#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x26 s PRO 26 N 0.00 -0.20 0.10 4.33 0.04 -1.26 -4.80 135.00 133.21 2x26 s PRO 26 Ca 0.00 -0.11 -0.16 0.00 0.04 0.00 0.00 61.00 60.77 2x26 s PRO 26 Cb 0.00 -1.72 -0.06 0.00 0.04 0.00 0.00 34.50 32.75 2x26 s PRO 26 CO 0.00 -3.02 1.48 1.49 0.04 0.00 0.00 177.00 176.99 2x26 h GLU 27 N -2.08 0.63 -4.43 4.56 4.81 -1.96 -3.37 114.58 112.73 2x26 h GLU 27 Ca -0.46 -0.26 -0.23 0.00 -0.13 0.00 0.00 59.36 58.28 2x26 h GLU 27 Cb 1.28 -0.03 -0.20 0.00 0.63 0.00 0.00 28.75 30.43 2x26 h GLU 27 CO 0.40 0.83 -0.72 0.00 -0.73 0.00 0.00 179.01 178.79 2x26 s ALA 28 N -4.70 0.53 -0.16 2.92 0.00 -1.26 -0.57 121.76 118.52 2x26 s ALA 28 Ca -0.13 -0.84 -0.03 0.00 0.00 0.00 0.00 51.96 50.96 2x26 s ALA 28 Cb 0.09 0.10 0.05 0.00 0.00 0.00 0.00 23.12 23.36 2x26 s ALA 28 CO 0.79 -0.10 0.05 -1.17 0.00 0.00 0.00 175.76 175.33 2x26 s LEU 29 N -1.84 0.84 -0.27 0.00 2.96 -0.36 -4.89 118.68 115.12 2x26 s LEU 29 Ca -0.07 -0.63 -0.08 0.00 -0.22 0.00 0.00 54.13 53.14 2x26 s LEU 29 Cb -0.07 -0.46 -0.02 0.00 0.50 0.00 0.00 46.19 46.14 2x26 s LEU 29 CO -0.01 -0.30 0.09 -0.13 -1.32 0.00 0.00 176.35 174.67 2x26 s ARG 30 N 1.96 3.50 -0.16 1.98 0.52 -1.26 -1.35 118.95 124.14 2x26 s ARG 30 Ca 0.01 -0.59 -0.02 0.00 -0.52 0.00 0.00 55.73 54.61 2x26 s ARG 30 Cb -0.16 -3.38 -0.02 0.00 0.52 0.00 0.00 34.95 31.92 2x26 s ARG 30 CO -0.08 -0.28 -0.07 0.42 0.02 0.00 0.00 175.30 175.32 2x26 s ILE 31 N 1.59 3.48 -0.19 1.52 1.01 -0.11 -0.03 121.20 128.47 2x26 s ILE 31 Ca 0.05 -0.50 -0.17 0.00 0.00 0.00 0.00 60.65 60.04 2x26 s ILE 31 Cb -0.16 -2.51 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 2x26 s ILE 31 CO 0.04 0.49 0.43 -0.83 0.00 0.00 0.00 174.94 175.06 2x26 s GLY 32 N 0.60 2.12 0.27 6.18 0.00 0.06 -0.23 107.32 116.32 2x26 s GLY 32 Ca -0.05 -0.46 0.04 0.00 0.00 0.00 0.00 44.72 44.25 2x26 s GLY 32 CO 0.03 0.85 -0.00 -2.52 0.00 0.00 0.00 173.10 171.45 2x26 s TYR 33 N 1.27 1.76 0.26 1.90 -0.85 -0.44 -3.17 117.35 118.08 2x26 s TYR 33 Ca 0.21 -0.88 0.09 0.00 -0.52 0.00 0.00 57.07 55.97 2x26 s TYR 33 Cb -0.15 -1.05 -0.05 0.00 0.38 0.00 0.00 41.96 41.09 2x26 s TYR 33 CO 0.08 0.05 -0.14 -0.65 -1.52 0.00 0.00 175.55 173.37 2x26 s GLN 34 N -3.84 1.56 0.45 -3.49 -0.21 -1.26 -0.71 119.66 112.16 2x26 s GLN 34 Ca 0.31 -1.74 0.14 0.00 0.02 0.00 0.00 55.36 54.09 2x26 s GLN 34 Cb 0.06 -1.43 1.06 0.00 1.00 0.00 0.00 33.01 33.70 2x26 s GLN 34 CO 0.11 0.20 2.03 0.87 -2.12 0.00 0.00 175.29 176.38 2x26 h LYS 35 N 2.33 0.33 -0.46 2.91 1.57 -1.78 0.20 116.57 121.66 2x26 h LYS 35 Ca -0.40 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 2x26 h LYS 35 Cb 1.24 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2x26 h LYS 35 CO 0.63 0.22 0.00 0.41 -0.57 0.00 0.00 179.45 180.14 2x26 n GLY 36 N -1.52 1.15 3.55 3.86 0.00 0.47 -4.72 105.19 107.98 2x26 n GLY 36 Ca 0.06 -0.47 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 2x26 n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2x26 s SER 37 N -0.94 6.77 0.10 1.61 0.01 0.06 -4.86 113.70 116.45 2x26 s SER 37 Ca 0.29 -2.24 -0.23 0.00 1.31 0.00 0.00 55.95 55.07 2x26 s SER 37 Cb 0.16 -2.55 -0.11 0.00 0.21 0.00 0.00 66.02 63.73 2x26 s SER 37 CO 0.18 -1.20 1.71 0.40 0.41 0.00 0.00 173.24 174.75 2x26 h ILE 38 N 5.78 0.83 -0.71 1.44 1.08 -1.86 0.42 117.51 124.50 2x26 h ILE 38 Ca 0.36 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.84 2x26 h ILE 38 Cb 0.91 0.83 -0.04 0.00 -3.07 0.00 0.00 36.82 35.46 2x26 h ILE 38 CO 1.41 0.00 0.46 1.23 -0.69 0.00 0.00 178.15 180.56 2x26 h GLY 39 N -0.12 1.00 0.91 5.37 0.00 -1.89 -0.74 103.07 107.61 2x26 h GLY 39 Ca 0.02 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 46.93 2x26 h GLY 39 CO -0.06 0.35 -0.01 -0.33 0.00 0.00 0.00 176.54 176.49 2x26 h MET 40 N 0.94 0.61 -0.39 4.80 2.86 -1.69 -0.95 114.93 121.10 2x26 h MET 40 Ca 0.26 -0.20 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 2x26 h MET 40 Cb -0.09 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.50 2x26 h MET 40 CO -0.07 0.73 0.17 0.28 1.06 0.00 0.00 176.91 179.08 2x26 h VAL 41 N 0.41 1.19 -0.31 -2.22 2.07 -0.59 0.15 116.25 116.95 2x26 h VAL 41 Ca 0.10 -0.56 -0.14 0.00 0.82 0.00 0.00 66.70 66.92 2x26 h VAL 41 Cb 0.46 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 2x26 h VAL 41 CO 0.02 0.21 -0.36 -0.07 0.02 0.00 0.00 177.57 177.38 2x26 h LEU 42 N 0.49 0.74 -0.64 2.57 3.38 -1.16 -0.07 115.31 120.61 2x26 h LEU 42 Ca 0.13 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 2x26 h LEU 42 Cb 0.17 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 2x26 h LEU 42 CO -0.01 1.03 0.22 0.00 0.09 0.00 0.00 178.44 179.76 2x26 h ALA 43 N 1.01 0.84 -0.11 1.53 0.00 -0.80 -1.67 119.26 120.07 2x26 h ALA 43 Ca 0.06 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2x26 h ALA 43 Cb 0.89 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2x26 h ALA 43 CO 0.08 0.50 0.07 -0.22 0.00 0.00 0.00 179.25 179.67 2x26 h LYS 44 N 0.92 0.14 -0.70 0.00 3.64 -0.51 -1.29 116.57 118.78 2x26 h LYS 44 Ca 0.21 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.60 2x26 h LYS 44 Cb 0.27 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 2x26 h LYS 44 CO -0.01 0.11 0.44 1.03 -2.27 0.00 0.00 179.45 178.75 2x26 h SER 45 N 0.13 0.73 0.01 4.20 0.87 -0.80 -2.46 113.55 116.23 2x26 h SER 45 Ca 0.04 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2x26 h SER 45 Cb 0.00 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 61.80 2x26 h SER 45 CO -0.01 0.51 -0.02 1.41 -0.53 0.00 0.00 176.83 178.19 2x26 n HIS 46 N -4.65 0.00 -2.75 2.24 8.25 -0.64 -4.93 115.22 112.73 2x26 n HIS 46 Ca 0.07 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.32 2x26 n HIS 46 Cb 0.07 -0.01 0.02 0.00 1.12 0.00 0.00 29.99 31.19 2x26 n HIS 46 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2x26 n GLN 47 N 0.06 -3.51 -0.23 -0.41 6.02 -0.57 -4.90 117.38 113.85 2x26 n GLN 47 Ca 0.19 0.93 -0.09 0.00 -0.01 0.00 0.00 57.00 58.02 2x26 n GLN 47 Cb 0.35 -5.67 0.03 0.00 1.02 0.00 0.00 30.24 25.97 2x26 n GLN 47 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2x26 h LEU 48 N -0.81 1.07 -0.52 1.08 3.38 -1.61 -1.27 115.31 116.63 2x26 h LEU 48 Ca -0.51 -0.28 -0.16 0.00 0.09 0.00 0.00 57.88 57.02 2x26 h LEU 48 Cb 1.36 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2x26 h LEU 48 CO 0.56 1.09 -0.59 -0.07 0.09 0.00 0.00 178.44 179.52 2x26 h LEU 49 N 1.02 0.55 -0.90 1.67 3.38 -1.91 -0.09 115.31 119.03 2x26 h LEU 49 Ca 0.19 -0.31 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 2x26 h LEU 49 Cb 0.50 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 2x26 h LEU 49 CO 0.02 1.01 -0.02 -0.33 0.09 0.00 0.00 178.44 179.22 2x26 h GLU 50 N 0.37 0.79 -0.02 1.13 3.07 -1.78 -0.64 114.58 117.50 2x26 h GLU 50 Ca -0.00 -0.22 -0.24 0.00 -0.50 0.00 0.00 59.36 58.40 2x26 h GLU 50 Cb 1.13 -0.09 0.01 0.00 -0.84 0.00 0.00 28.75 28.96 2x26 h GLU 50 CO 0.11 0.81 -0.96 0.87 -1.40 0.00 0.00 179.01 178.44 2x26 h LYS 51 N 0.74 0.56 -0.14 2.33 1.57 -1.08 -3.21 116.57 117.33 2x26 h LYS 51 Ca 0.14 -0.57 -0.19 0.00 -1.87 0.00 0.00 60.65 58.15 2x26 h LYS 51 Cb 0.47 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.94 2x26 h LYS 51 CO 0.02 1.20 -0.70 -0.09 -0.57 0.00 0.00 179.45 179.31 2x26 h ARG 52 N 0.32 0.61 -2.14 3.15 2.43 -0.89 -3.39 114.38 114.46 2x26 h ARG 52 Ca -0.09 -0.46 -0.57 0.00 -0.81 0.00 0.00 59.98 58.05 2x26 h ARG 52 Cb 1.59 0.09 -0.41 0.00 -0.42 0.00 0.00 29.97 30.82 2x26 h ARG 52 CO 0.18 1.08 -0.83 0.66 -1.51 0.00 0.00 179.97 179.55 2x26 n TYR 53 N -3.91 2.28 0.32 2.20 4.01 -0.26 -4.94 117.16 116.87 2x26 n TYR 53 Ca -0.05 -3.92 0.14 0.00 -0.16 0.00 0.00 57.90 53.91 2x26 n TYR 53 Cb 0.70 -0.47 0.64 0.00 -0.31 0.00 0.00 39.34 39.90 2x26 n TYR 53 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2x26 h PRO 54 N 3.55 0.00 -0.26 -0.72 0.13 -1.76 -2.44 132.00 130.50 2x26 h PRO 54 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2x26 h PRO 54 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 2x26 h PRO 54 CO 0.69 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.85 2x26 n GLU 55 N -2.55 1.87 -4.65 0.86 1.02 -1.26 -4.84 120.64 111.09 2x26 n GLU 55 Ca 0.00 -1.32 -0.33 0.00 -0.02 0.00 0.00 57.16 55.50 2x26 n GLU 55 Cb 0.19 -1.38 -0.12 0.00 -0.02 0.00 0.00 31.44 30.12 2x26 n GLU 55 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2x26 s SER 56 N -1.39 4.37 -0.50 1.62 0.01 -0.92 -4.74 113.70 112.14 2x26 s SER 56 Ca 0.31 -0.15 -0.26 0.00 1.31 0.00 0.00 55.95 57.16 2x26 s SER 56 Cb 0.17 -0.99 0.03 0.00 0.21 0.00 0.00 66.02 65.44 2x26 s SER 56 CO 0.24 0.32 0.99 -0.75 0.41 0.00 0.00 173.24 174.46 2x26 s LYS 57 N -1.06 3.50 -0.11 12.44 2.20 0.27 -4.93 119.74 132.05 2x26 s LYS 57 Ca 0.14 0.11 -0.20 0.00 -0.36 0.00 0.00 55.97 55.66 2x26 s LYS 57 Cb -0.11 -3.97 -0.04 0.00 -1.51 0.00 0.00 37.83 32.20 2x26 s LYS 57 CO 0.04 -1.37 0.57 0.42 -0.36 0.00 0.00 175.35 174.64 2x26 s ILE 58 N 4.05 5.12 0.16 5.43 -1.09 -1.26 -1.22 121.20 132.40 2x26 s ILE 58 Ca 0.37 1.14 0.05 0.00 -2.23 0.00 0.00 60.65 59.98 2x26 s ILE 58 Cb -0.10 -3.90 -0.05 0.00 -1.58 0.00 0.00 42.46 36.83 2x26 s ILE 58 CO 0.25 0.28 -0.10 -0.94 -1.23 0.00 0.00 174.94 173.20 2x26 s SER 59 N 0.75 1.87 -0.04 3.58 1.04 -0.46 -4.99 113.70 115.45 2x26 s SER 59 Ca 0.30 -1.03 0.03 0.00 0.48 0.00 0.00 55.95 55.73 2x26 s SER 59 Cb -0.16 -0.02 0.00 0.00 0.10 0.00 0.00 66.02 65.94 2x26 s SER 59 CO 0.13 -0.33 -0.12 0.26 0.98 0.00 0.00 173.24 174.15 2x26 s TRP 60 N -3.30 1.30 -0.10 5.02 0.52 -1.26 -0.94 118.94 120.18 2x26 s TRP 60 Ca 0.18 -0.38 0.00 0.00 0.02 0.00 0.00 56.10 55.93 2x26 s TRP 60 Cb 0.03 -0.92 0.02 0.00 -1.15 0.00 0.00 33.47 31.45 2x26 s TRP 60 CO 0.02 -0.16 -0.08 0.08 0.02 0.00 0.00 176.95 176.83 2x26 s VAL 61 N 0.25 1.02 0.07 4.03 1.01 0.68 -4.94 120.40 122.52 2x26 s VAL 61 Ca -0.06 -0.31 -0.22 0.00 0.00 0.00 0.00 61.98 61.39 2x26 s VAL 61 Cb -0.11 -1.01 -0.06 0.00 0.00 0.00 0.00 36.38 35.19 2x26 s VAL 61 CO 0.02 0.36 0.67 -0.70 0.00 0.00 0.00 175.10 175.44 2x26 s GLU 62 N 1.47 4.39 0.15 2.72 2.12 -1.26 -1.33 118.70 126.96 2x26 s GLU 62 Ca 0.00 0.91 0.10 0.00 0.36 0.00 0.00 54.97 56.35 2x26 s GLU 62 Cb -0.13 -3.30 -0.04 0.00 0.26 0.00 0.00 34.13 30.91 2x26 s GLU 62 CO -0.05 0.47 -0.21 -0.06 -0.54 0.00 0.00 175.26 174.86 2x26 s PHE 63 N -0.62 2.42 -0.14 5.30 0.08 0.11 -4.91 117.98 120.21 2x26 s PHE 63 Ca 0.33 -0.32 0.25 0.00 0.12 0.00 0.00 56.93 57.32 2x26 s PHE 63 Cb -0.20 -1.25 0.69 0.00 -0.57 0.00 0.00 43.02 41.69 2x26 s PHE 63 CO 0.21 0.43 1.73 -1.00 -0.10 0.00 0.00 175.22 176.49 2x26 h PRO 64 N 3.49 0.00 -2.18 0.24 0.13 -1.97 -3.40 132.00 128.31 2x26 h PRO 64 Ca -0.49 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 64.79 2x26 h PRO 64 Cb 1.19 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.18 2x26 h PRO 64 CO 0.46 0.12 0.54 0.00 -0.23 0.00 0.00 178.00 178.88 2x26 s ALA 65 N -3.38 -1.83 0.22 -0.56 0.00 -1.26 -4.32 121.76 110.63 2x26 s ALA 65 Ca 0.04 0.84 -0.08 0.00 0.00 0.00 0.00 51.96 52.76 2x26 s ALA 65 Cb 0.07 0.42 0.29 0.00 0.00 0.00 0.00 23.12 23.90 2x26 s ALA 65 CO 0.64 -0.78 1.80 0.78 0.00 0.00 0.00 175.76 178.19 2x26 h GLY 66 N 2.00 1.03 0.52 0.00 0.00 -1.91 -2.74 103.07 101.97 2x26 h GLY 66 Ca -0.22 -0.25 0.07 0.00 0.00 0.00 0.00 47.33 46.93 2x26 h GLY 66 CO 0.29 0.12 0.13 -2.55 0.00 0.00 0.00 176.54 174.52 2x26 h PRO 67 N 0.66 0.27 -0.93 4.80 0.11 -1.98 0.33 132.00 135.27 2x26 h PRO 67 Ca 0.32 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.42 2x26 h PRO 67 Cb 0.26 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 31.27 2x26 h PRO 67 CO -0.22 0.18 0.58 1.96 -0.21 0.00 0.00 178.00 180.29 2x26 h GLN 68 N 0.28 1.24 -0.50 1.05 7.50 -1.96 -1.34 115.11 121.37 2x26 h GLN 68 Ca 0.22 -0.10 -0.01 0.00 0.50 0.00 0.00 58.65 59.26 2x26 h GLN 68 Cb 0.24 -0.27 -0.02 0.00 0.05 0.00 0.00 27.48 27.48 2x26 h GLN 68 CO -0.25 0.85 0.26 1.98 -1.50 0.00 0.00 178.83 180.17 2x26 h MET 69 N 1.27 0.72 -0.18 1.46 4.05 -1.12 -2.68 114.93 118.43 2x26 h MET 69 Ca 0.33 -0.10 -0.07 0.00 -0.28 0.00 0.00 59.70 59.59 2x26 h MET 69 Cb -0.09 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 30.56 2x26 h MET 69 CO -0.07 0.58 -0.20 -0.07 0.23 0.00 0.00 176.91 177.39 2x26 h LEU 70 N 0.67 0.31 -0.86 3.39 3.38 -0.59 -0.49 115.31 121.12 2x26 h LEU 70 Ca 0.18 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2x26 h LEU 70 Cb 0.09 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 2x26 h LEU 70 CO -0.02 0.52 0.50 -0.08 0.09 0.00 0.00 178.44 179.45 2x26 h GLU 71 N 0.29 1.18 -0.54 1.13 4.81 -1.12 -0.15 114.58 120.18 2x26 h GLU 71 Ca 0.05 -0.12 -0.10 0.00 -0.13 0.00 0.00 59.36 59.06 2x26 h GLU 71 Cb 0.52 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 2x26 h GLU 71 CO 0.03 0.85 -0.06 0.00 -0.73 0.00 0.00 179.01 179.10 2x26 h ALA 72 N 1.27 0.85 -0.77 2.92 0.00 -1.05 -1.83 119.26 120.65 2x26 h ALA 72 Ca 0.31 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2x26 h ALA 72 Cb -0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 2x26 h ALA 72 CO -0.05 0.66 0.42 1.25 0.00 0.00 0.00 179.25 181.52 2x26 h LEU 73 N 0.89 0.96 -0.40 0.00 5.85 -0.80 -1.84 115.31 119.97 2x26 h LEU 73 Ca 0.15 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 2x26 h LEU 73 Cb 0.61 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 2x26 h LEU 73 CO 0.04 0.77 -0.23 -1.13 -0.34 0.00 0.00 178.44 177.55 2x26 h ASN 74 N 1.07 0.00 0.02 1.25 -0.00 -0.66 -2.79 115.58 114.48 2x26 h ASN 74 Ca 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.57 2x26 h ASN 74 Cb 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.35 2x26 h ASN 74 CO -0.04 0.23 -0.10 1.33 -0.00 0.00 0.00 177.43 178.85 2x26 n VAL 75 N -3.21 0.00 -0.78 2.57 0.24 -0.72 -4.98 118.33 111.45 2x26 n VAL 75 Ca 0.02 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 2x26 n VAL 75 Cb 0.56 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.79 2x26 n VAL 75 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2x26 n GLY 76 N 1.28 0.55 0.07 7.63 0.00 -0.81 -4.95 105.19 108.96 2x26 n GLY 76 Ca 0.15 -0.57 0.12 0.00 0.00 0.00 0.00 46.02 45.72 2x26 n GLY 76 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2x26 n SER 77 N 1.04 0.73 -4.33 1.61 3.41 -0.76 -4.84 113.62 110.48 2x26 n SER 77 Ca 0.00 0.19 -0.18 0.00 -0.26 0.00 0.00 58.87 58.63 2x26 n SER 77 Cb 0.00 0.02 -0.10 0.00 -0.26 0.00 0.00 64.21 63.87 2x26 n SER 77 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2x26 s ILE 78 N -3.16 1.39 -0.09 -1.33 -4.36 -1.24 -4.95 121.20 107.47 2x26 s ILE 78 Ca 0.07 -2.11 0.12 0.00 -0.26 0.00 0.00 60.65 58.46 2x26 s ILE 78 Cb 0.13 -2.16 -0.17 0.00 1.25 0.00 0.00 42.46 41.51 2x26 s ILE 78 CO 0.70 -0.50 0.12 0.47 0.24 0.00 0.00 174.94 175.97 2x26 n ASP 79 N -0.39 1.97 -3.74 4.36 8.00 0.96 -4.57 116.55 123.14 2x26 n ASP 79 Ca -0.07 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.30 2x26 n ASP 79 Cb 0.62 1.06 -0.10 0.00 -0.02 0.00 0.00 41.12 42.68 2x26 n ASP 79 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2x26 s LEU 80 N -4.59 0.55 0.08 0.64 2.96 -1.01 -3.91 118.68 113.41 2x26 s LEU 80 Ca -0.06 0.73 -0.09 0.00 -0.22 0.00 0.00 54.13 54.49 2x26 s LEU 80 Cb 0.05 1.32 0.00 0.00 0.50 0.00 0.00 46.19 48.06 2x26 s LEU 80 CO 0.52 -0.15 0.20 -0.83 -1.32 0.00 0.00 176.35 174.77 2x26 s GLY 81 N 0.11 0.06 -0.11 7.98 0.00 -0.24 -0.76 107.32 114.36 2x26 s GLY 81 Ca -0.01 -0.54 -0.00 0.00 0.00 0.00 0.00 44.72 44.17 2x26 s GLY 81 CO 0.01 -0.73 -0.11 -0.45 0.00 0.00 0.00 173.10 171.82 2x26 s SER 82 N -2.77 4.25 0.24 1.64 0.15 -1.19 -0.87 113.70 115.15 2x26 s SER 82 Ca 0.04 -0.23 -0.13 0.00 0.70 0.00 0.00 55.95 56.33 2x26 s SER 82 Cb 0.04 -1.46 -0.00 0.00 -1.71 0.00 0.00 66.02 62.89 2x26 s SER 82 CO -0.10 0.22 0.48 0.28 1.20 0.00 0.00 173.24 175.32 2x26 s THR 83 N 0.02 0.01 0.02 6.45 -1.32 -0.77 -4.73 115.64 115.32 2x26 s THR 83 Ca -0.03 -1.33 -0.00 0.00 -1.21 0.00 0.00 61.69 59.12 2x26 s THR 83 Cb -0.14 -2.11 0.01 0.00 -1.51 0.00 0.00 72.50 68.75 2x26 s THR 83 CO 0.04 -0.03 0.03 0.61 -2.21 0.00 0.00 174.62 173.06 2x26 n GLY 84 N -0.37 -0.96 0.24 6.08 0.00 -1.26 -0.16 105.19 108.76 2x26 n GLY 84 Ca -0.03 -1.70 0.13 0.00 0.00 0.00 0.00 46.02 44.43 2x26 n GLY 84 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2x26 h ASP 85 N -0.04 0.00 0.01 1.61 2.03 -1.94 -3.37 116.42 114.73 2x26 h ASP 85 Ca -0.01 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.18 2x26 h ASP 85 Cb 0.03 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.52 2x26 h ASP 85 CO 0.01 0.11 -0.56 0.40 -1.03 0.00 0.00 179.24 178.17 2x26 h ILE 86 N 0.00 1.44 -0.97 4.15 1.08 -1.94 -3.37 117.51 117.89 2x26 h ILE 86 Ca -0.00 -2.30 0.14 0.00 -0.39 0.00 0.00 64.86 62.30 2x26 h ILE 86 Cb 0.68 2.95 -0.08 0.00 -3.07 0.00 0.00 36.82 37.30 2x26 h ILE 86 CO 0.01 0.52 0.61 -0.65 -0.69 0.00 0.00 178.15 177.96 2x26 h PRO 87 N -0.92 0.85 -0.36 2.37 0.11 -1.90 -1.23 132.00 130.91 2x26 h PRO 87 Ca -0.14 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.90 2x26 h PRO 87 Cb 1.19 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 2x26 h PRO 87 CO -0.06 0.56 0.16 -1.35 -0.21 0.00 0.00 178.00 177.10 2x26 h PRO 88 N 0.88 0.50 -0.25 1.05 0.11 -1.77 -2.21 132.00 130.30 2x26 h PRO 88 Ca 0.50 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 66.58 2x26 h PRO 88 Cb 0.62 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.60 2x26 h PRO 88 CO -0.27 0.41 0.10 0.82 -0.21 0.00 0.00 178.00 178.84 2x26 h ILE 89 N 0.51 0.95 -0.95 4.15 2.04 -1.39 0.22 117.51 123.04 2x26 h ILE 89 Ca 0.13 -0.07 0.04 0.00 1.00 0.00 0.00 64.86 65.95 2x26 h ILE 89 Cb 0.08 0.71 -0.06 0.00 -0.74 0.00 0.00 36.82 36.81 2x26 h ILE 89 CO -0.02 0.04 0.62 -0.26 0.00 0.00 0.00 178.15 178.53 2x26 h PHE 90 N 0.22 1.16 -0.08 1.37 0.04 -1.35 0.05 116.94 118.34 2x26 h PHE 90 Ca 0.11 0.03 -0.22 0.00 2.80 0.00 0.00 57.97 60.69 2x26 h PHE 90 Cb 0.07 -0.39 0.01 0.00 2.20 0.00 0.00 35.95 37.84 2x26 h PHE 90 CO -0.12 0.67 -0.79 0.00 -0.60 0.00 0.00 178.31 177.47 2x26 h ALA 91 N 1.39 0.21 -0.07 2.45 0.00 -1.02 -2.69 119.26 119.52 2x26 h ALA 91 Ca 0.38 -0.61 -0.15 0.00 0.00 0.00 0.00 54.91 54.53 2x26 h ALA 91 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2x26 h ALA 91 CO -0.12 0.59 -0.60 1.96 0.00 0.00 0.00 179.25 181.08 2x26 h GLN 92 N 0.35 0.25 0.00 0.00 4.20 -0.85 -1.43 115.11 117.63 2x26 h GLN 92 Ca -0.08 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.46 2x26 h GLN 92 Cb 1.44 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 29.25 2x26 h GLN 92 CO 0.16 0.77 -0.05 0.00 -0.67 0.00 0.00 178.83 179.04 2x26 h ALA 93 N 1.19 1.74 -0.23 3.87 0.00 -0.87 -1.46 119.26 123.50 2x26 h ALA 93 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2x26 h ALA 93 Cb 1.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2x26 h ALA 93 CO 0.09 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.40 2x26 n ALA 94 N -2.45 2.49 -0.02 0.00 0.00 -0.92 -4.46 120.51 115.16 2x26 n ALA 94 Ca -0.03 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.79 2x26 n ALA 94 Cb 0.13 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.54 2x26 n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x26 n GLY 95 N 1.19 0.80 3.72 0.00 0.00 -0.55 -5.05 105.19 105.31 2x26 n GLY 95 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2x26 n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x26 s ALA 96 N -2.02 3.67 -1.18 4.61 0.00 -0.58 -4.90 121.76 121.35 2x26 s ALA 96 Ca 0.00 1.26 -0.06 0.00 0.00 0.00 0.00 51.96 53.16 2x26 s ALA 96 Cb 0.00 -3.57 0.23 0.00 0.00 0.00 0.00 23.12 19.78 2x26 s ALA 96 CO 0.00 -0.70 1.79 -3.47 0.00 0.00 0.00 175.76 173.38 2x26 n ASP 97 N 3.51 6.19 -4.60 0.00 2.03 -1.26 -4.38 116.55 118.03 2x26 n ASP 97 Ca 0.11 -3.29 -0.34 0.00 0.52 0.00 0.00 54.79 51.78 2x26 n ASP 97 Cb 0.40 -1.35 -0.11 0.00 -0.72 0.00 0.00 41.12 39.35 2x26 n ASP 97 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2x26 s LEU 98 N -1.83 3.43 0.05 -2.67 1.43 -1.26 -2.39 118.68 115.43 2x26 s LEU 98 Ca 0.38 0.02 0.04 0.00 -1.03 0.00 0.00 54.13 53.54 2x26 s LEU 98 Cb 0.10 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.48 2x26 s LEU 98 CO 0.02 0.29 -0.03 0.68 0.23 0.00 0.00 176.35 177.54 2x26 s VAL 99 N -0.37 3.88 -0.33 -1.59 -7.23 0.43 -4.90 120.40 110.29 2x26 s VAL 99 Ca 0.07 -0.88 -0.26 0.00 -1.81 0.00 0.00 61.98 59.10 2x26 s VAL 99 Cb -0.12 -2.78 0.01 0.00 0.56 0.00 0.00 36.38 34.05 2x26 s VAL 99 CO 0.02 0.25 0.94 -0.31 -0.31 0.00 0.00 175.10 175.69 2x26 s TYR 100 N -1.17 3.14 -0.96 2.82 2.02 0.10 -1.87 117.35 121.44 2x26 s TYR 100 Ca 0.22 0.94 0.18 0.00 -0.37 0.00 0.00 57.07 58.03 2x26 s TYR 100 Cb -0.11 -3.54 -0.17 0.00 -0.40 0.00 0.00 41.96 37.74 2x26 s TYR 100 CO 0.13 -0.73 0.79 1.33 -1.57 0.00 0.00 175.55 175.50 2x26 n VAL 101 N 5.81 0.00 -3.53 0.71 0.24 0.19 -1.61 118.33 120.14 2x26 n VAL 101 Ca 0.08 -0.10 -0.11 0.00 -2.04 0.00 0.00 64.34 62.16 2x26 n VAL 101 Cb 0.48 1.03 -0.04 0.00 -1.47 0.00 0.00 33.84 33.84 2x26 n VAL 101 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2x26 s GLY 102 N -2.63 -0.43 0.02 7.63 0.00 -1.15 -4.43 107.32 106.33 2x26 s GLY 102 Ca 0.08 1.40 -0.02 0.00 0.00 0.00 0.00 44.72 46.17 2x26 s GLY 102 CO 0.71 0.69 0.02 0.54 0.00 0.00 0.00 173.10 175.06 2x26 s VAL 103 N -2.08 0.11 0.25 1.40 0.11 0.16 -1.39 120.40 118.95 2x26 s VAL 103 Ca -0.01 -0.89 0.08 0.00 -2.93 0.00 0.00 61.98 58.24 2x26 s VAL 103 Cb -0.01 -0.37 -0.04 0.00 -1.53 0.00 0.00 36.38 34.43 2x26 s VAL 103 CO -0.02 -0.49 0.10 -1.61 -3.33 0.00 0.00 175.10 169.75 2x26 s GLU 104 N -1.57 2.63 0.70 1.54 2.02 -0.16 -2.02 118.70 121.85 2x26 s GLU 104 Ca -0.15 -1.20 -0.16 0.00 0.02 0.00 0.00 54.97 53.48 2x26 s GLU 104 Cb -0.08 -2.39 0.02 0.00 0.10 0.00 0.00 34.13 31.78 2x26 s GLU 104 CO -0.01 0.39 1.26 -2.30 0.02 0.00 0.00 175.26 174.63 2x26 n PRO 105 N -0.94 0.80 -1.32 0.39 -0.02 -1.26 -3.36 135.00 129.30 2x26 n PRO 105 Ca -0.07 0.34 -0.32 0.00 -2.02 0.00 0.00 63.50 61.42 2x26 n PRO 105 Cb 0.58 -2.50 0.09 0.00 -0.02 0.00 0.00 33.50 31.66 2x26 n PRO 105 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2x26 s PRO 106 N -3.62 2.13 -0.65 0.52 0.04 -1.26 -4.40 135.00 127.76 2x26 s PRO 106 Ca 0.80 1.43 0.06 0.00 0.04 0.00 0.00 61.00 63.33 2x26 s PRO 106 Cb -0.35 -1.86 0.22 0.00 0.04 0.00 0.00 34.50 32.55 2x26 s PRO 106 CO 0.44 -1.78 0.66 1.63 0.04 0.00 0.00 177.00 177.99 2x26 n LYS 107 N -3.19 2.23 0.25 4.56 5.02 -1.26 -4.74 118.16 121.03 2x26 n LYS 107 Ca 0.11 -4.56 0.09 0.00 -2.02 0.00 0.00 58.31 51.94 2x26 n LYS 107 Cb 0.52 -2.23 0.67 0.00 -0.02 0.00 0.00 35.03 33.97 2x26 n LYS 107 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2x26 h PRO 108 N 4.56 0.00 0.00 1.97 0.13 -1.86 -1.24 132.00 135.56 2x26 h PRO 108 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2x26 h PRO 108 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 2x26 h PRO 108 CO 0.78 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.18 2x26 n LYS 109 N -4.45 0.64 0.00 0.86 4.76 -1.26 -0.65 118.16 118.05 2x26 n LYS 109 Ca -0.02 0.00 0.08 0.00 -2.87 0.00 0.00 58.31 55.50 2x26 n LYS 109 Cb 0.11 -1.50 -0.05 0.00 -1.84 0.00 0.00 35.03 31.76 2x26 n LYS 109 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2x26 n ALA 110 N -1.18 3.70 -3.44 7.82 0.00 -0.47 -4.87 120.51 122.08 2x26 n ALA 110 Ca 0.18 -0.52 -0.23 0.00 0.00 0.00 0.00 53.44 52.86 2x26 n ALA 110 Cb 0.19 -0.62 -0.16 0.00 0.00 0.00 0.00 19.45 18.86 2x26 n ALA 110 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2x26 s GLU 111 N -2.30 1.41 0.13 0.00 2.12 -1.24 -0.80 118.70 118.02 2x26 s GLU 111 Ca 0.11 -0.33 -0.07 0.00 0.36 0.00 0.00 54.97 55.04 2x26 s GLU 111 Cb 0.14 -1.21 -0.01 0.00 0.26 0.00 0.00 34.13 33.30 2x26 s GLU 111 CO 0.56 0.02 0.20 0.14 -0.54 0.00 0.00 175.26 175.64 2x26 s VAL 112 N 0.65 0.10 -0.23 3.70 -7.23 -0.59 -2.88 120.40 113.94 2x26 s VAL 112 Ca -0.12 -1.44 -0.04 0.00 -1.81 0.00 0.00 61.98 58.57 2x26 s VAL 112 Cb -0.15 -1.71 -0.01 0.00 0.56 0.00 0.00 36.38 35.08 2x26 s VAL 112 CO 0.03 -0.47 -0.03 -0.63 -0.31 0.00 0.00 175.10 173.68 2x26 s ILE 113 N -3.95 3.48 -0.01 -0.62 1.01 -0.04 -1.02 121.20 120.05 2x26 s ILE 113 Ca 0.14 -0.47 -0.08 0.00 0.00 0.00 0.00 60.65 60.24 2x26 s ILE 113 Cb 0.05 -2.59 -0.05 0.00 0.01 0.00 0.00 42.46 39.88 2x26 s ILE 113 CO -0.04 0.41 0.28 -0.76 0.00 0.00 0.00 174.94 174.83 2x26 s LEU 114 N 1.49 4.38 0.33 2.97 1.43 -0.26 -0.46 118.68 128.56 2x26 s LEU 114 Ca 0.06 0.61 0.03 0.00 -1.03 0.00 0.00 54.13 53.80 2x26 s LEU 114 Cb -0.14 -2.60 -0.05 0.00 0.03 0.00 0.00 46.19 43.42 2x26 s LEU 114 CO -0.02 0.28 0.09 0.68 0.23 0.00 0.00 176.35 177.60 2x26 s VAL 115 N -1.24 0.84 0.55 -1.59 -7.23 -0.57 -1.59 120.40 109.57 2x26 s VAL 115 Ca 0.26 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.23 2x26 s VAL 115 Cb -0.13 -2.63 -0.05 0.00 0.56 0.00 0.00 36.38 34.12 2x26 s VAL 115 CO 0.14 0.00 1.15 0.00 -0.31 0.00 0.00 175.10 176.08 2x26 s ALA 116 N -3.41 2.68 0.20 1.32 0.00 -1.26 -1.00 121.76 120.29 2x26 s ALA 116 Ca 0.34 0.87 -0.13 0.00 0.00 0.00 0.00 51.96 53.04 2x26 s ALA 116 Cb 0.07 -3.38 0.23 0.00 0.00 0.00 0.00 23.12 20.03 2x26 s ALA 116 CO 0.15 -0.85 1.65 1.49 0.00 0.00 0.00 175.76 178.20 2x26 h GLU 117 N 1.19 0.05 -0.30 0.00 4.57 -0.87 -1.62 114.58 117.59 2x26 h GLU 117 Ca -0.50 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 2x26 h GLU 117 Cb 1.27 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.85 2x26 h GLU 117 CO 0.57 0.03 0.00 0.27 -1.18 0.00 0.00 179.01 178.70 2x26 n ASN 118 N -5.34 1.65 -4.77 1.04 0.23 -1.26 -4.88 115.26 101.93 2x26 n ASN 118 Ca 0.07 -1.97 -0.40 0.00 -0.53 0.00 0.00 54.58 51.76 2x26 n ASN 118 Cb 0.31 -0.20 -0.01 0.00 -2.08 0.00 0.00 39.78 37.81 2x26 n ASN 118 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 2x26 s SER 119 N -1.06 6.48 0.00 0.53 0.15 -0.61 -4.91 113.70 114.28 2x26 s SER 119 Ca 0.22 2.65 0.28 0.00 0.70 0.00 0.00 55.95 59.80 2x26 s SER 119 Cb 0.12 -2.64 1.46 0.00 -1.71 0.00 0.00 66.02 63.25 2x26 s SER 119 CO 0.15 -0.73 1.99 -0.81 1.20 0.00 0.00 173.24 175.04 2x26 n PRO 120 N 0.35 0.47 -2.20 5.44 -0.05 -1.26 -4.74 135.00 133.00 2x26 n PRO 120 Ca 0.02 0.02 -0.43 0.00 -0.05 0.00 0.00 63.50 63.06 2x26 n PRO 120 Cb 0.43 -1.50 -0.02 0.00 -0.05 0.00 0.00 33.50 32.36 2x26 n PRO 120 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 175.50 175.87 2x26 s ILE 121 N -2.50 3.80 -0.11 0.52 1.01 -1.26 -4.86 121.20 117.81 2x26 s ILE 121 Ca 0.29 0.89 0.08 0.00 0.00 0.00 0.00 60.65 61.91 2x26 s ILE 121 Cb 0.19 -3.86 -0.12 0.00 0.01 0.00 0.00 42.46 38.68 2x26 s ILE 121 CO 0.42 -0.40 0.01 0.29 0.00 0.00 0.00 174.94 175.26 2x26 n LYS 122 N 7.69 1.88 -4.48 2.79 4.76 -1.26 -5.02 118.16 124.52 2x26 n LYS 122 Ca 0.18 0.01 -0.23 0.00 -2.87 0.00 0.00 58.31 55.40 2x26 n LYS 122 Cb 0.46 -1.27 -0.11 0.00 -1.84 0.00 0.00 35.03 32.27 2x26 n LYS 122 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2x26 s THR 123 N -2.26 1.48 0.32 -0.18 -4.23 -1.26 -5.03 115.64 104.48 2x26 s THR 123 Ca -0.08 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.40 2x26 s THR 123 Cb 0.03 -2.74 0.27 0.00 1.34 0.00 0.00 72.50 71.40 2x26 s THR 123 CO 0.41 -0.09 1.97 0.58 -0.54 0.00 0.00 174.62 176.96 2x26 h VAL 124 N 2.09 1.16 -0.17 2.29 2.07 -1.95 -1.65 116.25 120.09 2x26 h VAL 124 Ca -0.41 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 66.79 2x26 h VAL 124 Cb 1.24 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 2x26 h VAL 124 CO 0.71 0.18 0.12 0.00 0.02 0.00 0.00 177.57 178.60 2x26 h ALA 125 N 1.53 2.04 0.00 1.67 0.00 -1.92 0.25 119.26 122.83 2x26 h ALA 125 Ca 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2x26 h ALA 125 Cb -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2x26 h ALA 125 CO -0.08 -0.08 0.00 -0.25 0.00 0.00 0.00 179.25 178.84 2x26 n ASP 126 N -4.50 0.00 0.00 0.00 8.00 -0.62 -2.09 116.55 117.34 2x26 n ASP 126 Ca 0.00 0.13 0.14 0.00 0.71 0.00 0.00 54.79 55.78 2x26 n ASP 126 Cb 0.18 -0.29 0.64 0.00 -0.02 0.00 0.00 41.12 41.64 2x26 n ASP 126 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2x26 n LEU 127 N -1.29 0.00 -4.65 0.64 4.77 0.08 -4.87 117.00 111.67 2x26 n LEU 127 Ca 0.05 0.40 -0.51 0.00 -0.03 0.00 0.00 56.01 55.92 2x26 n LEU 127 Cb 0.09 -0.40 -0.06 0.00 -2.33 0.00 0.00 43.42 40.72 2x26 n LEU 127 CO 0.09 -0.02 1.17 1.17 -1.33 0.00 0.00 177.39 178.47 2x26 n LYS 128 N -1.40 1.54 0.00 3.23 4.81 -0.89 -1.33 118.16 124.12 2x26 n LYS 128 Ca 0.10 0.56 0.00 0.00 -0.87 0.00 0.00 58.31 58.10 2x26 n LYS 128 Cb 0.28 -2.28 0.00 0.00 0.02 0.00 0.00 35.03 33.05 2x26 n LYS 128 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2x26 n GLY 129 N 3.45 2.07 3.89 3.14 0.00 -0.30 -5.00 105.19 112.44 2x26 n GLY 129 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 2x26 n GLY 129 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2x26 s HIS 130 N -2.59 3.46 -0.11 1.61 3.76 -0.45 -4.71 115.29 116.25 2x26 s HIS 130 Ca 0.00 0.77 -0.30 0.00 -0.15 0.00 0.00 55.06 55.38 2x26 s HIS 130 Cb 0.00 -2.19 -0.02 0.00 1.11 0.00 0.00 32.58 31.48 2x26 s HIS 130 CO 0.00 0.19 1.15 0.15 -0.85 0.00 0.00 174.74 175.37 2x26 s LYS 131 N -3.28 4.33 -0.17 1.40 1.02 -1.26 -1.93 119.74 119.85 2x26 s LYS 131 Ca 0.46 1.56 0.00 0.00 0.02 0.00 0.00 55.97 58.01 2x26 s LYS 131 Cb -0.11 -3.60 0.01 0.00 -0.52 0.00 0.00 37.83 33.60 2x26 s LYS 131 CO 0.27 -0.49 -0.16 0.08 -0.92 0.00 0.00 175.35 174.13 2x26 s VAL 132 N 2.53 2.51 0.11 3.17 1.01 -1.10 -1.62 120.40 127.00 2x26 s VAL 132 Ca 0.52 -0.80 -0.16 0.00 0.00 0.00 0.00 61.98 61.54 2x26 s VAL 132 Cb -0.21 -2.07 -0.07 0.00 0.00 0.00 0.00 36.38 34.03 2x26 s VAL 132 CO 0.18 0.51 0.54 0.00 0.00 0.00 0.00 175.10 176.33 2x26 s ALA 133 N 1.10 3.59 0.02 5.51 0.00 -0.21 -0.78 121.76 130.99 2x26 s ALA 133 Ca 0.00 -0.09 -0.29 0.00 0.00 0.00 0.00 51.96 51.59 2x26 s ALA 133 Cb -0.14 -2.55 0.10 0.00 0.00 0.00 0.00 23.12 20.53 2x26 s ALA 133 CO -0.05 0.44 1.10 -0.59 0.00 0.00 0.00 175.76 176.66 2x26 s PHE 134 N -1.31 -0.13 -0.09 0.00 -0.12 -0.83 -0.87 117.98 114.62 2x26 s PHE 134 Ca 0.34 -0.04 -0.21 0.00 -0.05 0.00 0.00 56.93 56.97 2x26 s PHE 134 Cb -0.17 0.57 -0.04 0.00 -0.63 0.00 0.00 43.02 42.76 2x26 s PHE 134 CO 0.19 -0.49 0.59 -1.14 -0.05 0.00 0.00 175.22 174.31 2x26 s GLN 135 N -2.82 4.39 0.31 1.99 0.74 -1.08 -0.93 119.66 122.25 2x26 s GLN 135 Ca 0.11 0.67 -0.29 0.00 0.05 0.00 0.00 55.36 55.90 2x26 s GLN 135 Cb 0.01 -3.44 -0.11 0.00 1.10 0.00 0.00 33.01 30.57 2x26 s GLN 135 CO -0.03 0.11 1.50 0.21 -0.55 0.00 0.00 175.29 176.53 2x26 s LYS 136 N 0.71 4.18 0.00 1.67 2.20 -1.26 -2.46 119.74 124.77 2x26 s LYS 136 Ca 0.32 2.48 0.00 0.00 -0.36 0.00 0.00 55.97 58.40 2x26 s LYS 136 Cb -0.16 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 33.12 2x26 s LYS 136 CO 0.14 -0.51 0.00 0.41 -0.36 0.00 0.00 175.35 175.03 2x26 n GLY 137 N 1.54 0.37 4.00 5.54 0.00 -1.26 -5.00 105.19 110.38 2x26 n GLY 137 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 2x26 n GLY 137 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x26 s SER 138 N -2.09 4.44 0.36 1.61 1.04 -1.03 -4.88 113.70 113.15 2x26 s SER 138 Ca 0.00 -0.46 0.09 0.00 0.48 0.00 0.00 55.95 56.06 2x26 s SER 138 Cb 0.00 0.07 0.83 0.00 0.10 0.00 0.00 66.02 67.02 2x26 s SER 138 CO 0.00 -1.80 1.87 0.77 0.98 0.00 0.00 173.24 175.06 2x26 h SER 139 N -0.42 0.64 0.21 7.02 4.64 -1.95 -1.83 113.55 121.86 2x26 h SER 139 Ca -0.35 0.04 -0.12 0.00 -0.47 0.00 0.00 61.79 60.89 2x26 h SER 139 Cb 1.27 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2x26 h SER 139 CO 0.40 0.32 -0.47 0.28 -0.87 0.00 0.00 176.83 176.49 2x26 h SER 140 N 0.68 0.34 -0.22 4.97 0.02 -1.89 0.12 113.55 117.56 2x26 h SER 140 Ca 0.45 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 61.24 2x26 h SER 140 Cb 0.75 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.18 2x26 h SER 140 CO -0.21 0.76 0.12 -0.74 -1.14 0.00 0.00 176.83 175.62 2x26 h HIS 141 N 0.25 0.30 -0.29 3.45 6.17 -1.55 0.14 115.15 123.62 2x26 h HIS 141 Ca 0.02 -0.01 -0.00 0.00 0.71 0.00 0.00 60.37 61.09 2x26 h HIS 141 Cb 0.92 -0.10 -0.01 0.00 2.52 0.00 0.00 27.41 30.74 2x26 h HIS 141 CO 0.02 0.26 0.18 -0.97 0.71 0.00 0.00 177.93 178.13 2x26 h ASN 142 N 0.25 0.34 -0.78 3.26 -1.24 -1.18 -1.17 115.58 115.07 2x26 h ASN 142 Ca 0.08 -0.04 0.05 0.00 0.71 0.00 0.00 56.30 57.10 2x26 h ASN 142 Cb 0.05 -0.09 -0.05 0.00 0.73 0.00 0.00 38.32 38.96 2x26 h ASN 142 CO -0.01 0.28 0.48 0.25 -1.29 0.00 0.00 177.43 177.13 2x26 h LEU 143 N 0.37 0.76 -0.29 0.34 6.46 -0.53 -2.67 115.31 119.75 2x26 h LEU 143 Ca 0.10 0.01 -0.05 0.00 -0.12 0.00 0.00 57.88 57.82 2x26 h LEU 143 Cb -0.01 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 39.77 2x26 h LEU 143 CO -0.02 0.50 -0.03 0.25 -0.62 0.00 0.00 178.44 178.52 2x26 h LEU 144 N 0.90 0.53 -0.89 2.25 5.85 -0.40 -0.64 115.31 122.92 2x26 h LEU 144 Ca 0.33 -0.33 0.14 0.00 0.84 0.00 0.00 57.88 58.86 2x26 h LEU 144 Cb 0.11 -0.14 -0.09 0.00 0.37 0.00 0.00 40.66 40.91 2x26 h LEU 144 CO -0.15 0.74 0.49 -0.07 -0.34 0.00 0.00 178.44 179.11 2x26 h LEU 145 N 0.32 0.64 0.10 2.25 3.38 -1.02 0.58 115.31 121.56 2x26 h LEU 145 Ca 0.08 0.08 -0.27 0.00 0.09 0.00 0.00 57.88 57.85 2x26 h LEU 145 Cb 0.49 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.21 2x26 h LEU 145 CO 0.02 0.29 -1.22 0.03 0.09 0.00 0.00 178.44 177.65 2x26 h ARG 146 N 0.72 0.32 -0.40 1.13 3.08 -1.21 -2.56 114.38 115.46 2x26 h ARG 146 Ca 0.47 -0.51 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 2x26 h ARG 146 Cb 0.61 0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.83 2x26 h ARG 146 CO -0.33 1.23 0.08 0.00 -1.07 0.00 0.00 179.97 179.88 2x26 h ALA 147 N 0.56 0.53 -0.10 0.04 0.00 -0.70 -1.56 119.26 118.03 2x26 h ALA 147 Ca -0.14 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 2x26 h ALA 147 Cb 1.94 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.57 2x26 h ALA 147 CO 0.21 0.23 0.05 -0.07 0.00 0.00 0.00 179.25 179.66 2x26 h LEU 148 N 0.51 0.14 -0.26 0.00 3.38 -0.92 -1.45 115.31 116.71 2x26 h LEU 148 Ca 0.12 -0.13 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2x26 h LEU 148 Cb 0.34 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.98 2x26 h LEU 148 CO 0.00 0.22 -0.31 -0.09 0.09 0.00 0.00 178.44 178.35 2x26 h ARG 149 N 0.04 -0.31 -0.35 1.13 2.43 -1.44 0.88 114.38 116.76 2x26 h ARG 149 Ca 0.04 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.30 2x26 h ARG 149 Cb 0.12 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 2x26 h ARG 149 CO -0.00 -0.20 0.24 0.37 -1.51 0.00 0.00 179.97 178.87 2x26 h GLN 150 N -0.32 0.16 -0.00 0.20 4.15 -1.03 -1.03 115.11 117.24 2x26 h GLN 150 Ca 0.13 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.54 2x26 h GLN 150 Cb 0.53 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.18 2x26 h GLN 150 CO -0.43 0.11 -0.21 0.00 -1.93 0.00 0.00 178.83 176.37 2x26 n ALA 151 N -2.56 2.95 -1.14 3.38 0.00 -0.48 -4.91 120.51 117.75 2x26 n ALA 151 Ca 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2x26 n ALA 151 Cb 0.31 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.51 2x26 n ALA 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x26 n GLY 152 N 1.35 0.76 3.52 0.00 0.00 -0.39 -4.63 105.19 105.80 2x26 n GLY 152 Ca 0.12 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 2x26 n GLY 152 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x26 s LEU 153 N 0.00 2.83 0.46 0.99 1.43 0.18 -5.01 118.68 119.56 2x26 s LEU 153 Ca 0.00 -0.43 -0.08 0.00 -1.03 0.00 0.00 54.13 52.59 2x26 s LEU 153 Cb 0.00 -1.66 -0.05 0.00 0.03 0.00 0.00 46.19 44.52 2x26 s LEU 153 CO 0.00 0.21 0.80 -0.54 0.23 0.00 0.00 176.35 177.05 2x26 s LYS 154 N -1.91 3.64 0.41 1.70 1.02 -1.26 -3.40 119.74 119.94 2x26 s LYS 154 Ca 0.18 0.35 0.15 0.00 0.02 0.00 0.00 55.97 56.67 2x26 s LYS 154 Cb -0.11 -2.36 1.02 0.00 -0.52 0.00 0.00 37.83 35.87 2x26 s LYS 154 CO 0.10 -0.17 1.90 0.35 -0.92 0.00 0.00 175.35 176.60 2x26 h PHE 155 N 0.58 0.55 0.00 3.18 3.57 -1.95 -0.61 116.94 122.25 2x26 h PHE 155 Ca -0.47 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.05 2x26 h PHE 155 Cb 1.20 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.77 2x26 h PHE 155 CO 0.60 0.19 0.00 0.25 -2.23 0.00 0.00 178.31 177.12 2x26 n THR 156 N -4.50 0.30 1.27 4.41 -2.24 -1.26 -3.09 114.28 109.17 2x26 n THR 156 Ca 0.16 0.08 0.14 0.00 -2.27 0.00 0.00 64.05 62.15 2x26 n THR 156 Cb 0.56 -0.69 0.61 0.00 -2.10 0.00 0.00 70.33 68.71 2x26 n THR 156 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2x26 n ASP 157 N -1.33 0.23 -4.74 3.42 8.00 -0.24 -4.84 116.55 117.06 2x26 n ASP 157 Ca 0.10 -0.17 -0.30 0.00 0.71 0.00 0.00 54.79 55.13 2x26 n ASP 157 Cb 0.20 -0.20 -0.08 0.00 -0.02 0.00 0.00 41.12 41.03 2x26 n ASP 157 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2x26 s ILE 158 N -2.68 1.57 -0.62 0.53 -4.36 -1.18 -1.15 121.20 113.31 2x26 s ILE 158 Ca 0.23 -1.91 -0.06 0.00 -0.26 0.00 0.00 60.65 58.65 2x26 s ILE 158 Cb 0.20 -2.48 0.16 0.00 1.25 0.00 0.00 42.46 41.58 2x26 s ILE 158 CO 0.51 0.00 0.47 -1.10 0.24 0.00 0.00 174.94 175.06 2x26 s GLN 159 N -3.88 2.69 0.23 0.37 -0.21 -0.81 -4.87 119.66 113.18 2x26 s GLN 159 Ca 0.21 -2.36 -0.31 0.00 0.02 0.00 0.00 55.36 52.92 2x26 s GLN 159 Cb 0.04 -3.87 -0.11 0.00 1.00 0.00 0.00 33.01 30.07 2x26 s GLN 159 CO 0.11 -1.19 1.59 -1.25 -2.12 0.00 0.00 175.29 172.43 2x26 s PRO 160 N 0.27 4.17 -0.40 2.91 0.04 -1.26 -2.73 135.00 138.01 2x26 s PRO 160 Ca 0.15 2.48 0.03 0.00 0.04 0.00 0.00 61.00 63.70 2x26 s PRO 160 Cb -0.19 -3.08 0.11 0.00 0.04 0.00 0.00 34.50 31.37 2x26 s PRO 160 CO -0.04 -0.62 0.13 0.99 0.04 0.00 0.00 177.00 177.50 2x26 s THR 161 N 0.56 2.56 -0.35 1.26 2.01 0.04 -4.90 115.64 116.82 2x26 s THR 161 Ca 0.67 -2.52 -0.29 0.00 0.31 0.00 0.00 61.69 59.86 2x26 s THR 161 Cb -0.46 -2.83 0.01 0.00 0.01 0.00 0.00 72.50 69.23 2x26 s THR 161 CO 0.39 -0.66 1.27 -0.31 -0.69 0.00 0.00 174.62 174.62 2x26 s TYR 162 N 0.67 2.71 -0.12 4.92 2.02 -1.26 -1.97 117.35 124.31 2x26 s TYR 162 Ca 0.12 0.85 -0.11 0.00 -0.37 0.00 0.00 57.07 57.55 2x26 s TYR 162 Cb -0.21 -4.04 0.03 0.00 -0.40 0.00 0.00 41.96 37.34 2x26 s TYR 162 CO -0.06 -1.58 0.33 -0.51 -1.57 0.00 0.00 175.55 172.16 2x26 s LEU 163 N 4.51 0.72 0.85 -1.29 1.43 -0.11 -4.95 118.68 119.85 2x26 s LEU 163 Ca 0.55 0.67 -0.11 0.00 -1.03 0.00 0.00 54.13 54.20 2x26 s LEU 163 Cb -0.14 1.13 0.10 0.00 0.03 0.00 0.00 46.19 47.31 2x26 s LEU 163 CO 0.25 -0.12 1.09 0.42 0.23 0.00 0.00 176.35 178.23 2x26 s THR 164 N 0.21 2.86 0.17 5.49 -4.23 -1.26 -2.65 115.64 116.23 2x26 s THR 164 Ca -0.00 0.28 -0.15 0.00 -1.18 0.00 0.00 61.69 60.64 2x26 s THR 164 Cb -0.03 -2.84 0.07 0.00 1.34 0.00 0.00 72.50 71.05 2x26 s THR 164 CO 0.00 -0.36 1.73 -0.65 -0.54 0.00 0.00 174.62 174.79 2x26 h PRO 165 N -1.37 0.22 -0.91 3.99 0.11 -1.96 -0.17 132.00 131.91 2x26 h PRO 165 Ca -0.48 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.64 2x26 h PRO 165 Cb 1.27 -0.05 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 2x26 h PRO 165 CO 0.55 0.14 0.60 0.00 -0.21 0.00 0.00 178.00 179.08 2x26 h ALA 166 N 1.32 1.18 -0.25 -0.75 0.00 -1.93 0.13 119.26 118.95 2x26 h ALA 166 Ca 0.20 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 2x26 h ALA 166 Cb 0.25 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2x26 h ALA 166 CO -0.26 0.50 -0.45 -0.44 0.00 0.00 0.00 179.25 178.60 2x26 h ASP 167 N 1.19 0.83 -0.67 0.00 3.32 -1.87 -2.77 116.42 116.44 2x26 h ASP 167 Ca 0.35 -0.53 -0.03 0.00 0.02 0.00 0.00 57.03 56.84 2x26 h ASP 167 Cb -0.07 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.21 2x26 h ASP 167 CO -0.10 1.21 0.32 0.00 -1.72 0.00 0.00 179.24 178.94 2x26 h ALA 168 N 0.65 0.87 -0.78 3.45 0.00 -0.79 -0.59 119.26 122.07 2x26 h ALA 168 Ca 0.01 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.83 2x26 h ALA 168 Cb 1.05 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.52 2x26 h ALA 168 CO 0.10 0.44 0.47 -0.09 0.00 0.00 0.00 179.25 180.18 2x26 h ARG 169 N 0.94 0.85 -0.05 0.00 2.43 -0.73 -0.25 114.38 117.57 2x26 h ARG 169 Ca 0.23 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.35 2x26 h ARG 169 Cb 0.13 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2x26 h ARG 169 CO -0.03 0.56 0.02 0.00 -1.51 0.00 0.00 179.97 179.02 2x26 h ALA 170 N 1.37 0.06 -0.48 2.80 0.00 -1.20 -1.93 119.26 119.89 2x26 h ALA 170 Ca 0.34 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.11 2x26 h ALA 170 Cb 0.14 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2x26 h ALA 170 CO -0.16 -0.37 0.03 0.00 0.00 0.00 0.00 179.25 178.76 2x26 h ALA 171 N 0.88 1.17 -0.00 0.00 0.00 -0.67 -0.29 119.26 120.34 2x26 h ALA 171 Ca 0.02 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2x26 h ALA 171 Cb 0.14 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2x26 h ALA 171 CO -0.00 0.55 -0.00 0.35 0.00 0.00 0.00 179.25 180.14 2x26 h PHE 172 N 0.72 0.00 -0.37 0.00 3.57 -1.04 0.62 116.94 120.45 2x26 h PHE 172 Ca 0.15 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.70 2x26 h PHE 172 Cb 0.39 -0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.08 2x26 h PHE 172 CO 0.02 0.47 0.06 1.96 -2.23 0.00 0.00 178.31 178.59 2x26 h GLN 173 N -0.46 0.17 0.00 1.11 4.20 -1.16 -2.19 115.11 116.78 2x26 h GLN 173 Ca 0.00 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.70 2x26 h GLN 173 Cb 0.47 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.21 2x26 h GLN 173 CO 0.00 0.11 0.00 1.96 -0.67 0.00 0.00 178.83 180.23 2x26 h GLN 174 N 0.18 0.00 0.00 1.46 4.20 -1.07 -3.46 115.11 116.42 2x26 h GLN 174 Ca 0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2x26 h GLN 174 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 2x26 h GLN 174 CO -0.24 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.33 2x26 n GLY 175 N -0.34 0.64 0.18 3.46 0.00 -0.82 -4.95 105.19 103.35 2x26 n GLY 175 Ca -0.00 -0.47 0.04 0.00 0.00 0.00 0.00 46.02 45.59 2x26 n GLY 175 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2x26 h ASN 176 N 0.00 0.00 -3.94 1.61 2.35 0.00 -3.44 115.58 112.16 2x26 h ASN 176 Ca 0.00 0.00 -0.41 0.00 -0.55 0.00 0.00 56.30 55.34 2x26 h ASN 176 Cb 0.00 0.00 -0.17 0.00 0.05 0.00 0.00 38.32 38.20 2x26 h ASN 176 CO 0.00 0.42 -0.75 0.68 -1.65 0.00 0.00 177.43 176.13 2x26 s VAL 177 N -3.50 1.36 -0.44 2.81 -7.23 -1.08 -4.94 120.40 107.38 2x26 s VAL 177 Ca 0.00 -1.82 0.23 0.00 -1.81 0.00 0.00 61.98 58.58 2x26 s VAL 177 Cb 0.11 -1.63 -0.13 0.00 0.56 0.00 0.00 36.38 35.28 2x26 s VAL 177 CO 0.70 -0.47 0.93 0.47 -0.31 0.00 0.00 175.10 176.42 2x26 n ASP 178 N 0.34 0.56 -3.78 4.85 8.00 -0.64 -4.64 116.55 121.24 2x26 n ASP 178 Ca -0.14 -0.09 -0.09 0.00 0.71 0.00 0.00 54.79 55.18 2x26 n ASP 178 Cb 0.58 0.95 -0.06 0.00 -0.02 0.00 0.00 41.12 42.56 2x26 n ASP 178 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2x26 s ALA 179 N -3.28 -0.47 -0.17 2.24 0.00 -1.17 -4.47 121.76 114.45 2x26 s ALA 179 Ca 0.01 -0.42 -0.04 0.00 0.00 0.00 0.00 51.96 51.51 2x26 s ALA 179 Cb 0.13 0.55 0.08 0.00 0.00 0.00 0.00 23.12 23.89 2x26 s ALA 179 CO 0.82 -0.55 0.22 -0.46 0.00 0.00 0.00 175.76 175.79 2x26 s TRP 180 N -3.83 -0.29 -0.11 0.00 -0.00 -0.62 -1.04 118.94 113.05 2x26 s TRP 180 Ca 0.04 0.45 -0.20 0.00 -0.00 0.00 0.00 56.10 56.39 2x26 s TRP 180 Cb 0.04 -0.27 -0.04 0.00 -0.00 0.00 0.00 33.47 33.19 2x26 s TRP 180 CO -0.11 -0.50 0.55 0.00 -0.00 0.00 0.00 176.95 176.89 2x26 s ALA 181 N 2.34 3.44 0.01 5.86 0.00 -0.05 -1.10 121.76 132.26 2x26 s ALA 181 Ca 0.05 -0.11 -0.28 0.00 0.00 0.00 0.00 51.96 51.63 2x26 s ALA 181 Cb -0.14 -2.75 0.09 0.00 0.00 0.00 0.00 23.12 20.32 2x26 s ALA 181 CO -0.10 -0.06 0.78 -1.50 0.00 0.00 0.00 175.76 174.88 2x26 s ILE 182 N 0.75 0.00 0.28 0.00 1.10 -0.19 -4.50 121.20 118.65 2x26 s ILE 182 Ca 0.29 0.00 0.07 0.00 -0.51 0.00 0.00 60.65 60.51 2x26 s ILE 182 Cb -0.16 -1.00 -0.03 0.00 0.15 0.00 0.00 42.46 41.42 2x26 s ILE 182 CO 0.12 0.00 0.21 -1.66 -2.11 0.00 0.00 174.94 171.51 2x26 s TRP 183 N -2.69 3.00 0.47 3.50 -2.14 -1.26 -1.54 118.94 118.28 2x26 s TRP 183 Ca 0.00 -0.19 -0.23 0.00 2.66 0.00 0.00 56.10 58.35 2x26 s TRP 183 Cb -0.01 -1.52 -0.07 0.00 -3.10 0.00 0.00 33.47 28.77 2x26 s TRP 183 CO -0.05 0.42 1.19 -0.51 -2.66 0.00 0.00 176.95 175.33 2x26 s ASP 184 N -3.88 6.05 0.00 -2.66 1.01 0.02 -2.11 116.67 115.11 2x26 s ASP 184 Ca 0.35 2.35 0.23 0.00 0.71 0.00 0.00 52.55 56.20 2x26 s ASP 184 Cb -0.07 -2.61 0.79 0.00 1.01 0.00 0.00 42.92 42.04 2x26 s ASP 184 CO 0.25 -1.00 1.58 -0.81 0.21 0.00 0.00 175.17 175.40 2x26 n PRO 185 N -0.58 1.80 -0.32 8.23 -0.04 -1.26 -4.86 135.00 137.97 2x26 n PRO 185 Ca 0.08 -1.19 0.04 0.00 -0.04 0.00 0.00 63.50 62.39 2x26 n PRO 185 Cb 0.48 -1.43 0.23 0.00 -0.04 0.00 0.00 33.50 32.74 2x26 n PRO 185 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2x26 h TYR 186 N 2.55 1.08 0.61 0.54 -1.99 -1.82 -0.07 116.97 117.86 2x26 h TYR 186 Ca 0.00 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.74 2x26 h TYR 186 Cb 0.55 -0.35 -0.01 0.00 2.00 0.00 0.00 36.73 38.92 2x26 h TYR 186 CO 0.08 0.54 -0.40 -0.92 -0.00 0.00 0.00 178.16 177.46 2x26 h TYR 187 N 1.04 -1.07 -1.00 4.88 -0.00 -1.73 -1.75 116.97 117.34 2x26 h TYR 187 Ca 0.42 -0.01 0.01 0.00 -0.00 0.00 0.00 58.73 59.15 2x26 h TYR 187 Cb 0.25 0.39 -0.05 0.00 -0.00 0.00 0.00 36.73 37.32 2x26 h TYR 187 CO -0.00 -0.60 0.66 0.77 -0.00 0.00 0.00 178.16 178.99 2x26 h SER 188 N -0.96 1.14 -0.14 -2.11 0.02 -1.76 -0.77 113.55 108.95 2x26 h SER 188 Ca -0.07 -0.03 0.03 0.00 -0.84 0.00 0.00 61.79 60.88 2x26 h SER 188 Cb 0.79 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.02 2x26 h SER 188 CO 0.06 0.82 -0.03 0.00 -1.14 0.00 0.00 176.83 176.53 2x26 h ALA 189 N 1.37 0.10 -0.24 3.77 0.00 -0.92 -1.87 119.26 121.47 2x26 h ALA 189 Ca 0.37 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.33 2x26 h ALA 189 Cb -0.14 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2x26 h ALA 189 CO -0.09 -0.48 0.14 0.00 0.00 0.00 0.00 179.25 178.82 2x26 h ALA 190 N 1.14 0.30 -0.27 0.00 0.00 -0.90 -2.58 119.26 116.96 2x26 h ALA 190 Ca 0.07 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.99 2x26 h ALA 190 Cb 0.10 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.74 2x26 h ALA 190 CO -0.15 -0.19 -0.12 1.25 0.00 0.00 0.00 179.25 180.05 2x26 h LEU 191 N 0.29 -0.39 -0.87 0.00 5.85 -1.02 -2.73 115.31 116.45 2x26 h LEU 191 Ca 0.08 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 2x26 h LEU 191 Cb 0.03 0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 2x26 h LEU 191 CO -0.02 -0.15 -0.07 -0.07 -0.34 0.00 0.00 178.44 177.80 2x26 h LEU 192 N -0.07 0.00 -0.27 2.25 3.38 -1.26 -1.62 115.31 117.72 2x26 h LEU 192 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2x26 h LEU 192 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2x26 h LEU 192 CO -0.32 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.28 2x26 n GLN 193 N -3.15 0.23 0.00 1.13 6.02 -0.98 -5.03 117.38 115.60 2x26 n GLN 193 Ca 0.02 0.29 0.00 0.00 -0.01 0.00 0.00 57.00 57.29 2x26 n GLN 193 Cb 0.42 -1.82 0.00 0.00 1.02 0.00 0.00 30.24 29.86 2x26 n GLN 193 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2x26 n GLY 194 N 0.80 0.41 1.87 1.08 0.00 -0.61 -5.00 105.19 103.74 2x26 n GLY 194 Ca 0.04 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.28 2x26 n GLY 194 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x26 n GLY 195 N 0.56 1.28 3.34 -0.02 0.00 -1.26 -4.89 105.19 104.20 2x26 n GLY 195 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2x26 n GLY 195 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2x26 s VAL 196 N -2.97 1.96 0.09 1.61 -7.23 -1.26 -0.24 120.40 112.36 2x26 s VAL 196 Ca 0.00 -1.79 0.02 0.00 -1.81 0.00 0.00 61.98 58.39 2x26 s VAL 196 Cb 0.00 -1.83 -0.04 0.00 0.56 0.00 0.00 36.38 35.07 2x26 s VAL 196 CO 0.00 -0.13 -0.07 0.00 -0.31 0.00 0.00 175.10 174.60 2x26 s ARG 197 N -2.36 0.78 -0.34 4.82 1.70 -0.17 -4.64 118.95 118.74 2x26 s ARG 197 Ca 0.13 -1.24 -0.29 0.00 -0.47 0.00 0.00 55.73 53.87 2x26 s ARG 197 Cb -0.08 -0.21 0.02 0.00 -0.57 0.00 0.00 34.95 34.11 2x26 s ARG 197 CO 0.06 -0.01 1.07 0.08 -1.08 0.00 0.00 175.30 175.43 2x26 s VAL 198 N -3.27 4.49 0.08 4.99 1.01 -1.26 -1.51 120.40 124.92 2x26 s VAL 198 Ca 0.08 1.66 -0.13 0.00 0.00 0.00 0.00 61.98 63.60 2x26 s VAL 198 Cb 0.03 -4.43 -0.23 0.00 0.00 0.00 0.00 36.38 31.75 2x26 s VAL 198 CO -0.04 -0.53 1.20 0.25 0.00 0.00 0.00 175.10 175.98 2x26 h LEU 199 N 10.19 0.87 -7.01 3.92 5.85 -1.11 -3.47 115.31 124.55 2x26 h LEU 199 Ca -0.21 -0.70 -0.04 0.00 0.84 0.00 0.00 57.88 57.77 2x26 h LEU 199 Cb 1.06 -0.27 -0.21 0.00 0.37 0.00 0.00 40.66 41.62 2x26 h LEU 199 CO 1.04 1.50 0.12 -0.75 -0.34 0.00 0.00 178.44 180.01 2x26 s LYS 200 N -3.30 0.83 0.00 1.25 2.47 -1.16 -4.81 119.74 115.03 2x26 s LYS 200 Ca -0.09 0.99 0.00 0.00 -1.56 0.00 0.00 55.97 55.30 2x26 s LYS 200 Cb 0.07 0.41 0.00 0.00 -1.46 0.00 0.00 37.83 36.85 2x26 s LYS 200 CO 0.92 -0.10 0.00 -0.40 0.16 0.00 0.00 175.35 175.93 2x26 n ASP 201 N 2.68 1.97 -0.20 1.43 5.68 -1.26 -0.87 116.55 125.98 2x26 n ASP 201 Ca -0.14 -0.64 0.13 0.00 -0.50 0.00 0.00 54.79 53.64 2x26 n ASP 201 Cb 0.55 0.00 0.66 0.00 -1.14 0.00 0.00 41.12 41.19 2x26 n ASP 201 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2x26 n GLY 202 N 5.00 -0.56 0.27 6.12 0.00 0.18 -4.31 105.19 111.89 2x26 n GLY 202 Ca 0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 46.02 45.71 2x26 n GLY 202 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2x26 h THR 203 N 0.91 1.13 -0.37 2.61 2.02 -1.91 -2.30 112.91 114.99 2x26 h THR 203 Ca 0.00 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.88 2x26 h THR 203 Cb 0.20 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 2x26 h THR 203 CO 0.00 0.16 0.00 0.47 0.37 0.00 0.00 175.52 176.52 2x26 n ASP 204 N -4.64 2.57 -0.45 4.18 8.00 -1.26 -4.12 116.55 120.82 2x26 n ASP 204 Ca 0.07 -1.91 0.04 0.00 0.71 0.00 0.00 54.79 53.70 2x26 n ASP 204 Cb 0.06 -0.24 0.11 0.00 -0.02 0.00 0.00 41.12 41.03 2x26 n ASP 204 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2x26 n LEU 205 N 0.90 2.67 -3.71 0.64 4.77 -0.87 -5.03 117.00 116.38 2x26 n LEU 205 Ca 0.17 -2.04 -0.27 0.00 -0.03 0.00 0.00 56.01 53.84 2x26 n LEU 205 Cb 0.44 -0.17 0.03 0.00 -2.33 0.00 0.00 43.42 41.39 2x26 n LEU 205 CO 0.13 0.66 -0.10 -3.20 -1.33 0.00 0.00 177.39 173.55 2x26 n ASN 206 N 0.16 -3.36 -4.80 -1.43 5.15 -1.24 -4.93 115.26 104.81 2x26 n ASN 206 Ca 0.09 -0.94 -0.31 0.00 -0.60 0.00 0.00 54.58 52.81 2x26 n ASN 206 Cb 0.39 -3.61 0.07 0.00 -0.53 0.00 0.00 39.78 36.10 2x26 n ASN 206 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2x26 s GLN 207 N -5.98 2.52 -0.19 1.20 -0.21 -1.26 -5.03 119.66 110.72 2x26 s GLN 207 Ca 0.26 0.98 -0.12 0.00 0.02 0.00 0.00 55.36 56.50 2x26 s GLN 207 Cb -0.09 -1.94 -0.21 0.00 1.00 0.00 0.00 33.01 31.77 2x26 s GLN 207 CO 0.85 -1.40 0.15 2.41 -2.12 0.00 0.00 175.29 175.18 2x26 n THR 208 N -3.34 1.63 0.00 -0.19 -1.04 -1.26 -4.68 114.28 105.40 2x26 n THR 208 Ca 0.08 -0.40 0.00 0.00 -2.04 0.00 0.00 64.05 61.69 2x26 n THR 208 Cb 0.54 -1.82 0.00 0.00 -1.82 0.00 0.00 70.33 67.23 2x26 n THR 208 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2x26 n GLY 209 N 1.74 2.76 3.96 3.41 0.00 -1.26 -4.38 105.19 111.42 2x26 n GLY 209 Ca -0.37 -2.08 -0.22 0.00 0.00 0.00 0.00 46.02 43.35 2x26 n GLY 209 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x26 s SER 210 N 0.00 6.31 0.32 1.61 1.04 -1.21 -4.05 113.70 117.71 2x26 s SER 210 Ca 0.00 0.24 0.10 0.00 0.48 0.00 0.00 55.95 56.77 2x26 s SER 210 Cb 0.00 -1.94 -0.06 0.00 0.10 0.00 0.00 66.02 64.12 2x26 s SER 210 CO 0.00 -0.17 -0.13 -0.36 0.98 0.00 0.00 173.24 173.56 2x26 s PHE 211 N -2.13 2.32 -0.09 5.02 0.08 0.77 -0.99 117.98 122.97 2x26 s PHE 211 Ca 0.37 -0.46 0.03 0.00 0.12 0.00 0.00 56.93 56.99 2x26 s PHE 211 Cb -0.09 -1.22 -0.01 0.00 -0.57 0.00 0.00 43.02 41.12 2x26 s PHE 211 CO 0.32 0.60 -0.19 0.71 -0.10 0.00 0.00 175.22 176.56 2x26 s TYR 212 N -2.61 2.63 0.04 0.36 1.51 -0.49 -1.84 117.35 116.95 2x26 s TYR 212 Ca 0.31 -0.69 0.06 0.00 -1.01 0.00 0.00 57.07 55.75 2x26 s TYR 212 Cb 0.00 -1.71 -0.02 0.00 -0.11 0.00 0.00 41.96 40.12 2x26 s TYR 212 CO 0.15 -0.20 -0.18 -0.51 -1.11 0.00 0.00 175.55 173.71 2x26 s LEU 213 N 0.03 2.17 0.17 -1.29 1.02 -0.05 -0.63 118.68 120.09 2x26 s LEU 213 Ca -0.07 -0.49 0.03 0.00 0.02 0.00 0.00 54.13 53.62 2x26 s LEU 213 Cb -0.15 -0.82 -0.05 0.00 0.02 0.00 0.00 46.19 45.20 2x26 s LEU 213 CO 0.05 0.11 -0.05 0.00 0.02 0.00 0.00 176.35 176.48 2x26 s ALA 214 N -0.81 1.47 0.41 4.21 0.00 -0.78 -1.08 121.76 125.18 2x26 s ALA 214 Ca 0.05 -1.57 -0.26 0.00 0.00 0.00 0.00 51.96 50.19 2x26 s ALA 214 Cb -0.08 0.28 -0.08 0.00 0.00 0.00 0.00 23.12 23.23 2x26 s ALA 214 CO 0.02 -0.20 1.25 0.00 0.00 0.00 0.00 175.76 176.82 2x26 s ALA 215 N -3.45 3.20 0.24 0.00 0.00 -1.25 -0.43 121.76 120.07 2x26 s ALA 215 Ca 0.21 1.12 -0.05 0.00 0.00 0.00 0.00 51.96 53.24 2x26 s ALA 215 Cb 0.04 -3.44 0.45 0.00 0.00 0.00 0.00 23.12 20.17 2x26 s ALA 215 CO 0.03 -0.71 1.71 -0.09 0.00 0.00 0.00 175.76 176.70 2x26 h ARG 216 N 2.64 0.34 -0.02 0.00 2.43 -1.82 -1.41 114.38 116.54 2x26 h ARG 216 Ca -0.49 -0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 58.50 2x26 h ARG 216 Cb 1.24 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 2x26 h ARG 216 CO 0.62 0.22 -0.71 -1.35 -1.51 0.00 0.00 179.97 177.25 2x26 h PRO 217 N 0.35 0.13 -0.51 0.20 0.11 -1.92 0.46 132.00 130.82 2x26 h PRO 217 Ca 0.41 -0.11 -0.03 0.00 0.11 0.00 0.00 66.00 66.37 2x26 h PRO 217 Cb 0.66 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.77 2x26 h PRO 217 CO -0.45 0.79 0.19 -0.92 -0.21 0.00 0.00 178.00 177.39 2x26 h TYR 218 N 0.09 0.80 -0.55 0.65 3.20 -1.81 -1.79 116.97 117.56 2x26 h TYR 218 Ca -0.02 -0.07 -0.05 0.00 3.14 0.00 0.00 58.73 61.73 2x26 h TYR 218 Cb 1.26 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 39.27 2x26 h TYR 218 CO 0.01 0.68 0.13 0.00 -1.64 0.00 0.00 178.16 177.34 2x26 h ALA 219 N 1.04 0.73 -0.11 1.82 0.00 -1.03 -0.65 119.26 121.06 2x26 h ALA 219 Ca 0.17 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2x26 h ALA 219 Cb 0.23 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2x26 h ALA 219 CO -0.01 0.43 0.06 0.93 0.00 0.00 0.00 179.25 180.66 2x26 h GLU 220 N 0.78 0.13 -0.29 0.00 5.08 -0.83 -2.02 114.58 117.42 2x26 h GLU 220 Ca 0.17 -0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 58.38 2x26 h GLU 220 Cb 0.35 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2x26 h GLU 220 CO 0.00 0.09 -0.42 0.87 -1.00 0.00 0.00 179.01 178.55 2x26 h LYS 221 N 0.13 0.72 -0.89 2.33 1.57 -1.29 -3.34 116.57 115.81 2x26 h LYS 221 Ca 0.04 -0.39 -0.53 0.00 -1.87 0.00 0.00 60.65 57.90 2x26 h LYS 221 Cb -0.01 0.02 -0.43 0.00 0.08 0.00 0.00 32.23 31.89 2x26 h LYS 221 CO -0.02 1.01 -0.83 0.09 -0.57 0.00 0.00 179.45 179.13 2x26 n ASN 222 N -4.03 4.56 -0.01 0.86 3.02 -0.26 -4.88 115.26 114.51 2x26 n ASN 222 Ca -0.02 -3.59 -0.11 0.00 -0.03 0.00 0.00 54.58 50.82 2x26 n ASN 222 Cb 0.54 -0.38 -0.06 0.00 -0.61 0.00 0.00 39.78 39.27 2x26 n ASN 222 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 2x26 h GLY 223 N 2.31 0.15 0.92 7.41 0.00 -1.50 -1.31 103.07 111.06 2x26 h GLY 223 Ca 0.31 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.54 2x26 h GLY 223 CO 0.73 0.07 0.12 0.00 0.00 0.00 0.00 176.54 177.46 2x26 h ALA 224 N 0.92 0.43 -0.73 3.60 0.00 -1.90 -2.55 119.26 119.03 2x26 h ALA 224 Ca 0.03 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.83 2x26 h ALA 224 Cb 0.12 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2x26 h ALA 224 CO -0.00 0.05 0.46 0.35 0.00 0.00 0.00 179.25 180.11 2x26 h PHE 225 N 0.38 0.87 -0.76 0.00 3.57 -1.89 -1.13 116.94 117.97 2x26 h PHE 225 Ca 0.11 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.64 2x26 h PHE 225 Cb 0.22 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 2x26 h PHE 225 CO 0.00 0.50 0.50 0.82 -2.23 0.00 0.00 178.31 177.90 2x26 h ILE 226 N 0.91 1.17 -0.68 1.41 2.04 -1.16 -0.32 117.51 120.88 2x26 h ILE 226 Ca 0.29 -0.35 0.04 0.00 1.00 0.00 0.00 64.86 65.85 2x26 h ILE 226 Cb 0.01 0.08 -0.04 0.00 -0.74 0.00 0.00 36.82 36.12 2x26 h ILE 226 CO -0.11 0.18 0.45 1.56 0.00 0.00 0.00 178.15 180.24 2x26 h GLN 227 N 1.01 0.76 -0.24 2.37 1.08 -0.80 0.12 115.11 119.42 2x26 h GLN 227 Ca 0.29 -0.05 -0.04 0.00 -1.45 0.00 0.00 58.65 57.40 2x26 h GLN 227 Cb -0.08 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.17 2x26 h GLN 227 CO -0.07 0.51 -0.01 0.78 -0.95 0.00 0.00 178.83 179.08 2x26 h GLY 228 N 0.79 0.47 0.38 3.46 0.00 -0.70 -1.17 103.07 106.30 2x26 h GLY 228 Ca 0.28 -0.35 0.05 0.00 0.00 0.00 0.00 47.33 47.31 2x26 h GLY 228 CO -0.08 0.32 -0.15 -2.08 0.00 0.00 0.00 176.54 174.55 2x26 h VAL 229 N 0.20 0.57 -0.89 4.60 2.07 -0.34 -0.97 116.25 121.49 2x26 h VAL 229 Ca 0.07 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.64 2x26 h VAL 229 Cb 0.43 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 30.71 2x26 h VAL 229 CO 0.01 0.00 0.57 -0.07 0.02 0.00 0.00 177.57 178.10 2x26 h LEU 230 N -0.16 0.92 -1.26 2.57 3.38 -0.71 -0.59 115.31 119.46 2x26 h LEU 230 Ca 0.12 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.11 2x26 h LEU 230 Cb 0.33 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 2x26 h LEU 230 CO -0.29 0.61 0.51 0.00 0.09 0.00 0.00 178.44 179.35 2x26 h ALA 231 N 1.40 1.48 -0.55 1.53 0.00 -0.57 -0.61 119.26 121.93 2x26 h ALA 231 Ca 0.38 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.14 2x26 h ALA 231 Cb 0.10 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2x26 h ALA 231 CO -0.15 0.47 -0.04 1.15 0.00 0.00 0.00 179.25 180.68 2x26 h THR 232 N 1.01 1.26 -0.51 0.00 2.02 -0.47 -1.55 112.91 114.68 2x26 h THR 232 Ca 0.29 -1.16 -0.03 0.00 0.77 0.00 0.00 66.41 66.27 2x26 h THR 232 Cb -0.08 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 2x26 h THR 232 CO -0.07 0.41 0.19 -0.26 0.37 0.00 0.00 175.52 176.16 2x26 h PHE 233 N 0.89 0.74 -0.34 3.16 0.04 -0.03 -0.25 116.94 121.13 2x26 h PHE 233 Ca 0.15 -0.04 -0.08 0.00 2.80 0.00 0.00 57.97 60.80 2x26 h PHE 233 Cb 0.58 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.49 2x26 h PHE 233 CO 0.04 0.59 -0.12 1.03 -0.60 0.00 0.00 178.31 179.24 2x26 h SER 234 N 0.73 0.69 -0.62 2.17 0.87 -0.89 -0.02 113.55 116.47 2x26 h SER 234 Ca 0.17 -0.38 0.05 0.00 -1.23 0.00 0.00 61.79 60.40 2x26 h SER 234 Cb 0.17 -0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 61.89 2x26 h SER 234 CO -0.01 0.92 0.35 -0.08 -0.53 0.00 0.00 176.83 177.48 2x26 h GLU 235 N 0.46 0.65 -0.40 2.24 4.81 -1.04 -1.23 114.58 120.08 2x26 h GLU 235 Ca 0.08 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.13 2x26 h GLU 235 Cb 0.64 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 2x26 h GLU 235 CO 0.04 0.43 -0.31 0.00 -0.73 0.00 0.00 179.01 178.44 2x26 h ALA 236 N 1.31 0.70 -0.60 2.92 0.00 -0.76 -2.55 119.26 120.28 2x26 h ALA 236 Ca 0.27 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 2x26 h ALA 236 Cb 0.13 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2x26 h ALA 236 CO -0.15 0.67 0.21 0.22 0.00 0.00 0.00 179.25 180.19 2x26 h ASP 237 N 0.74 0.82 0.51 0.00 1.82 -0.75 -1.98 116.42 117.57 2x26 h ASP 237 Ca 0.08 -0.12 0.00 0.00 -0.39 0.00 0.00 57.03 56.60 2x26 h ASP 237 Cb 0.87 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 40.67 2x26 h ASP 237 CO 0.08 0.75 0.00 0.00 -1.61 0.00 0.00 179.24 178.46 2x26 h ALA 238 N 1.36 1.00 0.00 -0.78 0.00 -0.81 -0.76 119.26 119.27 2x26 h ALA 238 Ca 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 2x26 h ALA 238 Cb 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2x26 h ALA 238 CO -0.01 0.00 -0.02 -0.07 0.00 0.00 0.00 179.25 179.15 2x26 h LEU 239 N 0.00 0.00 -2.40 0.00 3.38 -1.20 -0.14 115.31 114.95 2x26 h LEU 239 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2x26 h LEU 239 Cb 0.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 2x26 h LEU 239 CO 0.00 0.02 -0.01 0.71 0.09 0.00 0.00 178.44 179.25 2x26 h THR 240 N 0.00 0.58 0.04 0.22 1.35 -1.27 0.25 112.91 114.08 2x26 h THR 240 Ca -0.00 -0.03 -0.38 0.00 -0.55 0.00 0.00 66.41 65.45 2x26 h THR 240 Cb 0.04 1.02 -0.05 0.00 -1.73 0.00 0.00 68.15 67.43 2x26 h THR 240 CO 0.00 0.01 -2.28 0.54 -0.25 0.00 0.00 175.52 173.54 2x26 n ARG 241 N -3.91 0.69 0.11 4.72 1.74 -0.19 -3.77 116.66 116.04 2x26 n ARG 241 Ca -0.03 0.19 0.04 0.00 -0.77 0.00 0.00 57.85 57.28 2x26 n ARG 241 Cb 0.09 -1.60 -0.00 0.00 -1.02 0.00 0.00 32.46 29.93 2x26 n ARG 241 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2x26 h SER 242 N 0.03 0.00 -1.91 0.55 4.64 -1.09 -3.36 113.55 112.40 2x26 h SER 242 Ca -0.51 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.31 2x26 h SER 242 Cb 1.97 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 63.65 2x26 h SER 242 CO -0.01 0.39 -1.02 0.00 -0.87 0.00 0.00 176.83 175.32 2x26 n GLN 243 N -3.01 1.75 -0.06 4.77 6.02 0.87 -4.97 117.38 122.76 2x26 n GLN 243 Ca -0.02 -3.83 -0.09 0.00 -0.01 0.00 0.00 57.00 53.05 2x26 n GLN 243 Cb 0.72 -1.82 -0.02 0.00 1.02 0.00 0.00 30.24 30.13 2x26 n GLN 243 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 2x26 h ARG 244 N 2.97 0.26 -0.14 -1.09 2.43 -1.64 0.11 114.38 117.28 2x26 h ARG 244 Ca 0.09 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.27 2x26 h ARG 244 Cb 0.87 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.34 2x26 h ARG 244 CO 0.61 0.17 -0.01 1.49 -1.51 0.00 0.00 179.97 180.72 2x26 h GLU 245 N 0.27 0.03 -0.65 0.20 4.81 -1.90 0.20 114.58 117.54 2x26 h GLU 245 Ca 0.09 -0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.27 2x26 h GLU 245 Cb 0.00 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 2x26 h GLU 245 CO -0.05 0.02 0.20 0.37 -0.73 0.00 0.00 179.01 178.83 2x26 h GLN 246 N 0.03 1.01 -0.50 1.92 4.15 -1.89 -2.14 115.11 117.68 2x26 h GLN 246 Ca 0.06 -0.22 -0.11 0.00 0.77 0.00 0.00 58.65 59.16 2x26 h GLN 246 Cb 0.08 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.61 2x26 h GLN 246 CO -0.12 0.88 -0.11 0.77 -1.93 0.00 0.00 178.83 178.32 2x26 h SER 247 N 0.94 0.94 -0.66 -0.69 0.02 -0.36 -1.57 113.55 112.17 2x26 h SER 247 Ca 0.21 -0.30 0.03 0.00 -0.84 0.00 0.00 61.79 60.88 2x26 h SER 247 Cb 0.29 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.54 2x26 h SER 247 CO -0.01 1.06 0.41 0.40 -1.14 0.00 0.00 176.83 177.55 2x26 h ILE 248 N 0.84 1.09 -0.54 3.27 2.04 -0.44 -0.58 117.51 123.19 2x26 h ILE 248 Ca 0.13 -0.28 -0.02 0.00 1.00 0.00 0.00 64.86 65.69 2x26 h ILE 248 Cb 0.65 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 2x26 h ILE 248 CO 0.05 0.15 0.24 0.00 0.00 0.00 0.00 178.15 178.59 2x26 h ALA 249 N 1.28 0.69 -0.08 1.87 0.00 -0.89 0.21 119.26 122.35 2x26 h ALA 249 Ca 0.26 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2x26 h ALA 249 Cb 0.01 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2x26 h ALA 249 CO -0.10 0.27 0.03 -0.07 0.00 0.00 0.00 179.25 179.38 2x26 h LEU 250 N 0.72 0.11 -0.79 0.00 3.38 -0.98 -2.62 115.31 115.13 2x26 h LEU 250 Ca 0.18 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 2x26 h LEU 250 Cb 0.14 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2x26 h LEU 250 CO -0.02 0.27 -0.11 -0.07 0.09 0.00 0.00 178.44 178.60 2x26 h LEU 251 N -0.05 0.79 -0.88 1.67 3.38 -1.01 -1.59 115.31 117.62 2x26 h LEU 251 Ca 0.03 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.76 2x26 h LEU 251 Cb 0.19 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 2x26 h LEU 251 CO -0.00 0.92 0.57 0.00 0.09 0.00 0.00 178.44 180.02 2x26 h ALA 252 N 1.15 1.11 -0.00 1.53 0.00 -0.89 0.29 119.26 122.46 2x26 h ALA 252 Ca 0.12 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 2x26 h ALA 252 Cb 0.59 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 18.04 2x26 h ALA 252 CO 0.04 0.53 -0.54 -0.22 0.00 0.00 0.00 179.25 179.06 2x26 h LYS 253 N 1.19 0.36 -0.75 0.00 3.64 -1.20 0.33 116.57 120.15 2x26 h LYS 253 Ca 0.32 -0.39 -0.06 0.00 -1.27 0.00 0.00 60.65 59.25 2x26 h LYS 253 Cb -0.12 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.78 2x26 h LYS 253 CO -0.07 1.07 0.25 1.79 -2.27 0.00 0.00 179.45 180.22 2x26 h THR 254 N -0.18 1.26 0.00 1.00 1.35 -1.20 -2.85 112.91 112.29 2x26 h THR 254 Ca -0.07 -0.88 0.00 0.00 -0.55 0.00 0.00 66.41 64.91 2x26 h THR 254 Cb 1.26 0.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 2x26 h THR 254 CO 0.11 0.35 -0.18 0.24 -0.25 0.00 0.00 175.52 175.78 2x26 h MET 255 N 1.10 0.00 -3.21 4.72 2.86 -0.96 -3.48 114.93 115.96 2x26 h MET 255 Ca 0.24 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.71 2x26 h MET 255 Cb 0.28 0.00 0.06 0.00 0.06 0.00 0.00 31.60 32.01 2x26 h MET 255 CO -0.01 0.00 -0.31 0.41 1.06 0.00 0.00 176.91 178.06 2x26 n GLY 256 N 1.22 0.26 3.31 8.32 0.00 0.98 -5.04 105.19 114.24 2x26 n GLY 256 Ca 0.04 -0.26 -0.18 0.00 0.00 0.00 0.00 46.02 45.62 2x26 n GLY 256 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x26 s LEU 257 N -3.81 2.51 0.59 0.99 1.43 -0.19 -5.03 118.68 115.18 2x26 s LEU 257 Ca 0.22 -0.97 -0.19 0.00 -1.03 0.00 0.00 54.13 52.17 2x26 s LEU 257 Cb -0.10 -0.60 -0.04 0.00 0.03 0.00 0.00 46.19 45.48 2x26 s LEU 257 CO 0.32 -0.18 1.21 -2.84 0.23 0.00 0.00 176.35 175.08 2x26 s PRO 258 N -3.42 2.99 0.28 1.29 0.02 -1.26 -4.64 135.00 130.26 2x26 s PRO 258 Ca 0.18 1.82 -0.00 0.00 0.02 0.00 0.00 61.00 63.02 2x26 s PRO 258 Cb -0.01 -1.93 0.49 0.00 0.02 0.00 0.00 34.50 33.06 2x26 s PRO 258 CO 0.05 -1.19 1.86 0.00 -0.33 0.00 0.00 177.00 177.39 2x26 h ALA 259 N 0.90 1.47 0.00 -1.55 0.00 -1.94 -1.29 119.26 116.85 2x26 h ALA 259 Ca -0.50 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.36 2x26 h ALA 259 Cb 1.30 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2x26 h ALA 259 CO 0.55 0.33 -0.21 -1.35 0.00 0.00 0.00 179.25 178.58 2x26 h PRO 260 N 1.08 0.00 -0.42 0.00 0.11 -1.99 0.33 132.00 131.11 2x26 h PRO 260 Ca 0.47 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.43 2x26 h PRO 260 Cb 0.33 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.44 2x26 h PRO 260 CO -0.22 0.21 -0.31 0.28 -0.21 0.00 0.00 178.00 177.75 2x26 h VAL 261 N 0.00 1.27 -0.47 3.15 2.07 -1.61 -1.87 116.25 118.78 2x26 h VAL 261 Ca -0.00 -1.48 -0.10 0.00 0.82 0.00 0.00 66.70 65.94 2x26 h VAL 261 Cb 0.47 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 2x26 h VAL 261 CO 0.03 0.50 -0.10 0.40 0.02 0.00 0.00 177.57 178.41 2x26 h ILE 262 N 0.78 1.26 -0.53 4.57 1.08 -0.94 -0.82 117.51 122.90 2x26 h ILE 262 Ca 0.08 -1.19 -0.02 0.00 -0.39 0.00 0.00 64.86 63.34 2x26 h ILE 262 Cb 0.89 1.01 -0.02 0.00 -3.07 0.00 0.00 36.82 35.62 2x26 h ILE 262 CO 0.08 0.41 0.26 0.00 -0.69 0.00 0.00 178.15 178.21 2x26 h ALA 263 N 1.11 0.69 -0.44 1.87 0.00 -0.82 0.79 119.26 122.46 2x26 h ALA 263 Ca 0.13 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 2x26 h ALA 263 Cb 0.61 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2x26 h ALA 263 CO 0.04 0.25 0.09 1.03 0.00 0.00 0.00 179.25 180.66 2x26 h SER 264 N 0.72 0.68 -0.44 0.00 0.87 -1.11 -1.05 113.55 113.21 2x26 h SER 264 Ca 0.18 -0.25 0.05 0.00 -1.23 0.00 0.00 61.79 60.55 2x26 h SER 264 Cb 0.12 -0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 61.85 2x26 h SER 264 CO -0.02 0.76 0.17 0.22 -0.53 0.00 0.00 176.83 177.43 2x26 h TYR 265 N 0.58 0.31 -0.23 2.24 3.20 -0.64 -1.98 116.97 120.45 2x26 h TYR 265 Ca 0.13 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.95 2x26 h TYR 265 Cb 0.36 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 2x26 h TYR 265 CO 0.02 0.12 -0.18 -0.07 -1.64 0.00 0.00 178.16 176.42 2x26 h LEU 266 N 0.35 0.38 -1.02 2.82 3.38 -0.63 -2.70 115.31 117.89 2x26 h LEU 266 Ca 0.21 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2x26 h LEU 266 Cb 0.18 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2x26 h LEU 266 CO -0.20 0.58 0.00 0.44 0.09 0.00 0.00 178.44 179.35 2x26 h ASP 267 N 0.36 0.00 -0.22 -0.43 3.32 -0.44 -2.45 116.42 116.56 2x26 h ASP 267 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2x26 h ASP 267 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 2x26 h ASP 267 CO 0.03 0.00 0.00 1.41 -1.72 0.00 0.00 179.24 178.96 2x26 n HIS 268 N -2.47 0.28 -4.53 4.55 8.25 -1.01 -4.92 115.22 115.38 2x26 n HIS 268 Ca 0.01 -0.14 -0.34 0.00 -0.26 0.00 0.00 57.72 57.00 2x26 n HIS 268 Cb 0.22 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.23 2x26 n HIS 268 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2x26 s ARG 269 N -1.72 2.75 0.73 -0.41 0.52 -0.92 -3.94 118.95 115.95 2x26 s ARG 269 Ca 0.34 -0.57 -0.12 0.00 -0.52 0.00 0.00 55.73 54.87 2x26 s ARG 269 Cb 0.20 -2.61 0.03 0.00 0.52 0.00 0.00 34.95 33.09 2x26 s ARG 269 CO 0.29 0.65 1.11 -1.25 0.02 0.00 0.00 175.30 176.12 2x26 s PRO 270 N -1.00 2.63 0.39 3.54 0.04 -1.26 -4.99 135.00 134.35 2x26 s PRO 270 Ca 0.14 0.46 -0.27 0.00 0.04 0.00 0.00 61.00 61.37 2x26 s PRO 270 Cb -0.11 -2.00 -0.11 0.00 0.04 0.00 0.00 34.50 32.33 2x26 s PRO 270 CO 0.03 -1.19 1.37 -2.30 0.04 0.00 0.00 177.00 174.95 2x26 n PRO 271 N -3.11 2.27 -3.17 0.56 -0.02 -1.26 -4.93 135.00 125.33 2x26 n PRO 271 Ca 0.07 0.80 -0.39 0.00 -2.02 0.00 0.00 63.50 61.96 2x26 n PRO 271 Cb 0.57 -2.50 -0.06 0.00 -0.02 0.00 0.00 33.50 31.49 2x26 n PRO 271 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2x26 s THR 272 N -1.15 4.61 0.09 3.45 2.01 -1.26 -4.84 115.64 118.56 2x26 s THR 272 Ca 0.57 1.37 0.04 0.00 0.31 0.00 0.00 61.69 63.98 2x26 s THR 272 Cb -0.50 -3.97 -0.03 0.00 0.01 0.00 0.00 72.50 68.00 2x26 s THR 272 CO 0.61 0.52 -0.12 0.42 -0.69 0.00 0.00 174.62 175.36 2x26 s THR 273 N -1.15 1.04 -0.14 -0.82 -4.23 -1.26 -4.93 115.64 104.15 2x26 s THR 273 Ca 0.32 -1.49 0.01 0.00 -1.18 0.00 0.00 61.69 59.35 2x26 s THR 273 Cb -0.20 -1.23 0.02 0.00 1.34 0.00 0.00 72.50 72.43 2x26 s THR 273 CO 0.21 -0.40 -0.17 -0.63 -0.54 0.00 0.00 174.62 173.10 2x26 s ILE 274 N -1.89 1.70 0.08 2.99 1.01 -1.26 -4.16 121.20 119.67 2x26 s ILE 274 Ca 0.02 -0.74 0.03 0.00 0.00 0.00 0.00 60.65 59.97 2x26 s ILE 274 Cb -0.06 -1.56 -0.03 0.00 0.01 0.00 0.00 42.46 40.82 2x26 s ILE 274 CO 0.01 0.48 -0.10 -0.54 0.00 0.00 0.00 174.94 174.79 2x26 s LYS 275 N 1.19 0.76 0.78 2.79 1.02 -0.85 -4.88 119.74 120.54 2x26 s LYS 275 Ca -0.01 -1.03 -0.15 0.00 0.02 0.00 0.00 55.97 54.81 2x26 s LYS 275 Cb -0.14 -0.51 0.02 0.00 -0.52 0.00 0.00 37.83 36.68 2x26 s LYS 275 CO -0.07 0.09 0.83 -2.30 -0.92 0.00 0.00 175.35 172.98 2x26 n PRO 276 N 0.88 0.25 -2.46 -1.68 -0.02 -1.26 -0.67 135.00 130.04 2x26 n PRO 276 Ca -0.18 0.14 -0.43 0.00 -2.02 0.00 0.00 63.50 61.01 2x26 n PRO 276 Cb 0.56 -2.12 -0.02 0.00 -0.02 0.00 0.00 33.50 31.90 2x26 n PRO 276 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2x26 s VAL 277 N -2.01 4.34 0.78 -1.45 1.01 -1.26 -4.71 120.40 117.11 2x26 s VAL 277 Ca 0.69 1.62 -0.03 0.00 0.00 0.00 0.00 61.98 64.26 2x26 s VAL 277 Cb -0.31 -4.06 0.15 0.00 0.00 0.00 0.00 36.38 32.16 2x26 s VAL 277 CO 0.55 -0.16 1.07 0.54 0.00 0.00 0.00 175.10 177.10 2x26 s ASN 278 N 1.88 4.02 0.23 3.32 2.20 -1.26 -4.86 114.94 120.46 2x26 s ASN 278 Ca 0.53 -0.34 -0.02 0.00 -0.94 0.00 0.00 52.86 52.09 2x26 s ASN 278 Cb -0.20 0.09 0.23 0.00 -2.00 0.00 0.00 41.25 39.37 2x26 s ASN 278 CO 0.13 -2.10 1.62 0.00 -2.94 0.00 0.00 177.10 173.81 2x26 h ALA 279 N -0.77 0.89 -0.25 3.54 0.00 -1.98 0.57 119.26 121.25 2x26 h ALA 279 Ca -0.37 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.07 2x26 h ALA 279 Cb 1.26 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2x26 h ALA 279 CO 0.37 0.63 -0.07 1.49 0.00 0.00 0.00 179.25 181.68 2x26 h GLU 280 N 0.50 0.49 -0.50 0.00 4.81 -1.99 -0.10 114.58 117.80 2x26 h GLU 280 Ca 0.05 -0.19 -0.08 0.00 -0.13 0.00 0.00 59.36 59.02 2x26 h GLU 280 Cb 0.84 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 2x26 h GLU 280 CO 0.07 0.71 0.01 0.28 -0.73 0.00 0.00 179.01 179.35 2x26 h VAL 281 N 0.23 1.26 -0.89 0.32 2.07 -1.88 -1.64 116.25 115.71 2x26 h VAL 281 Ca 0.06 -1.06 0.13 0.00 0.82 0.00 0.00 66.70 66.65 2x26 h VAL 281 Cb 0.54 0.97 -0.09 0.00 -1.52 0.00 0.00 31.29 31.19 2x26 h VAL 281 CO 0.03 0.37 0.51 0.00 0.02 0.00 0.00 177.57 178.50 2x26 h ALA 282 N 0.94 1.35 -0.43 1.67 0.00 -0.78 0.11 119.26 122.11 2x26 h ALA 282 Ca 0.14 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 2x26 h ALA 282 Cb 0.51 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2x26 h ALA 282 CO 0.02 0.04 -0.16 0.00 0.00 0.00 0.00 179.25 179.16 2x26 h ALA 283 N 1.53 0.60 -0.34 0.00 0.00 -0.63 -0.67 119.26 119.75 2x26 h ALA 283 Ca 0.47 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2x26 h ALA 283 Cb 0.56 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2x26 h ALA 283 CO -0.31 0.53 0.14 -0.07 0.00 0.00 0.00 179.25 179.53 2x26 h LEU 284 N 0.69 0.46 -1.38 0.00 3.38 -0.57 -1.68 115.31 116.22 2x26 h LEU 284 Ca 0.10 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2x26 h LEU 284 Cb 0.71 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2x26 h LEU 284 CO 0.05 0.50 -0.09 -0.61 0.09 0.00 0.00 178.44 178.39 2x26 h GLN 285 N 0.40 0.30 -0.41 1.13 5.75 -0.63 -2.09 115.11 119.56 2x26 h GLN 285 Ca 0.11 -0.07 -0.15 0.00 -0.15 0.00 0.00 58.65 58.40 2x26 h GLN 285 Cb 0.18 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 2x26 h GLN 285 CO -0.01 0.41 -0.32 0.37 -2.65 0.00 0.00 178.83 176.63 2x26 h GLN 286 N 0.29 0.95 -0.48 1.69 5.75 -0.80 -1.25 115.11 121.25 2x26 h GLN 286 Ca 0.06 -0.46 0.05 0.00 -0.15 0.00 0.00 58.65 58.14 2x26 h GLN 286 Cb 0.35 -0.00 -0.05 0.00 1.07 0.00 0.00 27.48 28.85 2x26 h GLN 286 CO 0.02 1.13 0.22 0.37 -2.65 0.00 0.00 178.83 177.92 2x26 h GLN 287 N 0.78 0.43 -0.59 1.69 4.15 -0.92 0.26 115.11 120.91 2x26 h GLN 287 Ca 0.08 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.41 2x26 h GLN 287 Cb 0.91 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.48 2x26 h GLN 287 CO 0.08 0.28 0.11 1.15 -1.93 0.00 0.00 178.83 178.52 2x26 h THR 288 N 0.44 1.26 -0.30 2.39 2.02 -1.24 0.29 112.91 117.76 2x26 h THR 288 Ca 0.22 -0.96 0.01 0.00 0.77 0.00 0.00 66.41 66.45 2x26 h THR 288 Cb 0.16 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 2x26 h THR 288 CO -0.17 0.35 0.18 0.00 0.37 0.00 0.00 175.52 176.25 2x26 h ALA 289 N 1.02 0.38 -0.40 6.16 0.00 -0.72 0.15 119.26 125.84 2x26 h ALA 289 Ca 0.18 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2x26 h ALA 289 Cb 0.40 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2x26 h ALA 289 CO 0.01 -0.19 0.21 -0.44 0.00 0.00 0.00 179.25 178.83 2x26 h ASP 290 N 0.36 0.51 -0.66 0.00 3.32 -0.25 -0.96 116.42 118.74 2x26 h ASP 290 Ca 0.12 -0.11 0.07 0.00 0.02 0.00 0.00 57.03 57.13 2x26 h ASP 290 Cb 0.00 -0.13 -0.06 0.00 0.22 0.00 0.00 39.33 39.36 2x26 h ASP 290 CO -0.06 0.47 0.35 0.25 -1.72 0.00 0.00 179.24 178.53 2x26 h LEU 291 N 0.51 0.49 -0.81 1.55 5.85 -0.02 0.18 115.31 123.06 2x26 h LEU 291 Ca 0.14 0.04 -0.13 0.00 0.84 0.00 0.00 57.88 58.78 2x26 h LEU 291 Cb 0.08 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2x26 h LEU 291 CO -0.02 0.31 -0.56 -0.26 -0.34 0.00 0.00 178.44 177.57 2x26 h PHE 292 N 0.63 0.12 -0.17 1.25 -1.00 -0.54 -1.66 116.94 115.57 2x26 h PHE 292 Ca 0.31 -0.04 -0.13 0.00 2.81 0.00 0.00 57.97 60.91 2x26 h PHE 292 Cb 0.24 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 39.78 2x26 h PHE 292 CO -0.09 0.64 -0.41 -0.92 -1.61 0.00 0.00 178.31 175.91 2x26 h TYR 293 N 0.07 0.74 0.00 -0.55 3.20 -0.51 0.11 116.97 120.03 2x26 h TYR 293 Ca -0.00 -0.28 -0.03 0.00 3.14 0.00 0.00 58.73 61.55 2x26 h TYR 293 Cb 1.01 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 39.15 2x26 h TYR 293 CO 0.01 1.04 -0.16 0.93 -1.64 0.00 0.00 178.16 178.34 2x26 h GLU 294 N 0.23 0.00 -0.46 1.82 5.08 -0.59 0.03 114.58 120.69 2x26 h GLU 294 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2x26 h GLU 294 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 2x26 h GLU 294 CO 0.09 0.16 0.00 0.09 -1.00 0.00 0.00 179.01 178.35 2x26 n ASN 295 N -4.12 2.60 -1.71 1.42 3.02 -0.63 -4.95 115.26 110.89 2x26 n ASN 295 Ca -0.02 -1.97 -0.18 0.00 -0.03 0.00 0.00 54.58 52.37 2x26 n ASN 295 Cb 0.23 -0.31 -0.05 0.00 -0.61 0.00 0.00 39.78 39.05 2x26 n ASN 295 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2x26 n ARG 296 N 0.92 -1.36 0.11 3.52 1.74 -0.00 -4.88 116.66 116.72 2x26 n ARG 296 Ca 0.17 1.03 0.02 0.00 -0.77 0.00 0.00 57.85 58.29 2x26 n ARG 296 Cb 0.42 -5.41 -0.00 0.00 -1.02 0.00 0.00 32.46 26.45 2x26 n ARG 296 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2x26 h LEU 297 N 0.00 0.00 -8.56 0.55 3.38 -1.02 -3.44 115.31 106.22 2x26 h LEU 297 Ca -0.40 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.06 2x26 h LEU 297 Cb 1.25 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.78 2x26 h LEU 297 CO 0.53 0.53 -0.81 0.68 0.09 0.00 0.00 178.44 179.46 2x26 s VAL 298 N -2.95 1.49 -0.53 1.22 -7.23 -1.20 -5.03 120.40 106.19 2x26 s VAL 298 Ca 0.02 -1.40 0.25 0.00 -1.81 0.00 0.00 61.98 59.05 2x26 s VAL 298 Cb 0.08 -1.37 0.32 0.00 0.56 0.00 0.00 36.38 35.97 2x26 s VAL 298 CO 0.76 -0.08 1.72 1.55 -0.31 0.00 0.00 175.10 178.75 2x26 h PRO 299 N 4.28 0.00 -5.02 4.82 0.13 -1.87 -3.41 132.00 130.93 2x26 h PRO 299 Ca -0.44 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.35 2x26 h PRO 299 Cb 1.18 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.11 2x26 h PRO 299 CO 0.40 0.00 -0.75 0.15 -0.23 0.00 0.00 178.00 177.57 2x26 s LYS 300 N -3.21 0.74 0.18 0.86 1.02 -1.26 -5.13 119.74 112.95 2x26 s LYS 300 Ca 0.08 -0.95 -0.30 0.00 0.02 0.00 0.00 55.97 54.82 2x26 s LYS 300 Cb 0.09 -0.60 -0.08 0.00 -0.52 0.00 0.00 37.83 36.73 2x26 s LYS 300 CO 0.61 0.12 1.06 0.21 -0.92 0.00 0.00 175.35 176.42 2x26 s LYS 301 N -1.98 4.64 0.02 1.68 2.20 -1.26 -4.83 119.74 120.22 2x26 s LYS 301 Ca -0.02 1.65 0.04 0.00 -0.36 0.00 0.00 55.97 57.28 2x26 s LYS 301 Cb -0.08 -3.29 -0.03 0.00 -1.51 0.00 0.00 37.83 32.92 2x26 s LYS 301 CO 0.01 0.16 -0.08 0.08 -0.36 0.00 0.00 175.35 175.17 2x26 s VAL 302 N -0.38 3.57 -0.75 4.02 1.01 -1.26 -5.01 120.40 121.59 2x26 s VAL 302 Ca 0.48 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 61.47 2x26 s VAL 302 Cb -0.28 -2.56 0.20 0.00 0.00 0.00 0.00 36.38 33.73 2x26 s VAL 302 CO 0.34 0.36 0.69 -0.62 0.00 0.00 0.00 175.10 175.87 2x26 s ASP 303 N -1.50 6.58 0.26 3.32 -1.08 -1.26 -4.92 116.67 118.06 2x26 s ASP 303 Ca 0.17 -2.48 -0.03 0.00 -0.52 0.00 0.00 52.55 49.70 2x26 s ASP 303 Cb -0.11 -2.20 0.39 0.00 -1.46 0.00 0.00 42.92 39.54 2x26 s ASP 303 CO 0.08 -0.63 1.88 0.40 0.52 0.00 0.00 175.17 177.42 2x26 h ILE 304 N 5.07 1.10 0.00 4.11 1.08 -1.95 -1.67 117.51 125.25 2x26 h ILE 304 Ca 0.01 -0.41 -0.03 0.00 -0.39 0.00 0.00 64.86 64.04 2x26 h ILE 304 Cb 1.05 -0.19 -0.00 0.00 -3.07 0.00 0.00 36.82 34.61 2x26 h ILE 304 CO 0.82 0.22 -0.14 0.03 -0.69 0.00 0.00 178.15 178.38 2x26 h ARG 305 N 1.19 0.00 0.00 2.37 3.08 -1.91 0.72 114.38 119.83 2x26 h ARG 305 Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.47 2x26 h ARG 305 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2x26 h ARG 305 CO -0.16 0.14 0.00 1.96 -1.07 0.00 0.00 179.97 180.84 2x26 h GLN 306 N 0.00 0.00 -0.25 0.04 4.20 -1.72 -2.94 115.11 114.44 2x26 h GLN 306 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2x26 h GLN 306 Cb 0.43 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.21 2x26 h GLN 306 CO 0.02 0.00 0.00 0.54 -0.67 0.00 0.00 178.83 178.72 2x26 n ARG 307 N -2.75 2.17 -3.09 1.46 5.12 0.24 -4.93 116.66 114.89 2x26 n ARG 307 Ca -0.01 -1.79 -0.40 0.00 -1.93 0.00 0.00 57.85 53.73 2x26 n ARG 307 Cb 0.17 -1.25 -0.06 0.00 -1.16 0.00 0.00 32.46 30.16 2x26 n ARG 307 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2x26 s ILE 308 N -0.98 5.00 0.35 0.55 1.01 -1.11 -0.73 121.20 125.29 2x26 s ILE 308 Ca 0.20 1.24 -0.28 0.00 0.00 0.00 0.00 60.65 61.81 2x26 s ILE 308 Cb 0.11 -3.97 -0.10 0.00 0.01 0.00 0.00 42.46 38.51 2x26 s ILE 308 CO 0.15 0.09 1.31 0.86 0.00 0.00 0.00 174.94 177.35 2x26 s TRP 309 N 2.01 3.00 -0.56 3.97 -0.00 -0.64 -4.89 118.94 121.83 2x26 s TRP 309 Ca 0.30 1.41 0.02 0.00 -0.00 0.00 0.00 56.10 57.83 2x26 s TRP 309 Cb -0.16 -3.68 0.42 0.00 -0.00 0.00 0.00 33.47 30.05 2x26 s TRP 309 CO 0.10 -1.91 1.61 1.04 -0.00 0.00 0.00 176.95 177.79 2x26 n GLN 310 N 0.66 3.11 -1.62 5.86 6.02 -1.26 -4.72 117.38 125.44 2x26 n GLN 310 Ca 0.01 -3.83 -0.49 0.00 -0.01 0.00 0.00 57.00 52.67 2x26 n GLN 310 Cb 0.42 -2.27 -0.05 0.00 1.02 0.00 0.00 30.24 29.36 2x26 n GLN 310 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2x26 n ASN 328 N -0.69 2.11 0.13 1.08 3.02 -1.26 -5.13 115.26 114.52 2x26 n ASN 328 Ca 0.51 1.11 0.10 0.00 -0.03 0.00 0.00 54.58 56.27 2x26 n ASN 328 Cb 0.65 -1.28 0.04 0.00 -0.61 0.00 0.00 39.78 38.57 2x26 n ASN 328 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2x26 h LEU 329 N 4.73 0.00 -2.63 3.41 3.38 -1.99 -3.48 115.31 118.73 2x26 h LEU 329 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2x26 h LEU 329 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 2x26 h LEU 329 CO 0.80 0.09 -0.01 -1.22 0.09 0.00 0.00 178.44 178.19 2x26 n TYR 330 N -2.85 -1.74 -1.41 1.13 4.02 -1.26 -4.90 117.16 110.14 2x26 n TYR 330 Ca 0.00 0.67 0.00 0.00 -0.01 0.00 0.00 57.90 58.56 2x26 n TYR 330 Cb 0.59 -3.01 0.00 0.00 -0.02 0.00 0.00 39.34 36.89 2x26 n TYR 330 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2x26 n PHE 331 N -1.40 -3.88 -0.47 -0.72 3.72 -1.26 -0.40 117.46 113.06 2x26 n PHE 331 Ca 0.00 2.09 0.00 0.00 -0.05 0.00 0.00 57.45 59.50 2x26 n PHE 331 Cb 0.49 -3.28 0.00 0.00 -0.94 0.00 0.00 39.48 35.74 2x26 n PHE 331 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65