.00 174.94 175.76 1of8 s ASP 279 N 1.43 7.12 0.33 3.58 -1.08 0.17 -1.30 116.67 126.91 1of8 s ASP 279 Ca 0.04 1.52 0.26 0.00 -0.52 0.00 0.00 52.55 53.85 1of8 s ASP 279 Cb -0.15 -2.55 0.84 0.00 -1.46 0.00 0.00 42.92 39.61 1of8 s ASP 279 CO -0.04 -0.61 1.76 1.88 0.52 0.00 0.00 175.17 178.69 1of8 h TYR 280 N 7.45 0.00 -2.51 -5.34 -1.99 -1.16 -3.42 116.97 110.00 1of8 h TYR 280 Ca -0.25 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.48 1of8 h TYR 280 Cb 1.10 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.83 1of8 h TYR 280 CO 0.74 0.00 0.00 0.45 -0.00 0.00 0.00 178.16 179.35 1of8 n SER 281 N -2.57 0.57 0.00 3.88 2.88 -1.26 -3.37 113.62 113.74 1of8 n SER 281 Ca 0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 1of8 n SER 281 Cb 0.38 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 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 0.00 0.00 0.25 0.66 8.25 -1.26 -1.55 115.22 121.56 1of8 n HIS 282 Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.54 1of8 n HIS 282 Cb 0.00 0.00 0.62 0.00 1.12 0.00 0.00 29.99 31.73 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 2.00 -1.41 0.00 -1.30 -2.43 103.07 99.93 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 0.00 3.43 0.00 0.00 0.00 176.54 179.97 1of8 h ASN 284 N 0.00 0.00 0.05 0.19 2.35 -1.03 -2.68 115.58 114.46 1of8 h ASN 284 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1of8 h ASN 284 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1of8 h ASN 284 CO 0.01 0.00 -0.26 -1.20 -1.65 0.00 0.00 177.43 174.33 1of8 n SER 285 N -2.61 1.88 -3.72 5.81 7.64 -0.92 -4.85 113.62 116.85 1of8 n SER 285 Ca 0.03 -1.44 -0.24 0.00 1.01 0.00 0.00 58.87 58.23 1of8 n SER 285 Cb 0.33 0.23 0.04 0.00 -1.01 0.00 0.00 64.21 63.81 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 0.10 -3.08 -3.18 6.43 5.03 -1.01 -1.83 115.26 117.73 1of8 n ASN 286 Ca 0.12 -0.74 -0.20 0.00 0.87 0.00 0.00 54.58 54.63 1of8 n ASN 286 Cb 0.45 -4.27 0.07 0.00 -1.02 0.00 0.00 39.78 35.00 1of8 n ASN 286 CO 0.00 0.00 0.00 2.29 -1.83 0.00 0.00 177.26 177.72 1of8 n LYS 287 N -4.48 -6.71 -3.15 3.52 -0.00 -1.26 -5.02 118.16 101.06 1of8 n LYS 287 Ca -0.15 0.73 0.05 0.00 -0.00 0.00 0.00 58.31 58.93 1of8 n LYS 287 Cb 0.62 -5.45 -0.01 0.00 -0.00 0.00 0.00 35.03 30.19 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 -3.47 -1.10 0.58 -5.58 -1.08 -0.76 -5.03 116.67 100.23 1of8 s ASP 288 Ca 0.40 0.46 0.28 0.00 -0.52 0.00 0.00 52.55 53.17 1of8 s ASP 288 Cb -0.18 1.83 1.54 0.00 -1.46 0.00 0.00 42.92 44.65 1of8 s ASP 288 CO 0.64 -0.20 2.01 2.19 0.52 0.00 0.00 175.17 180.32 1of8 h PHE 289 N 7.90 0.00 0.00 -5.34 -5.15 -1.82 0.07 116.94 112.60 1of8 h PHE 289 Ca -0.13 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.64 1of8 h PHE 289 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.34 1of8 h PHE 289 CO 0.10 0.00 0.00 0.00 -2.00 0.00 0.00 178.31 176.41 1of8 h ARG 290 N 0.00 0.00 0.00 6.09 3.08 -1.92 -1.75 114.38 119.88 1of8 h ARG 290 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1of8 h ARG 290 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.87 1of8 h ARG 290 CO -0.00 0.00 0.00 0.09 -1.07 0.00 0.00 179.97 178.99 1of8 n ASN 291 N -2.46 0.60 -0.26 7.04 3.02 0.01 -4.18 115.26 119.03 1of8 n ASN 291 Ca 0.01 0.56 -0.04 0.00 -0.03 0.00 0.00 54.58 55.08 1of8 n ASN 291 Cb 0.19 -0.72 0.07 0.00 -0.61 0.00 0.00 39.78 38.71 1of8 n ASN 291 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1of8 h GLN 292 N 0.00 0.90 -0.02 3.52 4.20 -1.48 -0.96 115.11 121.26 1of8 h GLN 292 Ca 0.00 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 1of8 h GLN 292 Cb 0.65 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 1of8 h GLN 292 CO 0.00 0.59 -0.13 -1.35 -0.67 0.00 0.00 178.83 177.28 1of8 h PRO 293 N 0.93 0.03 -0.48 1.46 0.11 -1.80 -1.08 132.00 131.17 1of8 h PRO 293 Ca 0.27 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 66.25 1of8 h PRO 293 Cb -0.05 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 1of8 h PRO 293 CO -0.08 0.16 -0.21 0.87 -0.21 0.00 0.00 178.00 178.53 1of8 h LYS 294 N 0.03 0.99 -0.46 1.05 1.57 -1.44 -1.70 116.57 116.61 1of8 h LYS 294 Ca 0.01 -0.42 -0.03 0.00 -1.87 0.00 0.00 60.65 58.34 1of8 h LYS 294 Cb 0.25 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 1of8 h LYS 294 CO 0.02 1.09 0.17 0.28 -0.57 0.00 0.00 179.45 180.44 1of8 h VAL 295 N 0.85 1.21 -0.65 0.50 2.07 -0.88 -2.53 116.25 116.82 1of8 h VAL 295 Ca 0.11 -0.66 0.10 0.00 0.82 0.00 0.00 66.70 67.07 1of8 h VAL 295 Cb 0.79 0.79 -0.08 0.00 -1.52 0.00 0.00 31.29 31.26 1of8 h VAL 295 CO 0.07 0.25 0.26 -1.13 0.02 0.00 0.00 177.57 177.03 1of8 h ASN 296 N 0.60 0.27 -0.83 0.57 -1.24 -0.93 -0.50 115.58 113.52 1of8 h ASN 296 Ca 0.15 0.08 0.03 0.00 0.71 0.00 0.00 56.30 57.27 1of8 h ASN 296 Cb 0.21 0.05 -0.05 0.00 0.73 0.00 0.00 38.32 39.27 1of8 h ASN 296 CO -0.01 0.15 0.54 0.44 -1.29 0.00 0.00 177.43 177.26 1of8 h ASP 297 N 0.44 0.90 -0.28 1.15 3.45 -0.89 0.15 116.42 121.34 1of8 h ASP 297 Ca 0.33 -0.01 -0.17 0.00 0.43 0.00 0.00 57.03 57.62 1of8 h ASP 297 Cb 0.42 -0.20 -0.00 0.00 -0.56 0.00 0.00 39.33 38.98 1of8 h ASP 297 CO -0.32 0.62 -0.46 0.58 -1.57 0.00 0.00 179.24 178.09 1of8 h VAL 298 N 1.05 1.28 -0.31 -1.35 2.07 -1.08 -1.64 116.25 116.27 1of8 h VAL 298 Ca 0.33 -1.65 -0.06 0.00 0.82 0.00 0.00 66.70 66.14 1of8 h VAL 298 Cb -0.01 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1of8 h VAL 298 CO -0.11 0.54 -0.05 0.58 0.02 0.00 0.00 177.57 178.55 1of8 h VAL 299 N 0.68 1.27 -0.82 2.57 2.07 -0.87 -2.95 116.25 118.21 1of8 h VAL 299 Ca 0.04 -1.07 0.05 0.00 0.82 0.00 0.00 66.70 66.54 1of8 h VAL 299 Cb 1.05 1.34 -0.06 0.00 -1.52 0.00 0.00 31.29 32.11 1of8 h VAL 299 CO 0.11 0.35 0.51 0.00 0.02 0.00 0.00 177.57 178.55 1of8 h GLU 301 N 0.94 0.91 0.08 0.00 4.22 -1.25 0.11 114.58 119.58 1of8 h GLU 301 Ca 0.35 -0.05 -0.00 0.00 0.08 0.00 0.00 59.36 59.73 1of8 h GLU 301 Cb 0.13 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1of8 h GLU 301 CO -0.16 0.60 -0.04 1.96 -2.18 0.00 0.00 179.01 179.20 1of8 h GLN 302 N 0.93 -0.10 -0.04 1.92 4.20 -1.18 -2.61 115.11 118.23 1of8 h GLN 302 Ca 0.29 0.01 0.02 0.00 0.06 0.00 0.00 58.65 59.03 1of8 h GLN 302 Cb -0.02 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 1of8 h GLN 302 CO -0.10 0.20 -0.10 0.82 -0.67 0.00 0.00 178.83 178.99 1of8 h ILE 303 N -0.40 0.75 -0.15 2.54 2.04 -1.04 -1.38 117.51 119.87 1of8 h ILE 303 Ca -0.01 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.86 1of8 h ILE 303 Cb 0.35 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1of8 h ILE 303 CO 0.02 0.00 0.10 0.00 0.00 0.00 0.00 178.15 178.27 1of8 h ALA 304 N 0.87 1.96 -0.27 1.87 0.00 -0.80 -0.85 119.26 122.05 1of8 h ALA 304 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1of8 h ALA 304 Cb 0.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1of8 h ALA 304 CO -0.13 0.03 0.00 0.09 0.00 0.00 0.00 179.25 179.24 1of8 n ASN 305 N -4.51 2.10 0.00 0.00 4.13 -0.99 -3.75 115.26 112.24 1of8 n ASN 305 Ca -0.00 -1.83 0.00 0.00 1.68 0.00 0.00 54.58 54.43 1of8 n ASN 305 Cb 0.12 -0.17 0.00 0.00 -1.54 0.00 0.00 39.78 38.19 1of8 n ASN 305 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1of8 n GLY 306 N 1.20 1.45 3.59 7.41 0.00 -0.33 -5.04 105.19 113.47 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 -0.18 3.46 0.07 1.61 2.56 -0.55 -4.84 118.70 120.83 1of8 s GLU 307 Ca 0.00 0.70 0.24 0.00 0.00 0.00 0.00 54.97 55.91 1of8 s GLU 307 Cb 0.00 -4.06 0.28 0.00 2.00 0.00 0.00 34.13 32.35 1of8 s GLU 307 CO 0.00 -1.72 1.24 0.09 -0.56 0.00 0.00 175.26 174.31 1of8 n ASN 308 N 9.11 0.63 0.22 -1.70 3.02 -1.26 -4.06 115.26 121.22 1of8 n ASN 308 Ca 0.15 -0.09 0.14 0.00 -0.03 0.00 0.00 54.58 54.74 1of8 n ASN 308 Cb 0.49 0.40 0.36 0.00 -0.61 0.00 0.00 39.78 40.42 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 2.65 1.00 -1.82 5.41 0.00 -1.96 -3.40 119.26 121.13 1of8 h ALA 309 Ca 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 54.91 54.31 1of8 h ALA 309 Cb 0.68 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.35 1of8 h ALA 309 CO 0.00 0.00 0.59 0.42 0.00 0.00 0.00 179.25 180.26 1of8 s ILE 310 N -3.34 4.39 -0.49 0.00 1.01 -1.26 -0.70 121.20 120.81 1of8 s ILE 310 Ca 0.05 0.43 0.11 0.00 0.00 0.00 0.00 60.65 61.24 1of8 s ILE 310 Cb 0.07 -4.52 -0.12 0.00 0.01 0.00 0.00 42.46 37.90 1of8 s ILE 310 CO 0.61 -1.06 0.45 0.35 0.00 0.00 0.00 174.94 175.30 1of8 n THR 311 N 6.28 0.00 -3.85 2.92 -2.24 -0.32 -4.93 114.28 112.14 1of8 n THR 311 Ca 0.03 -0.24 -0.10 0.00 -2.27 0.00 0.00 64.05 61.46 1of8 n THR 311 Cb 0.48 0.96 -0.08 0.00 -2.10 0.00 0.00 70.33 69.59 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 -2.09 0.03 0.07 3.38 0.00 -0.92 -0.68 107.32 107.12 1of8 s GLY 312 Ca 0.04 -0.27 0.01 0.00 0.00 0.00 0.00 44.72 44.49 1of8 s GLY 312 CO 0.45 -0.45 -0.05 -1.34 0.00 0.00 0.00 173.10 171.71 1of8 s VAL 313 N -2.51 0.47 -0.04 1.40 -7.23 0.09 -1.02 120.40 111.56 1of8 s VAL 313 Ca -0.06 -1.72 0.03 0.00 -1.81 0.00 0.00 61.98 58.42 1of8 s VAL 313 Cb -0.01 -1.40 0.00 0.00 0.56 0.00 0.00 36.38 35.53 1of8 s VAL 313 CO -0.04 -0.84 -0.12 -0.32 -0.31 0.00 0.00 175.10 173.48 1of8 s MET 314 N -3.44 1.34 -0.03 4.82 -2.45 -0.42 -1.25 119.30 117.86 1of8 s MET 314 Ca 0.06 -0.42 0.01 0.00 -1.25 0.00 0.00 55.69 54.08 1of8 s MET 314 Cb 0.03 -1.19 0.02 0.00 1.25 0.00 0.00 34.83 34.94 1of8 s MET 314 CO -0.06 0.15 -0.02 0.42 1.05 0.00 0.00 175.02 176.56 1of8 s ILE 315 N 0.21 0.31 -0.43 10.11 1.01 -0.35 -0.63 121.20 131.43 1of8 s ILE 315 Ca -0.05 -0.04 -0.18 0.00 0.00 0.00 0.00 60.65 60.38 1of8 s ILE 315 Cb -0.11 -0.35 0.02 0.00 0.01 0.00 0.00 42.46 42.04 1of8 s ILE 315 CO 0.01 0.15 0.50 -1.61 0.00 0.00 0.00 174.94 173.99 1of8 s GLU 316 N 0.71 3.14 0.00 2.79 2.02 -1.26 -2.10 118.70 124.01 1of8 s GLU 316 Ca -0.08 -0.68 0.01 0.00 0.02 0.00 0.00 54.97 54.24 1of8 s GLU 316 Cb -0.11 -3.97 -0.01 0.00 0.10 0.00 0.00 34.13 30.14 1of8 s GLU 316 CO -0.01 -0.91 -0.03 0.45 0.02 0.00 0.00 175.26 174.78 1of8 s SER 317 N 1.90 0.32 0.29 -0.19 0.15 0.15 -1.35 113.70 114.97 1of8 s SER 317 Ca 0.15 -0.13 0.06 0.00 0.70 0.00 0.00 55.95 56.73 1of8 s SER 317 Cb -0.16 -0.01 -0.02 0.00 -1.71 0.00 0.00 66.02 64.11 1of8 s SER 317 CO 0.15 -0.02 0.26 -3.20 1.20 0.00 0.00 173.24 171.63 1of8 n ASN 318 N 2.76 -0.66 0.13 5.45 2.85 0.17 -0.63 115.26 125.34 1of8 n ASN 318 Ca -0.14 -2.91 -0.13 0.00 -0.11 0.00 0.00 54.58 51.28 1of8 n ASN 318 Cb 0.58 1.52 -0.07 0.00 1.24 0.00 0.00 39.78 43.06 1of8 n ASN 318 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1of8 h ILE 319 N 1.94 0.67 -3.68 -1.44 2.04 -1.85 -2.25 117.51 112.95 1of8 h ILE 319 Ca -0.21 0.00 -0.67 0.00 1.00 0.00 0.00 64.86 64.98 1of8 h ILE 319 Cb 1.06 0.67 -0.18 0.00 -0.74 0.00 0.00 36.82 37.63 1of8 h ILE 319 CO 0.30 0.00 -0.78 0.20 0.00 0.00 0.00 178.15 177.87 1of8 s ASN 320 N -4.90 4.04 0.78 1.72 0.01 -0.59 -1.63 114.94 114.38 1of8 s ASN 320 Ca -0.15 -0.51 -0.12 0.00 -0.71 0.00 0.00 52.86 51.38 1of8 s ASN 320 Cb 0.06 -0.63 0.06 0.00 0.41 0.00 0.00 41.25 41.15 1of8 s ASN 320 CO 0.65 0.18 1.12 -1.83 -1.51 0.00 0.00 177.10 175.71 1of8 s GLU 321 N -2.15 2.22 1.32 -0.60 -1.05 -1.26 -4.53 118.70 112.65 1of8 s GLU 321 Ca 0.19 0.39 0.00 0.00 -0.15 0.00 0.00 54.97 55.39 1of8 s GLU 321 Cb -0.11 -1.96 0.00 0.00 -0.44 0.00 0.00 34.13 31.63 1of8 s GLU 321 CO 0.11 -1.47 0.00 0.41 0.95 0.00 0.00 175.26 175.26 1of8 n GLY 322 N -2.78 -1.54 3.44 -3.83 0.00 -0.13 -4.86 105.19 95.49 1of8 n GLY 322 Ca 0.07 -1.55 -0.15 0.00 0.00 0.00 0.00 46.02 44.39 1of8 n GLY 322 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1of8 s ASN 323 N -4.00 1.03 0.04 1.61 4.22 -1.26 -2.31 114.94 114.26 1of8 s ASN 323 Ca 0.00 -1.53 -0.09 0.00 -2.14 0.00 0.00 52.86 49.10 1of8 s ASN 323 Cb 0.00 0.63 0.00 0.00 1.28 0.00 0.00 41.25 43.17 1of8 s ASN 323 CO 0.00 -1.23 0.19 0.00 -2.04 0.00 0.00 177.10 174.02 1of8 s GLN 324 N -3.18 0.67 0.55 3.55 -2.07 0.02 -4.90 119.66 114.30 1of8 s GLN 324 Ca 0.33 -0.60 -0.14 0.00 -1.82 0.00 0.00 55.36 53.12 1of8 s GLN 324 Cb 0.00 0.28 -0.06 0.00 -1.09 0.00 0.00 33.01 32.14 1of8 s GLN 324 CO 0.21 -0.19 1.00 0.20 -1.32 0.00 0.00 175.29 175.19 1of8 s GLY 325 N -2.01 1.91 -0.29 2.60 0.00 -1.26 -4.39 107.32 103.88 1of8 s GLY 325 Ca -0.06 0.07 -0.17 0.00 0.00 0.00 0.00 44.72 44.57 1of8 s GLY 325 CO -0.03 0.34 0.45 -0.42 0.00 0.00 0.00 173.10 173.44 1of8 s ILE 326 N -2.82 5.10 -0.29 0.90 1.01 -1.26 -5.04 121.20 118.79 1of8 s ILE 326 Ca 0.57 0.57 -0.16 0.00 0.00 0.00 0.00 60.65 61.63 1of8 s ILE 326 Cb -0.10 -3.82 0.15 0.00 0.01 0.00 0.00 42.46 38.70 1of8 s ILE 326 CO 0.40 0.02 1.02 -0.76 0.00 0.00 0.00 174.94 175.61 1of8 s LEU 334 N 2.23 -0.44 0.24 2.97 2.01 -1.26 -5.22 118.68 119.21 1of8 s LEU 334 Ca 0.18 0.71 -0.31 0.00 0.01 0.00 0.00 54.13 54.71 1of8 s LEU 334 Cb -0.16 1.65 -0.13 0.00 0.01 0.00 0.00 46.19 47.57 1of8 s LEU 334 CO 0.11 -0.11 1.53 0.29 1.01 0.00 0.00 176.35 179.17 1of8 n LYS 335 N 3.57 2.34 -1.78 1.70 5.02 -1.26 -4.95 118.16 122.80 1of8 n LYS 335 Ca -0.18 0.84 -0.41 0.00 -2.02 0.00 0.00 58.31 56.53 1of8 n LYS 335 Cb 0.57 -2.57 -0.01 0.00 -0.02 0.00 0.00 35.03 33.00 1of8 n LYS 335 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1of8 s TYR 336 N 0.25 2.72 -0.95 2.13 5.04 -1.26 -3.46 117.35 121.81 1of8 s TYR 336 Ca 0.69 0.84 0.00 0.00 -2.44 0.00 0.00 57.07 56.16 1of8 s TYR 336 Cb -0.59 -4.07 0.00 0.00 0.35 0.00 0.00 41.96 37.65 1of8 s TYR 336 CO 0.45 -3.52 0.00 0.41 -1.34 0.00 0.00 175.55 171.56 1of8 n GLY 337 N 1.89 1.05 3.28 8.97 0.00 -1.26 -4.79 105.19 114.34 1of8 n GLY 337 Ca 0.07 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.25 2.36 0.38 1.61 1.01 -1.22 -1.54 120.40 120.75 1of8 s VAL 338 Ca 0.00 -0.93 -0.28 0.00 0.00 0.00 0.00 61.98 60.77 1of8 s VAL 338 Cb 0.00 -1.92 -0.11 0.00 0.00 0.00 0.00 36.38 34.35 1of8 s VAL 338 CO 0.00 0.56 1.49 -0.24 0.00 0.00 0.00 175.10 176.91 1of8 n SER 339 N 3.31 3.81 -1.11 3.32 2.88 -1.26 -4.77 113.62 119.81 1of8 n SER 339 Ca -0.18 1.23 0.11 0.00 -1.33 0.00 0.00 58.87 58.70 1of8 n SER 339 Cb 0.53 -1.62 0.26 0.00 -0.75 0.00 0.00 64.21 62.62 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 0.46 0.57 0.00 2.46 -5.35 -1.26 -0.80 119.36 115.44 1of8 n ILE 340 Ca 0.01 -0.74 0.00 0.00 -0.27 0.00 0.00 62.75 61.76 1of8 n ILE 340 Cb 0.39 0.76 0.00 0.00 -1.74 0.00 0.00 39.64 39.05 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 1.35 0.00 -2.20 7.28 -2.24 -1.26 -4.78 114.28 112.43 1of8 n THR 341 Ca 0.20 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.63 1of8 n THR 341 Cb 0.56 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.80 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 5.71 0.34 3.42 -0.00 -1.26 -4.71 116.67 121.17 1of8 s ASP 342 Ca 0.00 2.08 -0.27 0.00 -0.00 0.00 0.00 52.55 54.36 1of8 s ASP 342 Cb 0.00 -2.57 -0.09 0.00 -0.00 0.00 0.00 42.92 40.26 1of8 s ASP 342 CO 0.00 -1.22 1.16 0.00 -0.00 0.00 0.00 175.17 175.11 1of8 s ALA 343 N -1.95 3.30 0.21 5.23 0.00 -1.26 -4.68 121.76 122.62 1of8 s ALA 343 Ca 0.70 0.98 0.11 0.00 0.00 0.00 0.00 51.96 53.75 1of8 s ALA 343 Cb -0.22 -3.37 -0.05 0.00 0.00 0.00 0.00 23.12 19.49 1of8 s ALA 343 CO 0.29 -0.39 -0.19 0.00 0.00 0.00 0.00 175.76 175.47 1of8 s ILE 345 N -1.90 3.37 0.72 0.00 -4.36 -0.45 -0.95 121.20 117.62 1of8 s ILE 345 Ca 0.24 0.61 -0.06 0.00 -0.26 0.00 0.00 60.65 61.18 1of8 s ILE 345 Cb -0.07 -3.13 0.15 0.00 1.25 0.00 0.00 42.46 40.66 1of8 s ILE 345 CO 0.12 -0.43 0.99 0.61 0.24 0.00 0.00 174.94 176.47 1of8 n GLY 346 N -0.74 -0.18 0.19 6.27 0.00 -1.26 -0.65 105.19 108.83 1of8 n GLY 346 Ca 0.10 -1.90 -0.12 0.00 0.00 0.00 0.00 46.02 44.10 1of8 n GLY 346 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1of8 h TRP 347 N -1.01 0.70 -0.37 1.61 2.91 -0.67 -1.70 115.95 117.43 1of8 h TRP 347 Ca -0.32 -0.18 -0.06 0.00 1.13 0.00 0.00 58.89 59.46 1of8 h TRP 347 Cb 1.05 -0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 29.53 1of8 h TRP 347 CO 0.00 0.85 -0.01 0.93 -1.03 0.00 0.00 178.44 179.18 1of8 h GLU 348 N 0.36 0.66 -0.88 2.65 3.07 -1.89 -0.54 114.58 118.00 1of8 h GLU 348 Ca 0.06 -0.22 0.05 0.00 -0.50 0.00 0.00 59.36 58.76 1of8 h GLU 348 Cb 0.66 -0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 28.46 1of8 h GLU 348 CO 0.04 0.77 0.58 1.15 -1.40 0.00 0.00 179.01 180.16 1of8 h THR 349 N 0.48 1.11 -0.43 1.13 2.02 -1.94 -2.40 112.91 112.88 1of8 h THR 349 Ca 0.10 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.89 1of8 h THR 349 Cb 0.48 -0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.83 1of8 h THR 349 CO 0.02 0.19 0.14 0.74 0.37 0.00 0.00 175.52 176.99 1of8 h THR 350 N 1.06 1.22 -0.56 3.16 2.02 -0.29 -0.38 112.91 119.14 1of8 h THR 350 Ca 0.36 -0.71 0.07 0.00 0.77 0.00 0.00 66.41 66.90 1of8 h THR 350 Cb 0.10 0.87 -0.06 0.00 -1.74 0.00 0.00 68.15 67.32 1of8 h THR 350 CO -0.12 0.26 0.23 -0.33 0.37 0.00 0.00 175.52 175.92 1of8 h GLU 351 N 0.56 0.42 -0.25 6.66 5.08 -0.84 -0.57 114.58 125.64 1of8 h GLU 351 Ca 0.14 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 1of8 h GLU 351 Cb 0.25 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1of8 h GLU 351 CO -0.01 0.28 0.06 -0.44 -1.00 0.00 0.00 179.01 177.90 1of8 h ASP 352 N 0.43 0.38 -0.40 1.42 3.45 -0.98 -1.07 116.42 119.65 1of8 h ASP 352 Ca 0.27 -0.23 -0.00 0.00 0.43 0.00 0.00 57.03 57.50 1of8 h ASP 352 Cb 0.27 -0.10 -0.02 0.00 -0.56 0.00 0.00 39.33 38.92 1of8 h ASP 352 CO -0.24 0.51 0.24 0.58 -1.57 0.00 0.00 179.24 178.76 1of8 h VAL 353 N 0.23 1.13 -0.09 -1.35 2.07 -0.81 -1.91 116.25 115.51 1of8 h VAL 353 Ca 0.08 -0.29 -0.18 0.00 0.82 0.00 0.00 66.70 67.13 1of8 h VAL 353 Cb 0.28 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1of8 h VAL 353 CO 0.00 0.13 -0.70 -0.07 0.02 0.00 0.00 177.57 176.95 1of8 h LEU 354 N 0.52 0.48 -1.04 2.57 3.38 -0.95 -1.04 115.31 119.24 1of8 h LEU 354 Ca 0.14 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 1of8 h LEU 354 Cb -0.00 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1of8 h LEU 354 CO -0.03 1.03 0.01 0.03 0.09 0.00 0.00 178.44 179.58 1of8 h ARG 355 N 0.29 0.69 -0.26 1.13 3.08 -1.06 0.15 114.38 118.40 1of8 h ARG 355 Ca -0.02 -0.17 -0.18 0.00 0.07 0.00 0.00 59.98 59.68 1of8 h ARG 355 Cb 1.26 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 31.22 1of8 h ARG 355 CO 0.12 0.70 -0.54 0.87 -1.07 0.00 0.00 179.97 180.05 1of8 h LYS 356 N 0.66 0.78 -0.55 0.04 1.57 -1.11 -1.83 116.57 116.12 1of8 h LYS 356 Ca 0.13 -0.49 -0.06 0.00 -1.87 0.00 0.00 60.65 58.36 1of8 h LYS 356 Cb 0.39 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1of8 h LYS 356 CO 0.01 1.12 0.10 1.25 -0.57 0.00 0.00 179.45 181.36 1of8 h LEU 357 N 0.60 0.87 -0.90 2.94 5.85 -0.84 -1.58 115.31 122.24 1of8 h LEU 357 Ca 0.01 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.47 1of8 h LEU 357 Cb 1.13 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.88 1of8 h LEU 357 CO 0.11 0.90 0.54 0.00 -0.34 0.00 0.00 178.44 179.65 1of8 h ALA 358 N 1.00 1.14 -0.85 1.25 0.00 -0.84 -1.29 119.26 119.67 1of8 h ALA 358 Ca 0.17 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1of8 h ALA 358 Cb 0.40 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1of8 h ALA 358 CO 0.01 0.60 0.53 0.00 0.00 0.00 0.00 179.25 180.39 1of8 h ALA 359 N 1.29 1.08 -0.72 0.00 0.00 -0.90 -1.66 119.26 118.36 1of8 h ALA 359 Ca 0.32 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 1of8 h ALA 359 Cb -0.05 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.37 1of8 h ALA 359 CO -0.06 0.53 0.20 0.00 0.00 0.00 0.00 179.25 179.92 1of8 h ALA 360 N 1.29 1.01 -0.69 0.00 0.00 -0.54 -0.98 119.26 119.34 1of8 h ALA 360 Ca 0.31 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1of8 h ALA 360 Cb -0.07 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 1of8 h ALA 360 CO -0.06 0.66 0.46 0.28 0.00 0.00 0.00 179.25 180.59 1of8 h VAL 361 N 1.07 1.17 -0.72 0.00 2.07 -0.88 0.16 116.25 119.13 1of8 h VAL 361 Ca 0.23 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 1of8 h VAL 361 Cb 0.33 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 1of8 h VAL 361 CO -0.00 0.17 0.34 0.03 0.02 0.00 0.00 177.57 178.12 1of8 h ARG 362 N 0.93 1.04 -0.70 1.57 3.08 -0.81 -2.03 114.38 117.46 1of8 h ARG 362 Ca 0.25 -0.16 -0.06 0.00 0.07 0.00 0.00 59.98 60.08 1of8 h ARG 362 Cb -0.10 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 29.73 1of8 h ARG 362 CO -0.06 0.82 0.20 1.96 -1.07 0.00 0.00 179.97 181.82 1of8 h GLN 363 N 1.01 1.11 -0.85 0.04 4.20 -0.83 -2.46 115.11 117.32 1of8 h GLN 363 Ca 0.25 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 1of8 h GLN 363 Cb 0.13 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 27.72 1of8 h GLN 363 CO -0.03 0.97 0.51 -0.09 -0.67 0.00 0.00 178.83 179.52 1of8 h ARG 364 N 1.05 1.15 -0.81 1.46 2.43 -0.73 -1.77 114.38 117.16 1of8 h ARG 364 Ca 0.22 -0.10 0.04 0.00 -0.81 0.00 0.00 59.98 59.33 1of8 h ARG 364 Cb 0.34 -0.24 -0.05 0.00 -0.42 0.00 0.00 29.97 29.59 1of8 h ARG 364 CO -0.00 0.81 0.51 0.00 -1.51 0.00 0.00 179.97 179.77 1of8 h ARG 365 N 1.17 0.94 -0.48 0.20 3.08 -0.93 -0.94 114.38 117.44 1of8 h ARG 365 Ca 0.31 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.26 1of8 h ARG 365 Cb -0.05 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.77 1of8 h ARG 365 CO -0.06 0.62 0.15 0.93 -1.07 0.00 0.00 179.97 180.55 1of8 h GLU 366 N 0.97 0.74 -1.00 0.04 4.39 -1.00 -2.85 114.58 115.86 1of8 h GLU 366 Ca 0.33 -0.16 0.02 0.00 0.34 0.00 0.00 59.36 59.90 1of8 h GLU 366 Cb 0.06 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 28.55 1of8 h GLU 366 CO -0.13 0.69 0.66 0.28 -1.16 0.00 0.00 179.01 179.36 1of8 h VAL 367 N 0.63 1.23 0.00 3.13 2.07 -0.81 -3.52 116.25 118.98 1of8 h VAL 367 Ca 0.15 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1of8 h VAL 367 Cb 0.26 -0.22 0.00 0.00 -1.52 0.00 0.00 31.29 29.81 1of8 h VAL 367 CO -0.01 0.24 0.00 0.59 0.02 0.00 0.00 177.57 178.42