#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ndz s PRO 5 N 0.00 4.32 0.38 -0.78 0.04 -1.26 -4.88 135.00 132.83 1ndz s PRO 5 Ca 0.00 1.94 0.24 0.00 0.04 0.00 0.00 61.00 63.22 1ndz s PRO 5 Cb 0.00 -3.45 1.35 0.00 0.04 0.00 0.00 34.50 32.44 1ndz s PRO 5 CO 0.00 -0.48 1.52 0.00 0.04 0.00 0.00 177.00 178.08 1ndz n ALA 6 N 4.77 1.11 -3.40 8.56 0.00 -1.26 -3.45 120.51 126.84 1ndz n ALA 6 Ca 0.12 0.93 -0.26 0.00 0.00 0.00 0.00 53.44 54.23 1ndz n ALA 6 Cb 0.44 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.79 1ndz n ALA 6 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1ndz s PHE 7 N -5.37 0.61 -0.10 0.00 5.36 -1.26 -4.98 117.98 112.25 1ndz s PHE 7 Ca -0.08 -1.71 -0.03 0.00 -0.96 0.00 0.00 56.93 54.15 1ndz s PHE 7 Cb 0.32 -0.79 -0.12 0.00 -0.34 0.00 0.00 43.02 42.08 1ndz s PHE 7 CO 0.77 -0.87 2.06 -0.25 -1.46 0.00 0.00 175.22 175.47 1ndz n ASP 8 N 3.62 2.85 -4.21 6.13 9.92 -1.22 -4.83 116.55 128.81 1ndz n ASP 8 Ca 0.18 -2.03 -0.12 0.00 -0.53 0.00 0.00 54.79 52.29 1ndz n ASP 8 Cb 0.43 -0.75 -0.10 0.00 -0.64 0.00 0.00 41.12 40.05 1ndz n ASP 8 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1ndz s LYS 9 N 2.19 1.14 0.71 -1.24 -0.14 -1.26 -5.13 119.74 116.01 1ndz s LYS 9 Ca 0.34 -1.58 -0.16 0.00 -1.36 0.00 0.00 55.97 53.20 1ndz s LYS 9 Cb 0.15 0.10 0.02 0.00 -1.68 0.00 0.00 37.83 36.42 1ndz s LYS 9 CO -0.00 -0.30 1.17 -0.35 -0.76 0.00 0.00 175.35 175.10 1ndz n PRO 10 N -0.25 0.68 -4.05 -1.68 -0.04 -1.26 -4.86 135.00 123.54 1ndz n PRO 10 Ca -0.02 0.29 -0.09 0.00 -0.04 0.00 0.00 63.50 63.65 1ndz n PRO 10 Cb 0.65 -2.41 -0.11 0.00 -0.04 0.00 0.00 33.50 31.60 1ndz n PRO 10 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1ndz s LYS 11 N -3.55 0.50 0.07 0.54 1.02 -0.65 -4.94 119.74 112.73 1ndz s LYS 11 Ca 0.77 -0.94 0.10 0.00 0.02 0.00 0.00 55.97 55.92 1ndz s LYS 11 Cb -0.35 0.09 -0.03 0.00 -0.52 0.00 0.00 37.83 37.02 1ndz s LYS 11 CO 0.46 -0.06 -0.26 0.08 -0.92 0.00 0.00 175.35 174.65 1ndz s VAL 12 N -2.68 2.23 -0.07 3.17 1.01 -1.26 -0.44 120.40 122.36 1ndz s VAL 12 Ca -0.03 -1.47 -0.03 0.00 0.00 0.00 0.00 61.98 60.45 1ndz s VAL 12 Cb -0.01 -1.90 0.04 0.00 0.00 0.00 0.00 36.38 34.51 1ndz s VAL 12 CO -0.05 0.29 0.15 -0.70 0.00 0.00 0.00 175.10 174.80 1ndz s GLU 13 N -1.47 0.09 -0.01 2.72 2.12 -0.77 -4.77 118.70 116.61 1ndz s GLU 13 Ca 0.13 0.42 0.17 0.00 0.36 0.00 0.00 54.97 56.05 1ndz s GLU 13 Cb -0.10 -0.19 -0.23 0.00 0.26 0.00 0.00 34.13 33.87 1ndz s GLU 13 CO 0.03 -0.19 0.56 1.28 -0.54 0.00 0.00 175.26 176.40 1ndz n LEU 14 N 4.43 0.41 -3.56 2.70 4.77 -1.26 -0.65 117.00 123.85 1ndz n LEU 14 Ca -0.22 -0.25 -0.28 0.00 -0.03 0.00 0.00 56.01 55.22 1ndz n LEU 14 Cb 0.51 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.49 1ndz n LEU 14 CO 0.15 0.10 -0.26 -2.28 -1.33 0.00 0.00 177.39 173.77 1ndz s HIS 15 N -2.92 1.56 -0.07 -1.77 2.46 -1.26 -4.65 115.29 108.63 1ndz s HIS 15 Ca 0.00 -2.33 -0.06 0.00 0.47 0.00 0.00 55.06 53.15 1ndz s HIS 15 Cb 0.12 -1.40 0.02 0.00 -0.13 0.00 0.00 32.58 31.20 1ndz s HIS 15 CO 0.72 -0.78 0.19 0.54 -2.47 0.00 0.00 174.74 172.94 1ndz s VAL 16 N 0.16 -0.01 -0.20 0.89 0.11 -1.26 -1.60 120.40 118.49 1ndz s VAL 16 Ca 0.25 0.04 -0.11 0.00 -2.93 0.00 0.00 61.98 59.23 1ndz s VAL 16 Cb -0.10 -0.27 -0.05 0.00 -1.53 0.00 0.00 36.38 34.42 1ndz s VAL 16 CO -0.10 0.02 0.16 -1.00 -3.33 0.00 0.00 175.10 170.85 1ndz s HIS 17 N 0.36 3.40 0.22 1.54 3.76 0.87 -1.32 115.29 124.12 1ndz s HIS 17 Ca -0.02 0.36 -0.08 0.00 -0.15 0.00 0.00 55.06 55.17 1ndz s HIS 17 Cb -0.03 -2.21 0.28 0.00 1.11 0.00 0.00 32.58 31.73 1ndz s HIS 17 CO -0.01 0.25 1.81 1.25 -0.85 0.00 0.00 174.74 177.18 1ndz h LEU 18 N 6.80 0.57 0.00 0.89 5.85 -0.91 0.73 115.31 129.24 1ndz h LEU 18 Ca -0.41 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1ndz h LEU 18 Cb 1.15 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.11 1ndz h LEU 18 CO 0.75 0.35 0.00 -0.90 -0.34 0.00 0.00 178.44 178.30 1ndz n ASP 19 N -4.79 0.00 -1.02 1.25 3.85 -1.26 -0.40 116.55 114.19 1ndz n ASP 19 Ca 0.10 0.45 -0.02 0.00 -0.71 0.00 0.00 54.79 54.61 1ndz n ASP 19 Cb 0.20 -0.48 0.20 0.00 -1.35 0.00 0.00 41.12 39.70 1ndz n ASP 19 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1ndz n GLY 20 N 0.58 5.00 2.27 6.12 0.00 0.21 -4.75 105.19 114.61 1ndz n GLY 20 Ca 0.05 -1.27 -0.20 0.00 0.00 0.00 0.00 46.02 44.60 1ndz n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ndz n ALA 21 N -1.12 2.42 -3.26 4.61 0.00 0.47 -2.92 120.51 120.71 1ndz n ALA 21 Ca 0.29 -3.57 -0.23 0.00 0.00 0.00 0.00 53.44 49.93 1ndz n ALA 21 Cb 0.94 -0.89 -0.16 0.00 0.00 0.00 0.00 19.45 19.34 1ndz n ALA 21 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ndz s ILE 22 N -2.39 1.03 0.15 0.00 1.01 -1.26 -4.67 121.20 115.07 1ndz s ILE 22 Ca 0.40 -0.45 -0.26 0.00 0.00 0.00 0.00 60.65 60.33 1ndz s ILE 22 Cb 0.30 -0.93 -0.07 0.00 0.01 0.00 0.00 42.46 41.77 1ndz s ILE 22 CO -0.09 0.32 0.82 -1.59 0.00 0.00 0.00 174.94 174.40 1ndz s LYS 23 N 0.44 4.61 0.27 2.79 -2.85 -1.26 -4.78 119.74 118.97 1ndz s LYS 23 Ca -0.09 1.22 -0.07 0.00 -1.00 0.00 0.00 55.97 56.03 1ndz s LYS 23 Cb -0.13 -3.29 0.49 0.00 -2.06 0.00 0.00 37.83 32.84 1ndz s LYS 23 CO 0.02 0.48 1.58 -1.35 0.10 0.00 0.00 175.35 176.18 1ndz h PRO 24 N 4.66 0.01 0.00 1.78 0.11 -1.98 0.85 132.00 137.43 1ndz h PRO 24 Ca -0.46 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 1ndz h PRO 24 Cb 1.21 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1ndz h PRO 24 CO 0.68 0.01 -0.02 1.05 -0.21 0.00 0.00 178.00 179.50 1ndz h GLU 25 N 0.01 0.00 0.00 1.05 9.09 -1.91 -2.35 114.58 120.47 1ndz h GLU 25 Ca 0.47 0.00 -0.26 0.00 0.05 0.00 0.00 59.36 59.63 1ndz h GLU 25 Cb 0.80 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.86 1ndz h GLU 25 CO -0.92 0.02 -1.50 1.15 0.05 0.00 0.00 179.01 177.82 1ndz h THR 26 N 0.00 1.01 0.79 -1.06 2.02 -1.21 -1.78 112.91 112.68 1ndz h THR 26 Ca -0.00 -2.80 -0.04 0.00 0.77 0.00 0.00 66.41 64.34 1ndz h THR 26 Cb 0.14 2.48 0.01 0.00 -1.74 0.00 0.00 68.15 69.04 1ndz h THR 26 CO 0.00 0.58 -0.38 0.40 0.37 0.00 0.00 175.52 176.49 1ndz h ILE 27 N 0.00 0.07 -0.68 3.11 2.04 -1.37 -0.85 117.51 119.83 1ndz h ILE 27 Ca -0.21 -0.19 0.13 0.00 1.00 0.00 0.00 64.86 65.59 1ndz h ILE 27 Cb 1.91 0.09 -0.13 0.00 -0.74 0.00 0.00 36.82 37.95 1ndz h ILE 27 CO 0.09 0.01 -0.25 0.25 0.00 0.00 0.00 178.15 178.25 1ndz h LEU 28 N -1.24 -0.89 -0.57 1.44 7.12 -1.49 0.24 115.31 119.92 1ndz h LEU 28 Ca -0.11 0.22 0.06 0.00 0.13 0.00 0.00 57.88 58.19 1ndz h LEU 28 Cb 0.82 0.51 -0.09 0.00 -0.53 0.00 0.00 40.66 41.37 1ndz h LEU 28 CO 0.18 -0.27 -0.53 0.22 -0.13 0.00 0.00 178.44 177.91 1ndz h TYR 29 N -0.06 -1.65 -0.06 1.25 5.03 -1.39 -2.06 116.97 118.03 1ndz h TYR 29 Ca 0.30 0.09 -0.22 0.00 2.58 0.00 0.00 58.73 61.49 1ndz h TYR 29 Cb 0.54 0.80 0.00 0.00 1.55 0.00 0.00 36.73 39.62 1ndz h TYR 29 CO -0.61 -0.42 -0.85 1.88 -1.32 0.00 0.00 178.16 176.84 1ndz h TYR 30 N -0.24 0.72 0.09 -3.82 0.05 0.91 -2.58 116.97 112.10 1ndz h TYR 30 Ca 0.10 -0.35 -0.27 0.00 0.05 0.00 0.00 58.73 58.26 1ndz h TYR 30 Cb 0.49 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.13 1ndz h TYR 30 CO -0.83 1.15 -1.26 0.78 -1.05 0.00 0.00 178.16 176.96 1ndz h GLY 31 N 1.04 0.23 -0.60 3.88 0.00 -1.16 -1.17 103.07 105.29 1ndz h GLY 31 Ca -0.06 -0.58 0.07 0.00 0.00 0.00 0.00 47.33 46.76 1ndz h GLY 31 CO 0.15 0.51 -0.30 1.17 0.00 0.00 0.00 176.54 178.07 1ndz n LYS 32 N -3.46 -0.21 0.17 4.80 0.00 -0.78 -0.70 118.16 117.98 1ndz n LYS 32 Ca -0.08 0.92 0.13 0.00 0.00 0.00 0.00 58.31 59.28 1ndz n LYS 32 Cb 1.01 -1.36 0.47 0.00 0.00 0.00 0.00 35.03 35.15 1ndz n LYS 32 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 1ndz h ARG 33 N 0.00 0.00 -0.02 1.64 2.43 -1.13 -2.85 114.38 114.45 1ndz h ARG 33 Ca 0.15 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1ndz h ARG 33 Cb 0.30 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 1ndz h ARG 33 CO -0.58 0.00 -0.14 0.54 -1.51 0.00 0.00 179.97 178.27 1ndz n ARG 34 N -2.54 1.68 -1.44 0.20 1.74 0.04 -4.99 116.66 111.34 1ndz n ARG 34 Ca 0.03 -1.25 -0.15 0.00 -0.77 0.00 0.00 57.85 55.70 1ndz n ARG 34 Cb 0.34 -1.47 -0.07 0.00 -1.02 0.00 0.00 32.46 30.24 1ndz n ARG 34 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ndz n GLY 35 N 1.32 1.46 0.08 -0.13 0.00 0.01 -4.96 105.19 102.97 1ndz n GLY 35 Ca 0.14 -0.02 -0.16 0.00 0.00 0.00 0.00 46.02 45.98 1ndz n GLY 35 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1ndz h ILE 36 N 0.00 1.67 -3.68 -0.61 -0.00 -1.19 -3.48 117.51 110.21 1ndz h ILE 36 Ca -0.31 -2.35 0.00 0.00 -0.00 0.00 0.00 64.86 62.19 1ndz h ILE 36 Cb 1.24 3.25 0.00 0.00 -0.00 0.00 0.00 36.82 41.31 1ndz h ILE 36 CO 0.46 0.59 -0.95 0.00 -0.00 0.00 0.00 178.15 178.26 1ndz n ALA 37 N -2.70 -1.93 -2.21 0.16 0.00 -1.26 -5.03 120.51 107.54 1ndz n ALA 37 Ca -0.13 0.47 -0.07 0.00 0.00 0.00 0.00 53.44 53.71 1ndz n ALA 37 Cb 0.54 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.45 1ndz n ALA 37 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ndz s LEU 38 N -4.96 2.41 0.00 0.00 1.43 -1.26 -4.99 118.68 111.31 1ndz s LEU 38 Ca 0.00 -0.93 0.00 0.00 -1.03 0.00 0.00 54.13 52.17 1ndz s LEU 38 Cb 0.00 0.23 0.00 0.00 0.03 0.00 0.00 46.19 46.45 1ndz s LEU 38 CO 0.00 -0.57 0.81 -0.81 0.23 0.00 0.00 176.35 176.01 1ndz n PRO 39 N 0.26 0.00 -3.04 1.29 -0.04 -1.26 -4.67 135.00 127.54 1ndz n PRO 39 Ca -0.15 0.31 -0.05 0.00 -0.04 0.00 0.00 63.50 63.57 1ndz n PRO 39 Cb 0.60 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.58 1ndz n PRO 39 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ndz n ALA 40 N -1.31 -1.52 -1.54 0.55 0.00 -1.26 -4.96 120.51 110.47 1ndz n ALA 40 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.61 1ndz n ALA 40 Cb 0.00 0.59 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1ndz n ALA 40 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ndz n ASP 41 N -1.26 0.00 -4.84 0.00 9.92 -1.26 -4.92 116.55 114.19 1ndz n ASP 41 Ca -0.04 -1.51 -0.37 0.00 -0.53 0.00 0.00 54.79 52.34 1ndz n ASP 41 Cb 0.42 -0.10 -0.06 0.00 -0.64 0.00 0.00 41.12 40.73 1ndz n ASP 41 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 1ndz s THR 42 N 0.00 5.48 -1.15 -3.53 -1.32 -1.26 -4.97 115.64 108.89 1ndz s THR 42 Ca 0.00 0.21 -0.22 0.00 -1.21 0.00 0.00 61.69 60.47 1ndz s THR 42 Cb 0.00 -3.42 -0.07 0.00 -1.51 0.00 0.00 72.50 67.50 1ndz s THR 42 CO 0.00 0.58 1.91 -0.81 -2.21 0.00 0.00 174.62 174.08 1ndz n PRO 43 N 2.36 1.90 0.04 7.08 -0.04 -1.26 -1.20 135.00 143.88 1ndz n PRO 43 Ca -0.19 -2.52 0.00 0.00 -0.04 0.00 0.00 63.50 60.75 1ndz n PRO 43 Cb 0.54 -3.56 0.00 0.00 -0.04 0.00 0.00 33.50 30.44 1ndz n PRO 43 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ndz n GLU 44 N 8.04 0.00 0.12 0.54 1.02 -1.26 -4.81 120.64 124.29 1ndz n GLU 44 Ca 0.47 0.00 -0.00 0.00 -0.02 0.00 0.00 57.16 57.60 1ndz n GLU 44 Cb 0.45 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.88 1ndz n GLU 44 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1ndz h GLU 45 N 0.00 0.00 -0.02 3.49 4.22 -1.57 -2.93 114.58 117.77 1ndz h GLU 45 Ca 0.00 0.00 0.02 0.00 0.08 0.00 0.00 59.36 59.46 1ndz h GLU 45 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1ndz h GLU 45 CO 0.00 0.65 -0.49 1.25 -2.18 0.00 0.00 179.01 178.25 1ndz h LEU 46 N 0.00 -1.51 -0.52 1.64 6.46 -1.54 -0.27 115.31 119.57 1ndz h LEU 46 Ca -0.01 0.17 0.10 0.00 -0.12 0.00 0.00 57.88 58.02 1ndz h LEU 46 Cb 1.47 0.58 -0.11 0.00 -0.73 0.00 0.00 40.66 41.87 1ndz h LEU 46 CO 0.09 -0.47 -0.31 -0.61 -0.62 0.00 0.00 178.44 176.52 1ndz h GLN 47 N -0.60 -0.17 -0.72 1.25 5.75 -1.76 0.33 115.11 119.18 1ndz h GLN 47 Ca 0.01 0.01 0.14 0.00 -0.15 0.00 0.00 58.65 58.66 1ndz h GLN 47 Cb 0.65 0.04 -0.10 0.00 1.07 0.00 0.00 27.48 29.14 1ndz h GLN 47 CO -0.33 -0.11 0.26 -0.91 -2.65 0.00 0.00 178.83 175.08 1ndz h ASN 48 N -0.18 0.20 -0.17 -0.69 2.35 -1.33 0.47 115.58 116.23 1ndz h ASN 48 Ca 0.22 0.11 -0.17 0.00 -0.55 0.00 0.00 56.30 55.91 1ndz h ASN 48 Cb 0.53 0.11 -0.00 0.00 0.05 0.00 0.00 38.32 39.01 1ndz h ASN 48 CO -0.62 0.07 -0.53 0.40 -1.65 0.00 0.00 177.43 175.10 1ndz h ILE 49 N 0.39 1.29 -0.17 2.81 2.04 0.06 -3.35 117.51 120.59 1ndz h ILE 49 Ca 0.40 -1.73 -0.21 0.00 1.00 0.00 0.00 64.86 64.32 1ndz h ILE 49 Cb 0.61 1.65 0.01 0.00 -0.74 0.00 0.00 36.82 38.35 1ndz h ILE 49 CO -0.42 0.56 -0.72 0.16 0.00 0.00 0.00 178.15 177.73 1ndz h ILE 50 N 0.59 1.29 -4.04 -0.67 3.07 -0.22 -3.44 117.51 114.09 1ndz h ILE 50 Ca 0.02 -1.95 -0.54 0.00 1.55 0.00 0.00 64.86 63.94 1ndz h ILE 50 Cb 1.11 1.93 0.11 0.00 -0.27 0.00 0.00 36.82 39.70 1ndz h ILE 50 CO 0.11 0.62 0.56 -0.83 -1.05 0.00 0.00 178.15 177.56 1ndz s GLY 51 N -4.12 2.85 0.08 0.16 0.00 0.16 -4.66 107.32 101.78 1ndz s GLY 51 Ca -0.10 1.20 0.04 0.00 0.00 0.00 0.00 44.72 45.86 1ndz s GLY 51 CO 0.89 1.69 0.01 1.06 0.00 0.00 0.00 173.10 176.75 1ndz s MET 52 N -2.87 2.62 0.00 2.90 -1.94 0.29 -4.87 119.30 115.42 1ndz s MET 52 Ca 0.70 -0.79 0.05 0.00 -1.71 0.00 0.00 55.69 53.94 1ndz s MET 52 Cb -0.36 -2.58 0.10 0.00 2.01 0.00 0.00 34.83 34.00 1ndz s MET 52 CO 0.43 0.56 0.90 -0.40 -0.01 0.00 0.00 175.02 176.50 1ndz n ASP 53 N 0.68 1.97 -3.69 3.03 5.68 -1.26 -4.65 116.55 118.30 1ndz n ASP 53 Ca -0.11 -1.62 -0.13 0.00 -0.50 0.00 0.00 54.79 52.43 1ndz n ASP 53 Cb 0.52 -0.06 -0.09 0.00 -1.14 0.00 0.00 41.12 40.35 1ndz n ASP 53 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1ndz s LYS 54 N -0.73 0.60 0.40 0.11 2.20 -1.26 -5.08 119.74 115.98 1ndz s LYS 54 Ca 0.09 0.75 -0.24 0.00 -0.36 0.00 0.00 55.97 56.21 1ndz s LYS 54 Cb 0.05 0.28 -0.12 0.00 -1.51 0.00 0.00 37.83 36.53 1ndz s LYS 54 CO 0.07 -0.08 0.75 -2.30 -0.36 0.00 0.00 175.35 173.43 1ndz n PRO 55 N 2.93 0.87 -4.27 4.03 -0.02 -1.26 -4.95 135.00 132.33 1ndz n PRO 55 Ca -0.14 0.31 -0.20 0.00 -2.02 0.00 0.00 63.50 61.45 1ndz n PRO 55 Cb 0.56 -1.69 -0.08 0.00 -0.02 0.00 0.00 33.50 32.27 1ndz n PRO 55 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 1ndz n LEU 56 N 1.03 0.00 -4.78 2.45 -0.00 -1.26 -5.04 117.00 109.40 1ndz n LEU 56 Ca 0.11 -3.20 -0.30 0.00 -0.00 0.00 0.00 56.01 52.62 1ndz n LEU 56 Cb 0.38 1.64 0.10 0.00 -0.00 0.00 0.00 43.42 45.54 1ndz n LEU 56 CO 0.56 -0.53 0.70 0.28 -0.00 0.00 0.00 177.39 178.40 1ndz s THR 57 N -3.35 3.07 0.19 1.47 -1.32 -1.26 -4.85 115.64 109.60 1ndz s THR 57 Ca 0.39 0.35 -0.12 0.00 -1.21 0.00 0.00 61.69 61.10 1ndz s THR 57 Cb 0.02 -3.00 0.12 0.00 -1.51 0.00 0.00 72.50 68.13 1ndz s THR 57 CO 0.27 -0.46 1.73 -0.07 -2.21 0.00 0.00 174.62 173.89 1ndz h LEU 58 N -1.18 0.09 -0.81 9.08 4.07 -1.99 -0.54 115.31 124.04 1ndz h LEU 58 Ca -0.47 0.08 0.17 0.00 0.08 0.00 0.00 57.88 57.75 1ndz h LEU 58 Cb 1.26 0.09 -0.11 0.00 1.08 0.00 0.00 40.66 42.99 1ndz h LEU 58 CO 0.57 0.07 0.31 -0.65 -1.08 0.00 0.00 178.44 177.66 1ndz h PRO 59 N 0.30 0.38 -0.30 1.13 0.11 -2.00 0.21 132.00 131.83 1ndz h PRO 59 Ca 0.27 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.20 1ndz h PRO 59 Cb 0.34 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 1ndz h PRO 59 CO -0.31 0.25 -0.43 -0.44 -0.21 0.00 0.00 178.00 176.86 1ndz h ASP 60 N 0.39 0.82 -0.02 -2.05 3.45 -1.82 -2.73 116.42 114.47 1ndz h ASP 60 Ca 0.47 -0.39 0.03 0.00 0.43 0.00 0.00 57.03 57.58 1ndz h ASP 60 Cb 0.80 -0.23 -0.06 0.00 -0.56 0.00 0.00 39.33 39.29 1ndz h ASP 60 CO -0.48 1.13 -0.38 0.15 -1.57 0.00 0.00 179.24 178.09 1ndz h PHE 61 N 0.62 -1.07 0.00 4.55 3.57 -0.29 -2.85 116.94 121.46 1ndz h PHE 61 Ca 0.04 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 1ndz h PHE 61 Cb 0.99 0.47 -0.00 0.00 2.79 0.00 0.00 35.95 40.20 1ndz h PHE 61 CO 0.05 -0.46 -0.03 -0.07 -2.23 0.00 0.00 178.31 175.57 1ndz h LEU 62 N -0.53 0.00 -0.07 0.59 3.38 -0.42 -2.97 115.31 115.29 1ndz h LEU 62 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1ndz h LEU 62 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1ndz h LEU 62 CO -0.31 0.03 0.00 0.00 0.09 0.00 0.00 178.44 178.25 1ndz h ALA 63 N 1.97 1.00 -0.03 1.53 0.00 -1.25 -1.30 119.26 121.18 1ndz h ALA 63 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1ndz h ALA 63 Cb 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1ndz h ALA 63 CO 0.00 0.00 -0.66 1.57 0.00 0.00 0.00 179.25 180.16 1ndz h LYS 64 N 0.00 0.14 -0.69 0.00 -0.00 -1.49 0.49 116.57 115.02 1ndz h LYS 64 Ca 0.00 -0.11 0.13 0.00 -0.00 0.00 0.00 60.65 60.67 1ndz h LYS 64 Cb 0.88 0.02 -0.04 0.00 -0.00 0.00 0.00 32.23 33.09 1ndz h LYS 64 CO 0.00 0.75 0.47 0.74 -0.00 0.00 0.00 179.45 181.40 1ndz h PHE 65 N 0.10 0.44 -0.46 0.07 -1.00 -1.38 -2.60 116.94 112.11 1ndz h PHE 65 Ca -0.01 0.01 -0.10 0.00 2.81 0.00 0.00 57.97 60.68 1ndz h PHE 65 Cb 1.18 -0.14 -0.02 0.00 3.61 0.00 0.00 35.95 40.58 1ndz h PHE 65 CO 0.01 0.18 -0.13 -0.44 -1.61 0.00 0.00 178.31 176.32 1ndz h ASP 66 N 0.39 0.85 -0.29 2.17 3.32 -0.30 -0.32 116.42 122.23 1ndz h ASP 66 Ca 0.33 -0.27 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1ndz h ASP 66 Cb 0.77 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 1ndz h ASP 66 CO -0.10 0.99 0.19 1.88 -1.72 0.00 0.00 179.24 180.48 1ndz h TYR 67 N 0.76 0.37 0.01 4.55 0.99 0.07 -3.39 116.97 120.32 1ndz h TYR 67 Ca 0.12 0.01 -0.35 0.00 2.00 0.00 0.00 58.73 60.50 1ndz h TYR 67 Cb 0.65 -0.12 -0.06 0.00 1.00 0.00 0.00 36.73 38.19 1ndz h TYR 67 CO 0.04 0.25 -2.20 2.48 -0.00 0.00 0.00 178.16 178.73 1ndz n TYR 68 N -4.87 0.34 -0.35 4.88 0.18 -1.00 -4.22 117.16 112.12 1ndz n TYR 68 Ca -0.02 0.11 0.23 0.00 1.88 0.00 0.00 57.90 60.10 1ndz n TYR 68 Cb 0.03 -1.06 0.47 0.00 -0.38 0.00 0.00 39.34 38.40 1ndz n TYR 68 CO 0.00 0.00 0.00 0.52 -2.08 0.00 0.00 176.86 175.30 1ndz h MET 69 N 0.00 0.39 0.00 -3.48 2.86 -1.27 -1.14 114.93 112.30 1ndz h MET 69 Ca -0.48 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.12 1ndz h MET 69 Cb 2.13 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 33.70 1ndz h MET 69 CO 0.03 0.26 -0.09 -1.35 1.06 0.00 0.00 176.91 176.82 1ndz h PRO 70 N 0.40 0.00 -0.57 -0.22 0.11 -1.75 0.26 132.00 130.24 1ndz h PRO 70 Ca 0.69 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.79 1ndz h PRO 70 Cb 1.57 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.65 1ndz h PRO 70 CO -0.49 0.09 0.32 0.00 -0.21 0.00 0.00 178.00 177.70 1ndz h ALA 71 N 1.91 1.49 0.00 -0.75 0.00 -1.45 -3.37 119.26 117.10 1ndz h ALA 71 Ca -0.00 -0.08 -0.40 0.00 0.00 0.00 0.00 54.91 54.42 1ndz h ALA 71 Cb 0.43 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 1ndz h ALA 71 CO 0.01 0.43 -2.45 -0.89 0.00 0.00 0.00 179.25 176.35 1ndz n ILE 72 N -4.40 1.44 -1.71 0.00 2.08 -0.83 -4.43 119.36 111.51 1ndz n ILE 72 Ca 0.05 -0.48 -0.41 0.00 0.56 0.00 0.00 62.75 62.47 1ndz n ILE 72 Cb 0.09 -1.58 0.01 0.00 -0.75 0.00 0.00 39.64 37.41 1ndz n ILE 72 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ndz n ALA 73 N -3.62 1.44 0.00 -1.39 0.00 0.02 -1.17 120.51 115.79 1ndz n ALA 73 Ca -0.48 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1ndz n ALA 73 Cb 0.93 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 18.09 1ndz n ALA 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ndz n GLY 74 N 0.75 2.95 3.27 0.00 0.00 -0.84 -4.89 105.19 106.44 1ndz n GLY 74 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 1ndz n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ndz h ARG 76 N 8.28 0.04 -0.43 0.00 3.08 -1.95 -0.95 114.38 122.45 1ndz h ARG 76 Ca -0.23 -0.00 0.03 0.00 0.07 0.00 0.00 59.98 59.85 1ndz h ARG 76 Cb 1.08 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 31.09 1ndz h ARG 76 CO 0.65 0.02 0.23 0.22 -1.07 0.00 0.00 179.97 180.03 1ndz h ASP 77 N 0.04 0.36 0.02 7.04 -0.00 -1.93 0.19 116.42 122.13 1ndz h ASP 77 Ca 0.53 0.01 -0.06 0.00 -0.00 0.00 0.00 57.03 57.52 1ndz h ASP 77 Cb 1.03 -0.06 -0.01 0.00 -0.00 0.00 0.00 39.33 40.29 1ndz h ASP 77 CO -0.86 0.26 -0.15 0.00 -0.00 0.00 0.00 179.24 178.48 1ndz h ALA 78 N 1.21 1.43 0.34 -0.78 0.00 -1.51 -0.30 119.26 119.64 1ndz h ALA 78 Ca 0.18 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1ndz h ALA 78 Cb 0.05 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ndz h ALA 78 CO -0.11 0.40 -0.16 0.82 0.00 0.00 0.00 179.25 180.20 1ndz h ILE 79 N 0.26 0.64 -0.27 0.00 2.04 0.30 -1.97 117.51 118.50 1ndz h ILE 79 Ca 0.05 -0.54 0.04 0.00 1.00 0.00 0.00 64.86 65.40 1ndz h ILE 79 Cb 0.43 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 1ndz h ILE 79 CO 0.03 0.10 0.06 0.50 0.00 0.00 0.00 178.15 178.84 1ndz h LYS 80 N -0.78 0.17 -0.91 2.37 3.64 -1.17 -1.93 116.57 117.96 1ndz h LYS 80 Ca -0.05 -0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.46 1ndz h LYS 80 Cb 0.51 -0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.22 1ndz h LYS 80 CO 0.08 0.11 0.58 -0.09 -2.27 0.00 0.00 179.45 177.86 1ndz h ARG 81 N 0.17 0.72 0.00 1.90 2.43 -1.08 -0.65 114.38 117.87 1ndz h ARG 81 Ca 0.13 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 1ndz h ARG 81 Cb 0.12 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 1ndz h ARG 81 CO -0.16 0.48 -0.23 -0.84 -1.51 0.00 0.00 179.97 177.72 1ndz h ILE 82 N 0.75 0.76 0.04 1.20 3.07 -0.55 -1.80 117.51 120.99 1ndz h ILE 82 Ca 0.46 -0.92 -0.06 0.00 1.55 0.00 0.00 64.86 65.89 1ndz h ILE 82 Cb 0.68 1.57 0.01 0.00 -0.27 0.00 0.00 36.82 38.80 1ndz h ILE 82 CO -0.22 0.22 -0.24 0.00 -1.05 0.00 0.00 178.15 176.86 1ndz h ALA 83 N 1.77 -0.02 -0.49 0.16 0.00 -0.93 0.96 119.26 120.71 1ndz h ALA 83 Ca -0.00 -0.55 0.04 0.00 0.00 0.00 0.00 54.91 54.40 1ndz h ALA 83 Cb 0.55 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 1ndz h ALA 83 CO 0.03 0.11 -0.29 0.98 0.00 0.00 0.00 179.25 180.07 1ndz n TYR 84 N -4.47 -0.22 1.00 0.00 9.36 -0.54 -2.75 117.16 119.54 1ndz n TYR 84 Ca -0.11 0.62 0.13 0.00 3.32 0.00 0.00 57.90 61.86 1ndz n TYR 84 Cb 0.57 -0.52 0.49 0.00 -0.63 0.00 0.00 39.34 39.25 1ndz n TYR 84 CO 0.00 0.00 0.00 -0.85 0.22 0.00 0.00 176.86 176.23 1ndz n GLU 85 N -4.46 0.00 -0.05 2.98 0.28 -0.68 -2.62 120.64 116.09 1ndz n GLU 85 Ca 0.01 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 56.92 1ndz n GLU 85 Cb 0.13 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 31.47 1ndz n GLU 85 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 1ndz h PHE 86 N 0.00 -0.84 -0.66 -1.84 3.04 -0.69 -2.02 116.94 113.94 1ndz h PHE 86 Ca 0.00 0.05 0.07 0.00 3.98 0.00 0.00 57.97 62.07 1ndz h PHE 86 Cb 0.50 0.41 -0.06 0.00 2.56 0.00 0.00 35.95 39.36 1ndz h PHE 86 CO 0.00 -0.38 0.34 0.28 -2.02 0.00 0.00 178.31 176.53 1ndz h VAL 87 N -0.31 0.90 -0.83 1.41 2.07 -1.31 -1.60 116.25 116.58 1ndz h VAL 87 Ca 0.13 -0.21 0.16 0.00 0.82 0.00 0.00 66.70 67.61 1ndz h VAL 87 Cb 0.53 0.25 -0.16 0.00 -1.52 0.00 0.00 31.29 30.39 1ndz h VAL 87 CO -0.43 0.11 -0.24 -0.08 0.02 0.00 0.00 177.57 176.96 1ndz h GLU 88 N 0.60 -0.01 -0.59 1.57 4.81 -1.46 0.13 114.58 119.62 1ndz h GLU 88 Ca 0.31 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.63 1ndz h GLU 88 Cb 0.26 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.61 1ndz h GLU 88 CO -0.22 -0.01 0.40 0.52 -0.73 0.00 0.00 179.01 178.96 1ndz h MET 89 N -0.02 0.44 0.05 1.92 2.86 -0.54 -1.52 114.93 118.12 1ndz h MET 89 Ca 0.38 -0.03 -0.23 0.00 -2.06 0.00 0.00 59.70 57.76 1ndz h MET 89 Cb 0.61 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.17 1ndz h MET 89 CO -0.86 0.29 -1.04 0.87 1.06 0.00 0.00 176.91 177.23 1ndz h LYS 90 N 0.45 0.26 -0.95 1.72 1.79 -0.34 -1.89 116.57 117.61 1ndz h LYS 90 Ca 0.27 -0.35 0.16 0.00 -2.18 0.00 0.00 60.65 58.55 1ndz h LYS 90 Cb 0.47 0.12 -0.08 0.00 -1.58 0.00 0.00 32.23 31.15 1ndz h LYS 90 CO -0.08 1.10 0.60 0.00 -1.08 0.00 0.00 179.45 179.99 1ndz h ALA 91 N 0.77 1.77 0.00 3.86 0.00 -0.44 -0.47 119.26 124.76 1ndz h ALA 91 Ca -0.08 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ndz h ALA 91 Cb 1.72 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1ndz h ALA 91 CO 0.17 -0.06 -0.00 0.87 0.00 0.00 0.00 179.25 180.22 1ndz h LYS 92 N 0.74 0.00 0.00 0.00 1.57 -0.54 -0.88 116.57 117.46 1ndz h LYS 92 Ca 0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 1ndz h LYS 92 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 1ndz h LYS 92 CO -0.26 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.37 1ndz n ASP 93 N -2.67 0.00 -1.35 0.86 10.43 -0.23 -4.92 116.55 118.67 1ndz n ASP 93 Ca 0.05 -0.83 -0.14 0.00 2.57 0.00 0.00 54.79 56.43 1ndz n ASP 93 Cb 0.48 0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.41 1ndz n ASP 93 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1ndz n GLY 94 N 0.52 0.58 3.70 0.44 0.00 -0.34 -4.87 105.19 105.23 1ndz n GLY 94 Ca 0.17 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 1ndz n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ndz s VAL 95 N -2.61 4.92 -1.52 1.61 1.01 -0.91 -1.63 120.40 121.26 1ndz s VAL 95 Ca 0.00 1.82 0.21 0.00 0.00 0.00 0.00 61.98 64.02 1ndz s VAL 95 Cb 0.00 -4.21 -0.11 0.00 0.00 0.00 0.00 36.38 32.05 1ndz s VAL 95 CO 0.00 0.15 0.98 1.33 0.00 0.00 0.00 175.10 177.57 1ndz n VAL 96 N 4.03 0.00 -3.67 2.92 0.24 0.42 -4.65 118.33 117.62 1ndz n VAL 96 Ca 0.04 -0.14 -0.09 0.00 -2.04 0.00 0.00 64.34 62.11 1ndz n VAL 96 Cb 0.51 1.13 -0.09 0.00 -1.47 0.00 0.00 33.84 33.92 1ndz n VAL 96 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1ndz s TYR 97 N -2.70 -0.79 0.00 6.34 5.04 -1.23 -0.72 117.35 123.29 1ndz s TYR 97 Ca 0.13 1.63 0.01 0.00 -2.44 0.00 0.00 57.07 56.39 1ndz s TYR 97 Cb 0.17 0.41 -0.00 0.00 0.35 0.00 0.00 41.96 42.89 1ndz s TYR 97 CO 0.70 -0.42 -0.02 0.54 -1.34 0.00 0.00 175.55 175.02 1ndz s VAL 98 N 1.51 0.14 -0.21 3.14 0.11 -0.64 -1.84 120.40 122.61 1ndz s VAL 98 Ca -0.10 -0.13 -0.06 0.00 -2.93 0.00 0.00 61.98 58.77 1ndz s VAL 98 Cb -0.07 -0.13 -0.03 0.00 -1.53 0.00 0.00 36.38 34.62 1ndz s VAL 98 CO -0.16 0.01 0.02 -1.61 -3.33 0.00 0.00 175.10 170.03 1ndz s GLU 99 N -0.13 3.67 0.02 1.54 2.02 0.18 -1.66 118.70 124.34 1ndz s GLU 99 Ca -0.00 -0.49 0.06 0.00 0.02 0.00 0.00 54.97 54.55 1ndz s GLU 99 Cb -0.01 -3.14 -0.03 0.00 0.10 0.00 0.00 34.13 31.04 1ndz s GLU 99 CO -0.00 0.01 -0.14 0.54 0.02 0.00 0.00 175.26 175.69 1ndz s VAL 100 N 1.03 3.10 0.10 2.63 0.11 -0.06 -4.16 120.40 123.15 1ndz s VAL 100 Ca 0.03 -1.01 0.02 0.00 -2.93 0.00 0.00 61.98 58.08 1ndz s VAL 100 Cb -0.14 -2.31 -0.04 0.00 -1.53 0.00 0.00 36.38 32.35 1ndz s VAL 100 CO 0.02 0.38 -0.07 0.00 -3.33 0.00 0.00 175.10 172.10 1ndz s ARG 101 N -1.37 0.82 -0.18 1.54 1.70 -0.43 -0.65 118.95 120.38 1ndz s ARG 101 Ca 0.15 -1.31 -0.34 0.00 -0.47 0.00 0.00 55.73 53.76 1ndz s ARG 101 Cb -0.11 -0.21 0.14 0.00 -0.57 0.00 0.00 34.95 34.21 1ndz s ARG 101 CO 0.06 -0.02 1.18 1.52 -1.08 0.00 0.00 175.30 176.96 1ndz s TYR 102 N -3.54 -0.16 -0.21 5.89 -0.85 -0.94 -0.20 117.35 117.35 1ndz s TYR 102 Ca 0.11 0.13 -0.16 0.00 -0.52 0.00 0.00 57.07 56.63 1ndz s TYR 102 Cb 0.05 0.51 -0.04 0.00 0.38 0.00 0.00 41.96 42.86 1ndz s TYR 102 CO -0.05 -0.23 0.40 0.45 -1.52 0.00 0.00 175.55 174.61 1ndz s SER 103 N -2.01 6.43 0.18 -0.18 0.15 -1.26 -1.50 113.70 115.51 1ndz s SER 103 Ca 0.08 0.51 -0.07 0.00 0.70 0.00 0.00 55.95 57.17 1ndz s SER 103 Cb -0.01 -2.23 0.08 0.00 -1.71 0.00 0.00 66.02 62.15 1ndz s SER 103 CO -0.05 -0.09 1.57 1.55 1.20 0.00 0.00 173.24 177.42 1ndz h PRO 104 N 7.42 0.87 -0.91 5.44 0.13 -1.91 -2.42 132.00 140.62 1ndz h PRO 104 Ca -0.36 -0.39 0.23 0.00 -0.87 0.00 0.00 66.00 64.62 1ndz h PRO 104 Cb 1.16 -0.02 -0.06 0.00 0.13 0.00 0.00 31.00 32.21 1ndz h PRO 104 CO 0.71 1.03 0.62 0.45 -0.23 0.00 0.00 178.00 180.59 1ndz h HIS 105 N 0.75 0.33 0.00 1.56 3.86 -1.91 -2.31 115.15 117.43 1ndz h HIS 105 Ca 0.09 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 1ndz h HIS 105 Cb 0.82 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.19 1ndz h HIS 105 CO 0.05 0.07 0.00 1.28 0.86 0.00 0.00 177.93 180.19 1ndz n LEU 106 N -4.42 0.00 0.00 2.43 4.77 -0.91 -1.16 117.00 117.70 1ndz n LEU 106 Ca 0.19 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 1ndz n LEU 106 Cb 0.82 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.91 1ndz n LEU 106 CO 0.33 0.00 0.33 0.18 -1.33 0.00 0.00 177.39 176.90 1ndz n LEU 107 N -0.94 1.19 -4.98 2.23 4.32 -0.89 -4.83 117.00 113.10 1ndz n LEU 107 Ca 0.16 -1.19 -0.20 0.00 -0.02 0.00 0.00 56.01 54.76 1ndz n LEU 107 Cb 0.08 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 41.89 1ndz n LEU 107 CO 0.12 0.30 0.20 0.00 -1.22 0.00 0.00 177.39 176.79 1ndz s ALA 108 N -0.41 4.11 0.00 -1.18 0.00 -0.31 -1.99 121.76 121.98 1ndz s ALA 108 Ca 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 50.58 1ndz s ALA 108 Cb 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 23.12 21.25 1ndz s ALA 108 CO 0.00 -0.33 0.17 0.27 0.00 0.00 0.00 175.76 175.87 1ndz n ASN 109 N -1.95 0.24 -3.69 0.00 6.94 0.32 -4.55 115.26 112.57 1ndz n ASN 109 Ca 0.04 -1.03 -0.15 0.00 -0.02 0.00 0.00 54.58 53.43 1ndz n ASN 109 Cb 0.59 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 37.93 1ndz n ASN 109 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1ndz s SER 110 N -0.03 -0.33 -1.61 0.53 0.15 0.25 -0.98 113.70 111.69 1ndz s SER 110 Ca 0.00 0.28 -0.13 0.00 0.70 0.00 0.00 55.95 56.80 1ndz s SER 110 Cb 0.00 0.38 0.11 0.00 -1.71 0.00 0.00 66.02 64.80 1ndz s SER 110 CO 0.00 -0.49 0.69 0.29 1.20 0.00 0.00 173.24 174.93 1ndz n LYS 111 N 1.18 -3.33 -3.67 5.44 5.02 -1.26 -3.97 118.16 117.57 1ndz n LYS 111 Ca -0.21 0.39 -0.15 0.00 -2.02 0.00 0.00 58.31 56.32 1ndz n LYS 111 Cb 0.56 -4.95 -0.14 0.00 -0.02 0.00 0.00 35.03 30.48 1ndz n LYS 111 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1ndz s VAL 112 N -3.49 -0.34 0.03 -0.18 0.11 -1.26 -4.70 120.40 110.57 1ndz s VAL 112 Ca 0.53 0.32 0.09 0.00 -2.93 0.00 0.00 61.98 59.98 1ndz s VAL 112 Cb -0.29 -0.37 -0.03 0.00 -1.53 0.00 0.00 36.38 34.16 1ndz s VAL 112 CO 0.91 0.13 -0.25 -0.70 -3.33 0.00 0.00 175.10 171.87 1ndz s GLU 113 N 2.35 1.92 0.68 1.54 -6.30 -1.26 -2.75 118.70 114.89 1ndz s GLU 113 Ca 0.02 -1.05 -0.16 0.00 -2.50 0.00 0.00 54.97 51.29 1ndz s GLU 113 Cb -0.12 -2.04 0.01 0.00 0.00 0.00 0.00 34.13 31.99 1ndz s GLU 113 CO -0.07 0.53 1.17 -1.25 0.02 0.00 0.00 175.26 175.65 1ndz s PRO 114 N -1.15 2.50 0.03 4.30 0.04 -1.26 -5.00 135.00 134.46 1ndz s PRO 114 Ca 0.12 1.63 -0.30 0.00 0.04 0.00 0.00 61.00 62.48 1ndz s PRO 114 Cb -0.10 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.48 1ndz s PRO 114 CO 0.02 -1.53 1.53 0.42 0.04 0.00 0.00 177.00 177.48 1ndz s ILE 115 N -2.07 3.37 0.45 0.56 1.01 -1.11 -4.97 121.20 118.45 1ndz s ILE 115 Ca 0.72 0.78 -0.25 0.00 0.00 0.00 0.00 60.65 61.91 1ndz s ILE 115 Cb -0.26 -3.50 -0.08 0.00 0.01 0.00 0.00 42.46 38.63 1ndz s ILE 115 CO 0.42 -0.00 1.36 -2.16 0.00 0.00 0.00 174.94 174.56 1ndz s PRO 116 N 2.54 3.68 -1.00 2.79 0.04 -1.26 -4.01 135.00 137.79 1ndz s PRO 116 Ca 0.69 2.27 0.00 0.00 0.04 0.00 0.00 61.00 64.00 1ndz s PRO 116 Cb -0.36 -2.60 0.00 0.00 0.04 0.00 0.00 34.50 31.58 1ndz s PRO 116 CO 0.29 -0.77 0.00 0.91 0.04 0.00 0.00 177.00 177.47 1ndz n TRP 117 N -0.26 -0.52 -1.21 0.56 7.02 -1.26 -2.13 117.44 119.65 1ndz n TRP 117 Ca 0.06 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.43 1ndz n TRP 117 Cb 0.43 -2.62 -0.04 0.00 -2.42 0.00 0.00 31.31 26.66 1ndz n TRP 117 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1ndz n ASN 118 N -0.19 -3.96 -4.76 -0.99 4.13 -1.26 -4.84 115.26 103.40 1ndz n ASN 118 Ca -0.14 0.25 -0.39 0.00 1.68 0.00 0.00 54.58 55.99 1ndz n ASN 118 Cb 0.59 -3.26 0.02 0.00 -1.54 0.00 0.00 39.78 35.59 1ndz n ASN 118 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1ndz s GLN 119 N -2.68 3.47 0.65 3.52 -0.21 -0.91 -5.02 119.66 118.48 1ndz s GLN 119 Ca 0.00 2.30 -0.11 0.00 0.02 0.00 0.00 55.36 57.57 1ndz s GLN 119 Cb 0.00 -2.48 -0.02 0.00 1.00 0.00 0.00 33.01 31.50 1ndz s GLN 119 CO 0.00 -0.94 1.04 0.00 -2.12 0.00 0.00 175.29 173.27 1ndz s ALA 120 N -1.26 2.97 0.30 6.09 0.00 -1.26 -4.86 121.76 123.74 1ndz s ALA 120 Ca 0.65 -0.06 -0.30 0.00 0.00 0.00 0.00 51.96 52.25 1ndz s ALA 120 Cb -0.41 -3.10 -0.12 0.00 0.00 0.00 0.00 23.12 19.49 1ndz s ALA 120 CO 0.51 -0.87 1.59 -1.91 0.00 0.00 0.00 175.76 175.08 1ndz n GLU 121 N -2.87 2.71 0.00 0.00 2.13 -1.26 -4.94 120.64 116.40 1ndz n GLU 121 Ca 0.06 0.96 0.00 0.00 0.66 0.00 0.00 57.16 58.85 1ndz n GLU 121 Cb 0.54 -2.74 0.00 0.00 0.27 0.00 0.00 31.44 29.51 1ndz n GLU 121 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ndz n GLY 122 N 1.95 5.26 0.94 8.31 0.00 -0.15 -5.03 105.19 116.47 1ndz n GLY 122 Ca 0.08 -1.52 0.05 0.00 0.00 0.00 0.00 46.02 44.62 1ndz n GLY 122 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ndz n ASP 123 N 0.00 1.21 -4.47 1.61 5.75 -1.26 -4.55 116.55 114.84 1ndz n ASP 123 Ca 0.00 -2.69 -0.43 0.00 -0.01 0.00 0.00 54.79 51.65 1ndz n ASP 123 Cb 0.00 -0.37 -0.07 0.00 -1.03 0.00 0.00 41.12 39.65 1ndz n ASP 123 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1ndz s LEU 124 N -1.28 4.86 0.35 -2.12 1.98 -1.26 -4.90 118.68 116.30 1ndz s LEU 124 Ca 0.30 -0.76 -0.11 0.00 -2.89 0.00 0.00 54.13 50.67 1ndz s LEU 124 Cb 0.32 -2.50 -0.07 0.00 0.66 0.00 0.00 46.19 44.60 1ndz s LEU 124 CO -0.10 -0.83 0.71 0.42 -1.89 0.00 0.00 176.35 174.66 1ndz s THR 125 N 2.60 4.81 0.26 3.68 -4.23 -1.26 0.12 115.64 121.63 1ndz s THR 125 Ca 0.16 0.59 -0.02 0.00 -1.18 0.00 0.00 61.69 61.24 1ndz s THR 125 Cb -0.18 -3.69 0.27 0.00 1.34 0.00 0.00 72.50 70.24 1ndz s THR 125 CO 0.14 -0.37 1.66 -0.65 -0.54 0.00 0.00 174.62 174.86 1ndz h PRO 126 N 1.68 0.22 -0.84 3.99 0.11 -1.80 0.26 132.00 135.61 1ndz h PRO 126 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1ndz h PRO 126 Cb 1.18 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 1ndz h PRO 126 CO 0.65 0.15 0.54 0.22 -0.21 0.00 0.00 178.00 179.35 1ndz h ASP 127 N 0.23 0.98 -0.39 -2.05 1.82 -1.94 -1.81 116.42 113.26 1ndz h ASP 127 Ca 0.47 -0.04 -0.06 0.00 -0.39 0.00 0.00 57.03 57.02 1ndz h ASP 127 Cb 0.87 -0.25 -0.02 0.00 0.68 0.00 0.00 39.33 40.61 1ndz h ASP 127 CO -0.59 0.72 0.05 -0.33 -1.61 0.00 0.00 179.24 177.49 1ndz h GLU 128 N 1.14 0.73 -0.84 0.28 5.08 -1.73 -1.17 114.58 118.07 1ndz h GLU 128 Ca 0.31 -0.17 0.22 0.00 -1.00 0.00 0.00 59.36 58.72 1ndz h GLU 128 Cb -0.11 -0.10 -0.14 0.00 0.50 0.00 0.00 28.75 28.90 1ndz h GLU 128 CO -0.06 0.71 0.18 0.28 -1.00 0.00 0.00 179.01 179.11 1ndz h VAL 129 N 0.70 0.33 -0.44 3.13 2.07 0.30 -2.11 116.25 120.22 1ndz h VAL 129 Ca 0.15 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.56 1ndz h VAL 129 Cb 0.35 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 1ndz h VAL 129 CO 0.01 0.03 0.11 0.58 0.02 0.00 0.00 177.57 178.32 1ndz h VAL 130 N 0.19 1.23 -0.21 2.57 2.07 -0.64 0.44 116.25 121.90 1ndz h VAL 130 Ca 0.51 -0.82 0.05 0.00 0.82 0.00 0.00 66.70 67.27 1ndz h VAL 130 Cb 1.00 0.92 -0.07 0.00 -1.52 0.00 0.00 31.29 31.61 1ndz h VAL 130 CO -0.65 0.29 -0.40 -1.28 0.02 0.00 0.00 177.57 175.55 1ndz h SER 131 N 0.58 -1.26 -0.76 0.57 0.87 -1.12 0.34 113.55 112.77 1ndz h SER 131 Ca 0.14 0.18 -0.06 0.00 -1.23 0.00 0.00 61.79 60.82 1ndz h SER 131 Cb 0.32 0.53 -0.03 0.00 -0.44 0.00 0.00 62.40 62.78 1ndz h SER 131 CO 0.00 -0.39 0.26 -0.07 -0.53 0.00 0.00 176.83 176.10 1ndz h LEU 132 N -0.42 1.09 -0.69 2.23 3.38 -0.89 -1.28 115.31 118.72 1ndz h LEU 132 Ca 0.10 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 57.93 1ndz h LEU 132 Cb 0.60 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 1ndz h LEU 132 CO -0.44 0.99 0.40 0.58 0.09 0.00 0.00 178.44 180.06 1ndz h VAL 133 N 1.12 0.99 0.45 1.22 2.07 -0.81 -1.30 116.25 120.00 1ndz h VAL 133 Ca 0.25 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1ndz h VAL 133 Cb 0.28 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 1ndz h VAL 133 CO -0.01 0.14 -0.42 0.78 0.02 0.00 0.00 177.57 178.07 1ndz h ASN 134 N 0.74 -1.15 -0.93 0.57 -0.26 0.58 -0.37 115.58 114.76 1ndz h ASN 134 Ca 0.31 0.09 0.10 0.00 -0.56 0.00 0.00 56.30 56.23 1ndz h ASN 134 Cb 0.16 0.38 -0.12 0.00 -1.06 0.00 0.00 38.32 37.68 1ndz h ASN 134 CO -0.17 -0.57 -0.50 0.00 -1.06 0.00 0.00 177.43 175.13 1ndz n GLN 135 N -5.00 -0.36 -0.35 0.81 6.02 -0.57 0.54 117.38 118.48 1ndz n GLN 135 Ca -0.10 1.41 -0.01 0.00 -0.01 0.00 0.00 57.00 58.28 1ndz n GLN 135 Cb 0.39 -2.07 0.14 0.00 1.02 0.00 0.00 30.24 29.72 1ndz n GLN 135 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1ndz h GLY 136 N 0.00 1.35 1.47 1.08 0.00 -1.02 0.19 103.07 106.16 1ndz h GLY 136 Ca 0.19 -0.50 -0.09 0.00 0.00 0.00 0.00 47.33 46.94 1ndz h GLY 136 CO -0.88 0.48 -0.15 1.41 0.00 0.00 0.00 176.54 177.39 1ndz h LEU 137 N 1.28 0.61 -0.00 3.11 -0.00 0.12 -0.32 115.31 120.11 1ndz h LEU 137 Ca 0.36 -0.18 -0.00 0.00 -0.00 0.00 0.00 57.88 58.05 1ndz h LEU 137 Cb -0.12 -0.17 -0.00 0.00 -0.00 0.00 0.00 40.66 40.37 1ndz h LEU 137 CO -0.08 0.79 -0.00 1.56 -0.00 0.00 0.00 178.44 180.70 1ndz h GLN 138 N 0.56 0.01 -0.19 1.13 4.20 0.72 0.20 115.11 121.74 1ndz h GLN 138 Ca 0.09 -0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.82 1ndz h GLN 138 Cb 0.59 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 1ndz h GLN 138 CO 0.04 0.43 0.13 0.93 -0.67 0.00 0.00 178.83 179.69 1ndz h GLU 139 N -0.41 0.16 -0.01 1.46 5.08 -0.69 -1.51 114.58 118.65 1ndz h GLU 139 Ca 0.00 -0.01 -0.19 0.00 -1.00 0.00 0.00 59.36 58.17 1ndz h GLU 139 Cb 0.43 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1ndz h GLU 139 CO 0.00 0.10 -0.82 0.78 -1.00 0.00 0.00 179.01 178.07 1ndz h GLY 140 N 0.16 0.21 0.94 -3.84 0.00 -0.53 -2.17 103.07 97.84 1ndz h GLY 140 Ca 0.08 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 47.05 1ndz h GLY 140 CO -0.01 0.31 -0.22 -2.09 0.00 0.00 0.00 176.54 174.52 1ndz h GLU 141 N 0.11 -0.56 -0.89 4.80 4.81 0.20 0.24 114.58 123.29 1ndz h GLU 141 Ca -0.03 0.04 0.17 0.00 -0.13 0.00 0.00 59.36 59.41 1ndz h GLU 141 Cb 1.43 0.13 -0.17 0.00 0.63 0.00 0.00 28.75 30.77 1ndz h GLU 141 CO 0.12 -0.38 -0.24 0.00 -0.73 0.00 0.00 179.01 177.79 1ndz h ARG 142 N -0.58 -0.01 0.08 1.92 2.47 -1.19 -1.37 114.38 115.70 1ndz h ARG 142 Ca -0.05 0.00 -0.27 0.00 -1.26 0.00 0.00 59.98 58.41 1ndz h ARG 142 Cb 0.47 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.78 1ndz h ARG 142 CO 0.06 -0.00 -1.28 -0.44 0.56 0.00 0.00 179.97 178.87 1ndz h ASP 143 N -0.01 0.27 -0.00 7.04 3.45 -1.08 -3.39 116.42 122.70 1ndz h ASP 143 Ca 0.41 -0.32 0.00 0.00 0.43 0.00 0.00 57.03 57.56 1ndz h ASP 143 Cb 0.64 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 39.32 1ndz h ASP 143 CO -0.91 1.26 -0.06 0.49 -1.57 0.00 0.00 179.24 178.45 1ndz n PHE 144 N -3.43 0.00 -1.37 4.55 3.01 0.04 -5.03 117.46 115.24 1ndz n PHE 144 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.37 1ndz n PHE 144 Cb 1.01 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.48 1ndz n PHE 144 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ndz n GLY 145 N 0.51 0.73 3.17 1.37 0.00 -0.52 -4.89 105.19 105.57 1ndz n GLY 145 Ca 0.02 -0.70 -0.32 0.00 0.00 0.00 0.00 46.02 45.03 1ndz n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ndz s VAL 146 N -2.00 1.99 0.12 1.61 1.01 -1.25 -4.93 120.40 116.95 1ndz s VAL 146 Ca 0.00 -0.95 -0.30 0.00 0.00 0.00 0.00 61.98 60.73 1ndz s VAL 146 Cb 0.00 -1.75 -0.06 0.00 0.00 0.00 0.00 36.38 34.57 1ndz s VAL 146 CO 0.00 0.54 1.03 -0.75 0.00 0.00 0.00 175.10 175.92 1ndz s LYS 147 N 0.67 4.63 -0.04 2.72 2.20 0.10 -4.49 119.74 125.52 1ndz s LYS 147 Ca -0.11 1.57 -0.01 0.00 -0.36 0.00 0.00 55.97 57.06 1ndz s LYS 147 Cb -0.16 -3.35 0.03 0.00 -1.51 0.00 0.00 37.83 32.85 1ndz s LYS 147 CO 0.02 0.10 0.08 0.08 -0.36 0.00 0.00 175.35 175.27 1ndz s VAL 148 N 0.09 -0.09 0.32 4.02 1.01 -1.26 -1.63 120.40 122.87 1ndz s VAL 148 Ca 0.49 0.25 0.06 0.00 0.00 0.00 0.00 61.98 62.79 1ndz s VAL 148 Cb -0.26 -0.16 -0.06 0.00 0.00 0.00 0.00 36.38 35.90 1ndz s VAL 148 CO 0.31 0.10 -0.02 -0.13 0.00 0.00 0.00 175.10 175.37 1ndz s ARG 149 N 1.40 1.68 0.25 2.72 1.81 -0.67 -4.95 118.95 121.19 1ndz s ARG 149 Ca -0.06 -1.89 0.06 0.00 -1.72 0.00 0.00 55.73 52.13 1ndz s ARG 149 Cb -0.12 -1.22 -0.05 0.00 -0.45 0.00 0.00 34.95 33.10 1ndz s ARG 149 CO -0.04 -0.02 -0.08 -1.54 -0.68 0.00 0.00 175.30 172.94 1ndz s SER 150 N -3.52 2.57 -0.05 0.23 1.04 -0.33 -0.88 113.70 112.76 1ndz s SER 150 Ca 0.33 -1.14 0.02 0.00 0.48 0.00 0.00 55.95 55.63 1ndz s SER 150 Cb 0.06 -0.13 0.02 0.00 0.10 0.00 0.00 66.02 66.06 1ndz s SER 150 CO 0.14 -0.32 -0.08 -0.63 0.98 0.00 0.00 173.24 173.34 1ndz s ILE 151 N -3.06 0.81 -0.10 -1.02 1.01 0.18 -1.07 121.20 117.96 1ndz s ILE 151 Ca 0.27 -0.29 -0.15 0.00 0.00 0.00 0.00 60.65 60.48 1ndz s ILE 151 Cb 0.03 -0.78 -0.05 0.00 0.01 0.00 0.00 42.46 41.67 1ndz s ILE 151 CO 0.10 0.28 0.37 -0.76 0.00 0.00 0.00 174.94 174.93 1ndz s LEU 152 N 0.80 4.33 -0.26 2.97 1.43 -0.93 -2.22 118.68 124.79 1ndz s LEU 152 Ca -0.13 0.72 -0.11 0.00 -1.03 0.00 0.00 54.13 53.58 1ndz s LEU 152 Cb -0.15 -2.51 -0.05 0.00 0.03 0.00 0.00 46.19 43.51 1ndz s LEU 152 CO 0.02 0.15 0.18 0.00 0.23 0.00 0.00 176.35 176.93 1ndz s MET 155 N -4.77 2.43 0.12 0.00 -1.94 -1.26 -1.56 119.30 112.32 1ndz s MET 155 Ca 0.64 -0.63 -0.03 0.00 -1.71 0.00 0.00 55.69 53.96 1ndz s MET 155 Cb -0.20 -2.08 0.20 0.00 2.01 0.00 0.00 34.83 34.76 1ndz s MET 155 CO 0.57 -0.11 0.65 0.54 -0.01 0.00 0.00 175.02 176.67 1ndz n ARG 156 N 4.34 -0.04 0.00 2.03 5.12 0.14 -0.92 116.66 127.34 1ndz n ARG 156 Ca -0.19 0.65 0.13 0.00 -1.93 0.00 0.00 57.85 56.52 1ndz n ARG 156 Cb 0.51 -0.97 0.63 0.00 -1.16 0.00 0.00 32.46 31.47 1ndz n ARG 156 CO 0.00 0.00 0.00 -2.39 -1.93 0.00 0.00 177.63 173.31 1ndz n HIS 157 N -4.66 0.00 -3.44 -1.55 1.44 -1.26 -4.26 115.22 101.49 1ndz n HIS 157 Ca 0.07 0.00 -0.27 0.00 -2.01 0.00 0.00 57.72 55.51 1ndz n HIS 157 Cb 0.22 -0.41 -0.10 0.00 0.12 0.00 0.00 29.99 29.81 1ndz n HIS 157 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1ndz s GLN 158 N -2.83 1.05 0.41 -1.40 -1.52 -0.10 -4.92 119.66 110.36 1ndz s GLN 158 Ca 0.19 -2.23 0.29 0.00 -1.95 0.00 0.00 55.36 51.66 1ndz s GLN 158 Cb 0.18 -1.60 1.27 0.00 -0.22 0.00 0.00 33.01 32.65 1ndz s GLN 158 CO 0.47 -1.38 1.87 -1.00 -0.25 0.00 0.00 175.29 175.00 1ndz h PRO 159 N 5.61 0.00 0.00 2.91 0.13 -1.74 0.32 132.00 139.23 1ndz h PRO 159 Ca 0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.39 1ndz h PRO 159 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1ndz h PRO 159 CO 0.40 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 178.83 1ndz h SER 160 N 0.00 0.00 0.67 1.44 4.64 -1.93 -2.40 113.55 115.97 1ndz h SER 160 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ndz h SER 160 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1ndz h SER 160 CO 0.00 0.00 -0.44 0.79 -0.87 0.00 0.00 176.83 176.31 1ndz n TRP 161 N -2.62 0.13 0.12 4.77 8.01 0.11 -4.57 117.44 123.40 1ndz n TRP 161 Ca -0.01 0.04 -0.02 0.00 -1.31 0.00 0.00 57.50 56.19 1ndz n TRP 161 Cb 0.10 -0.39 0.17 0.00 -2.01 0.00 0.00 31.31 29.18 1ndz n TRP 161 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.69 177.45 1ndz h SER 162 N 0.00 0.08 0.08 -0.99 0.02 -1.58 -1.43 113.55 109.74 1ndz h SER 162 Ca 0.00 -0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 60.83 1ndz h SER 162 Cb 0.56 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 1ndz h SER 162 CO 0.00 0.66 -0.23 0.77 -1.14 0.00 0.00 176.83 176.90 1ndz h SER 163 N 0.05 0.26 -0.40 3.07 4.64 -1.79 -1.35 113.55 118.04 1ndz h SER 163 Ca -0.01 -0.07 -0.05 0.00 -0.47 0.00 0.00 61.79 61.19 1ndz h SER 163 Cb 1.07 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.08 1ndz h SER 163 CO 0.08 0.50 0.07 -0.33 -0.87 0.00 0.00 176.83 176.28 1ndz h GLU 164 N 0.25 0.66 -0.01 4.77 5.08 -1.63 0.16 114.58 123.86 1ndz h GLU 164 Ca 0.04 -0.17 0.02 0.00 -1.00 0.00 0.00 59.36 58.24 1ndz h GLU 164 Cb 0.54 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.67 1ndz h GLU 164 CO 0.04 0.70 -0.43 0.28 -1.00 0.00 0.00 179.01 178.60 1ndz h VAL 165 N 0.51 0.00 -0.84 3.13 2.07 -1.01 0.20 116.25 120.31 1ndz h VAL 165 Ca 0.12 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.74 1ndz h VAL 165 Cb 0.36 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.06 1ndz h VAL 165 CO 0.01 0.00 0.48 0.58 0.02 0.00 0.00 177.57 178.65 1ndz h VAL 166 N -0.53 0.89 -0.91 2.57 2.07 -1.09 -0.25 116.25 118.99 1ndz h VAL 166 Ca 0.01 -0.27 0.06 0.00 0.82 0.00 0.00 66.70 67.32 1ndz h VAL 166 Cb 0.57 0.04 -0.06 0.00 -1.52 0.00 0.00 31.29 30.32 1ndz h VAL 166 CO -0.29 0.14 0.59 -0.33 0.02 0.00 0.00 177.57 177.71 1ndz h GLU 167 N 0.78 1.04 -0.03 1.57 4.39 -0.69 -1.12 114.58 120.52 1ndz h GLU 167 Ca 0.41 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 60.05 1ndz h GLU 167 Cb 0.41 -0.23 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1ndz h GLU 167 CO -0.26 0.69 0.02 -0.07 -1.16 0.00 0.00 179.01 178.22 1ndz h LEU 168 N 1.07 0.04 -0.93 1.33 -0.00 0.63 0.11 115.31 117.56 1ndz h LEU 168 Ca 0.38 -0.11 0.27 0.00 -0.00 0.00 0.00 57.88 58.42 1ndz h LEU 168 Cb 0.14 -0.01 -0.16 0.00 -0.00 0.00 0.00 40.66 40.63 1ndz h LEU 168 CO -0.14 0.14 0.24 0.00 -0.00 0.00 0.00 178.44 178.69 1ndz h LYS 170 N 0.14 0.73 -0.66 0.00 1.57 0.13 -3.13 116.57 115.35 1ndz h LYS 170 Ca 0.61 -0.69 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 1ndz h LYS 170 Cb 1.32 0.17 -0.03 0.00 0.08 0.00 0.00 32.23 33.78 1ndz h LYS 170 CO -0.74 1.28 0.11 -0.22 -0.57 0.00 0.00 179.45 179.32 1ndz h LYS 171 N 0.46 1.09 -0.79 3.15 3.64 -0.33 -3.14 116.57 120.66 1ndz h LYS 171 Ca -0.09 -0.29 -0.26 0.00 -1.27 0.00 0.00 60.65 58.74 1ndz h LYS 171 Cb 1.55 -0.13 -0.15 0.00 -0.41 0.00 0.00 32.23 33.08 1ndz h LYS 171 CO 0.18 1.00 0.33 0.66 -2.27 0.00 0.00 179.45 179.35 1ndz n TYR 172 N -4.24 2.58 -1.89 1.91 4.01 0.13 -5.01 117.16 114.66 1ndz n TYR 172 Ca 0.04 -1.28 -0.38 0.00 -0.16 0.00 0.00 57.90 56.12 1ndz n TYR 172 Cb 0.29 -0.73 0.03 0.00 -0.31 0.00 0.00 39.34 38.61 1ndz n TYR 172 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 1ndz s ARG 173 N -3.02 3.31 0.00 -0.72 1.70 -1.18 -1.41 118.95 117.63 1ndz s ARG 173 Ca 0.56 2.14 0.00 0.00 -0.47 0.00 0.00 55.73 57.95 1ndz s ARG 173 Cb 0.45 -2.32 0.00 0.00 -0.57 0.00 0.00 34.95 32.51 1ndz s ARG 173 CO 0.13 -1.02 0.00 -1.91 -1.08 0.00 0.00 175.30 171.42 1ndz n GLU 174 N -0.85 0.00 -1.66 3.89 2.13 -0.90 -4.75 120.64 118.49 1ndz n GLU 174 Ca 0.09 0.00 -0.37 0.00 0.66 0.00 0.00 57.16 57.55 1ndz n GLU 174 Cb 0.45 0.00 0.06 0.00 0.27 0.00 0.00 31.44 32.22 1ndz n GLU 174 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1ndz n GLN 175 N 0.00 2.77 -0.15 5.31 6.02 -0.50 -4.45 117.38 126.37 1ndz n GLN 175 Ca 0.00 -3.46 0.05 0.00 -0.01 0.00 0.00 57.00 53.57 1ndz n GLN 175 Cb 0.00 -2.28 0.13 0.00 1.02 0.00 0.00 30.24 29.11 1ndz n GLN 175 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1ndz n THR 176 N -0.72 1.05 -2.26 5.09 -2.24 -1.22 -4.87 114.28 109.11 1ndz n THR 176 Ca 0.57 -1.04 -0.43 0.00 -2.27 0.00 0.00 64.05 60.89 1ndz n THR 176 Cb 0.47 0.47 -0.02 0.00 -2.10 0.00 0.00 70.33 69.14 1ndz n THR 176 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1ndz s VAL 177 N -1.07 3.99 -0.39 2.28 -7.23 -0.97 -1.19 120.40 115.81 1ndz s VAL 177 Ca 0.20 1.21 0.04 0.00 -1.81 0.00 0.00 61.98 61.62 1ndz s VAL 177 Cb 0.11 -3.78 0.02 0.00 0.56 0.00 0.00 36.38 33.28 1ndz s VAL 177 CO 0.13 -0.10 0.52 1.33 -0.31 0.00 0.00 175.10 176.67 1ndz n VAL 178 N 5.33 0.00 -3.54 1.32 0.24 -0.23 -2.13 118.33 119.32 1ndz n VAL 178 Ca 0.15 -0.49 -0.09 0.00 -2.04 0.00 0.00 64.34 61.87 1ndz n VAL 178 Cb 0.44 1.06 -0.02 0.00 -1.47 0.00 0.00 33.84 33.85 1ndz n VAL 178 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ndz s ALA 179 N -0.49 -1.64 0.10 2.33 0.00 -1.25 -3.05 121.76 117.76 1ndz s ALA 179 Ca 0.04 0.54 0.05 0.00 0.00 0.00 0.00 51.96 52.58 1ndz s ALA 179 Cb 0.03 0.69 -0.04 0.00 0.00 0.00 0.00 23.12 23.80 1ndz s ALA 179 CO 0.06 -0.81 0.03 -1.50 0.00 0.00 0.00 175.76 173.54 1ndz s ILE 180 N -3.49 4.14 0.22 0.00 2.07 -0.54 -2.20 121.20 121.40 1ndz s ILE 180 Ca 0.05 -0.99 0.03 0.00 -1.41 0.00 0.00 60.65 58.34 1ndz s ILE 180 Cb -0.02 -3.00 -0.05 0.00 0.13 0.00 0.00 42.46 39.52 1ndz s ILE 180 CO -0.07 0.08 -0.00 -0.62 -1.91 0.00 0.00 174.94 172.42 1ndz s ASP 181 N -2.44 1.76 -0.20 4.50 3.68 0.05 -1.22 116.67 122.79 1ndz s ASP 181 Ca 0.27 -1.21 -0.02 0.00 2.13 0.00 0.00 52.55 53.72 1ndz s ASP 181 Cb -0.11 0.02 0.06 0.00 -1.45 0.00 0.00 42.92 41.44 1ndz s ASP 181 CO 0.20 -0.52 0.00 -0.22 0.13 0.00 0.00 175.17 174.76 1ndz s LEU 182 N -3.29 1.65 0.39 -1.34 2.96 -1.23 -0.91 118.68 116.91 1ndz s LEU 182 Ca 0.28 -0.92 0.05 0.00 -0.22 0.00 0.00 54.13 53.32 1ndz s LEU 182 Cb 0.06 -0.80 -0.02 0.00 0.50 0.00 0.00 46.19 45.92 1ndz s LEU 182 CO 0.08 -0.28 0.17 0.00 -1.32 0.00 0.00 176.35 175.01 1ndz s ALA 183 N 1.70 2.65 0.00 5.97 0.00 -0.60 -1.46 121.76 130.02 1ndz s ALA 183 Ca -0.02 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 50.51 1ndz s ALA 183 Cb -0.17 0.95 0.00 0.00 0.00 0.00 0.00 23.12 23.90 1ndz s ALA 183 CO -0.07 -0.43 0.00 0.41 0.00 0.00 0.00 175.76 175.67 1ndz n GLY 184 N -0.84 -0.86 3.54 0.00 0.00 -1.26 0.28 105.19 106.05 1ndz n GLY 184 Ca -0.03 -2.09 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 1ndz n GLY 184 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ndz s ASP 185 N -4.00 6.24 0.00 1.61 3.68 -1.26 -4.86 116.67 118.08 1ndz s ASP 185 Ca 0.00 -0.43 0.30 0.00 2.13 0.00 0.00 52.55 54.55 1ndz s ASP 185 Cb 0.00 -2.52 1.74 0.00 -1.45 0.00 0.00 42.92 40.69 1ndz s ASP 185 CO 0.00 -1.63 2.10 -1.84 0.13 0.00 0.00 175.17 173.93 1ndz n GLU 186 N 8.69 0.86 0.00 4.34 0.28 -1.26 -2.68 120.64 130.87 1ndz n GLU 186 Ca 0.03 0.00 0.12 0.00 -0.16 0.00 0.00 57.16 57.15 1ndz n GLU 186 Cb 0.48 -1.50 0.23 0.00 1.43 0.00 0.00 31.44 32.08 1ndz n GLU 186 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1ndz n THR 187 N -1.04 0.00 -1.49 3.84 -2.24 -1.26 -4.75 114.28 107.34 1ndz n THR 187 Ca 0.21 -0.01 -0.56 0.00 -2.27 0.00 0.00 64.05 61.42 1ndz n THR 187 Cb 0.12 0.34 -0.09 0.00 -2.10 0.00 0.00 70.33 68.61 1ndz n THR 187 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1ndz n ILE 188 N -1.40 0.16 -1.62 2.28 5.41 -1.09 -4.79 119.36 118.30 1ndz n ILE 188 Ca 0.06 -0.12 -0.64 0.00 1.00 0.00 0.00 62.75 63.05 1ndz n ILE 188 Cb 0.34 -1.15 -0.10 0.00 -0.71 0.00 0.00 39.64 38.02 1ndz n ILE 188 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1ndz n GLU 189 N 6.96 0.00 -1.15 0.38 2.13 -1.26 -1.23 120.64 126.47 1ndz n GLU 189 Ca 0.40 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 58.17 1ndz n GLU 189 Cb 0.11 -1.43 -0.02 0.00 0.27 0.00 0.00 31.44 30.37 1ndz n GLU 189 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ndz n GLY 190 N 4.18 0.55 0.33 8.31 0.00 -1.26 -4.89 105.19 112.41 1ndz n GLY 190 Ca 0.32 -0.04 0.15 0.00 0.00 0.00 0.00 46.02 46.46 1ndz n GLY 190 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ndz h SER 191 N 0.00 0.00 0.41 1.61 4.64 -1.52 0.58 113.55 119.27 1ndz h SER 191 Ca -0.11 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.18 1ndz h SER 191 Cb 0.97 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.06 1ndz h SER 191 CO 0.16 0.00 -0.16 0.28 -0.87 0.00 0.00 176.83 176.23 1ndz h SER 192 N 0.00 0.00 -0.34 4.97 0.02 -1.90 -2.86 113.55 113.43 1ndz h SER 192 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1ndz h SER 192 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 1ndz h SER 192 CO -0.00 0.16 0.00 0.18 -1.14 0.00 0.00 176.83 176.03 1ndz n LEU 193 N -3.71 3.35 -4.63 5.07 7.99 0.18 -4.56 117.00 120.69 1ndz n LEU 193 Ca -0.02 -1.47 -0.49 0.00 -0.01 0.00 0.00 56.01 54.03 1ndz n LEU 193 Cb 0.28 -0.22 -0.05 0.00 -0.11 0.00 0.00 43.42 43.32 1ndz n LEU 193 CO 0.32 0.71 1.05 0.49 -1.51 0.00 0.00 177.39 178.45 1ndz n PHE 194 N 1.41 1.92 -0.31 -1.77 3.72 -1.08 -4.76 117.46 116.59 1ndz n PHE 194 Ca 0.18 0.44 0.04 0.00 -0.05 0.00 0.00 57.45 58.06 1ndz n PHE 194 Cb 0.59 -2.44 0.18 0.00 -0.94 0.00 0.00 39.48 36.87 1ndz n PHE 194 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1ndz h PRO 195 N 5.26 0.82 -0.68 -1.08 0.11 -1.93 -1.43 132.00 133.06 1ndz h PRO 195 Ca -0.46 -0.05 0.12 0.00 0.11 0.00 0.00 66.00 65.72 1ndz h PRO 195 Cb 1.29 -0.18 -0.09 0.00 0.11 0.00 0.00 31.00 32.13 1ndz h PRO 195 CO 0.83 0.54 0.25 0.78 -0.21 0.00 0.00 178.00 180.20 1ndz h GLY 196 N 0.84 0.99 1.00 -0.55 0.00 -1.88 0.31 103.07 103.78 1ndz h GLY 196 Ca 0.42 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1ndz h GLY 196 CO -0.25 -0.07 0.01 0.45 0.00 0.00 0.00 176.54 176.68 1ndz h HIS 197 N 0.41 0.03 -0.19 5.60 3.86 -1.49 -1.33 115.15 122.03 1ndz h HIS 197 Ca 0.36 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.57 1ndz h HIS 197 Cb 0.51 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.97 1ndz h HIS 197 CO -0.18 0.02 0.12 0.28 0.86 0.00 0.00 177.93 179.03 1ndz h VAL 198 N 0.03 1.07 -0.26 2.45 2.07 -0.84 -1.04 116.25 119.74 1ndz h VAL 198 Ca 0.01 -0.17 -0.09 0.00 0.82 0.00 0.00 66.70 67.27 1ndz h VAL 198 Cb -0.00 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1ndz h VAL 198 CO -0.00 0.07 -0.21 1.56 0.02 0.00 0.00 177.57 179.01 1ndz h GLN 199 N 0.24 0.47 -0.95 1.57 1.08 -0.43 0.02 115.11 117.10 1ndz h GLN 199 Ca 0.07 -0.16 0.05 0.00 -1.45 0.00 0.00 58.65 57.16 1ndz h GLN 199 Cb 0.01 -0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 27.35 1ndz h GLN 199 CO -0.01 0.65 0.62 0.00 -0.95 0.00 0.00 178.83 179.14 1ndz h ALA 200 N 1.36 1.42 0.00 3.87 0.00 -0.99 -2.02 119.26 122.89 1ndz h ALA 200 Ca 0.07 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 1ndz h ALA 200 Cb 0.60 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1ndz h ALA 200 CO 0.04 0.47 -0.79 1.88 0.00 0.00 0.00 179.25 180.85 1ndz h TYR 201 N 1.16 0.00 -0.13 0.00 -1.99 -0.88 -0.06 116.97 115.06 1ndz h TYR 201 Ca 0.39 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 61.02 1ndz h TYR 201 Cb 0.08 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.79 1ndz h TYR 201 CO -0.00 0.79 -0.38 0.00 -0.00 0.00 0.00 178.16 178.57 1ndz h ALA 202 N 1.21 1.11 0.00 3.88 0.00 -0.91 -0.15 119.26 124.40 1ndz h ALA 202 Ca -0.01 -0.40 -0.14 0.00 0.00 0.00 0.00 54.91 54.36 1ndz h ALA 202 Cb 1.53 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1ndz h ALA 202 CO 0.10 0.58 -0.69 1.49 0.00 0.00 0.00 179.25 180.73 1ndz h GLU 203 N 0.24 0.00 -0.23 0.00 4.57 -1.02 -0.51 114.58 117.63 1ndz h GLU 203 Ca 0.02 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.23 1ndz h GLU 203 Cb 0.79 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.35 1ndz h GLU 203 CO 0.06 0.69 0.06 0.00 -1.18 0.00 0.00 179.01 178.65 1ndz h ALA 204 N 1.31 0.25 -0.97 2.92 0.00 -0.41 0.14 119.26 122.50 1ndz h ALA 204 Ca -0.01 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1ndz h ALA 204 Cb 1.36 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 19.12 1ndz h ALA 204 CO 0.09 -0.35 0.63 0.28 0.00 0.00 0.00 179.25 179.90 1ndz h VAL 205 N 0.16 1.14 -0.06 0.00 2.07 -0.76 -0.80 116.25 118.00 1ndz h VAL 205 Ca 0.10 -0.41 -0.09 0.00 0.82 0.00 0.00 66.70 67.12 1ndz h VAL 205 Cb 0.08 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 29.68 1ndz h VAL 205 CO -0.12 0.22 -0.39 0.50 0.02 0.00 0.00 177.57 177.80 1ndz h LYS 206 N 1.20 0.12 -0.19 1.57 3.64 -0.30 -3.03 116.57 119.57 1ndz h LYS 206 Ca 0.40 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.72 1ndz h LYS 206 Cb 0.06 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1ndz h LYS 206 CO -0.14 0.49 -0.01 -1.13 -2.27 0.00 0.00 179.45 176.39 1ndz n SER 207 N -4.06 3.34 -1.83 4.20 3.41 0.42 -4.98 113.62 114.12 1ndz n SER 207 Ca -0.02 -3.09 -0.16 0.00 -0.26 0.00 0.00 58.87 55.35 1ndz n SER 207 Cb 0.44 -0.52 -0.00 0.00 -0.26 0.00 0.00 64.21 63.87 1ndz n SER 207 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ndz n GLY 208 N -0.82 -0.26 3.74 5.00 0.00 -0.84 -5.02 105.19 106.99 1ndz n GLY 208 Ca 0.20 -0.22 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 1ndz n GLY 208 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ndz s VAL 209 N -2.80 5.29 0.86 1.61 -7.23 -0.37 -5.05 120.40 112.72 1ndz s VAL 209 Ca 0.03 0.56 -0.11 0.00 -1.81 0.00 0.00 61.98 60.66 1ndz s VAL 209 Cb -0.01 -3.63 0.11 0.00 0.56 0.00 0.00 36.38 33.41 1ndz s VAL 209 CO 0.04 0.41 1.11 -1.00 -0.31 0.00 0.00 175.10 175.35 1ndz s HIS 210 N 0.31 2.09 -0.04 2.82 3.76 -1.17 -4.45 115.29 118.60 1ndz s HIS 210 Ca 0.17 1.61 -0.02 0.00 -0.15 0.00 0.00 55.06 56.67 1ndz s HIS 210 Cb -0.13 -3.18 0.03 0.00 1.11 0.00 0.00 32.58 30.40 1ndz s HIS 210 CO 0.05 -2.39 0.09 1.03 -0.85 0.00 0.00 174.74 172.67 1ndz s ARG 211 N -4.78 0.03 0.29 1.40 0.52 -1.26 -1.47 118.95 113.68 1ndz s ARG 211 Ca 0.64 0.26 0.05 0.00 -0.52 0.00 0.00 55.73 56.15 1ndz s ARG 211 Cb -0.20 -0.18 -0.06 0.00 0.52 0.00 0.00 34.95 35.03 1ndz s ARG 211 CO 0.57 -0.15 0.00 -0.08 0.02 0.00 0.00 175.30 175.67 1ndz s THR 212 N 0.97 1.34 -0.21 0.02 -1.32 -0.36 -0.05 115.64 116.04 1ndz s THR 212 Ca -0.08 -2.05 -0.09 0.00 -1.21 0.00 0.00 61.69 58.26 1ndz s THR 212 Cb -0.11 -2.60 0.08 0.00 -1.51 0.00 0.00 72.50 68.37 1ndz s THR 212 CO -0.04 -0.17 0.47 -0.69 -2.21 0.00 0.00 174.62 171.99 1ndz s VAL 213 N -3.20 -0.42 -0.06 5.08 1.01 -1.18 -3.48 120.40 118.15 1ndz s VAL 213 Ca 0.32 0.11 -0.30 0.00 0.00 0.00 0.00 61.98 62.12 1ndz s VAL 213 Cb 0.06 -0.72 -0.05 0.00 0.00 0.00 0.00 36.38 35.67 1ndz s VAL 213 CO 0.13 0.04 1.63 -1.00 0.00 0.00 0.00 175.10 175.91 1ndz s HIS 214 N 2.15 2.02 -0.27 5.22 3.76 -0.54 -0.42 115.29 127.21 1ndz s HIS 214 Ca -0.06 0.23 -0.21 0.00 -0.15 0.00 0.00 55.06 54.87 1ndz s HIS 214 Cb -0.10 -3.90 0.07 0.00 1.11 0.00 0.00 32.58 29.77 1ndz s HIS 214 CO -0.14 -3.75 0.71 0.00 -0.85 0.00 0.00 174.74 170.71 1ndz s ALA 215 N 4.00 -1.82 0.00 -1.40 0.00 -0.65 -4.89 121.76 117.00 1ndz s ALA 215 Ca 0.72 2.18 0.00 0.00 0.00 0.00 0.00 51.96 54.87 1ndz s ALA 215 Cb -0.33 -1.28 0.00 0.00 0.00 0.00 0.00 23.12 21.52 1ndz s ALA 215 CO 0.29 -0.36 0.00 0.41 0.00 0.00 0.00 175.76 176.10 1ndz n GLY 216 N 3.33 0.46 0.05 0.00 0.00 -1.26 -0.44 105.19 107.34 1ndz n GLY 216 Ca -0.16 -0.81 -0.01 0.00 0.00 0.00 0.00 46.02 45.03 1ndz n GLY 216 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ndz h GLU 217 N 0.23 0.00 0.00 1.61 4.81 -1.91 0.26 114.58 119.58 1ndz h GLU 217 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1ndz h GLU 217 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1ndz h GLU 217 CO 0.00 0.04 -0.47 1.55 -0.73 0.00 0.00 179.01 179.40 1ndz n VAL 218 N -4.76 0.00 -2.20 0.32 3.14 -1.26 -4.63 118.33 108.94 1ndz n VAL 218 Ca -0.01 -0.19 -0.26 0.00 -2.96 0.00 0.00 64.34 60.92 1ndz n VAL 218 Cb 0.05 0.68 0.09 0.00 -1.06 0.00 0.00 33.84 33.59 1ndz n VAL 218 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1ndz s GLY 219 N -1.31 1.71 0.86 7.55 0.00 -1.26 -4.95 107.32 109.93 1ndz s GLY 219 Ca 0.00 -1.06 -0.11 0.00 0.00 0.00 0.00 44.72 43.55 1ndz s GLY 219 CO 0.00 -0.58 1.09 -1.35 0.00 0.00 0.00 173.10 172.26 1ndz s SER 220 N -4.60 3.72 0.60 1.64 1.04 -1.26 -4.10 113.70 110.75 1ndz s SER 220 Ca 0.63 1.62 0.31 0.00 0.48 0.00 0.00 55.95 58.99 1ndz s SER 220 Cb -0.09 -2.29 1.87 0.00 0.10 0.00 0.00 66.02 65.61 1ndz s SER 220 CO 0.46 -2.50 2.25 0.00 0.98 0.00 0.00 173.24 174.43 1ndz h ALA 221 N -1.45 1.50 -0.92 5.32 0.00 -1.94 -1.42 119.26 120.34 1ndz h ALA 221 Ca -0.48 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.49 1ndz h ALA 221 Cb 1.27 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.00 1ndz h ALA 221 CO 0.53 -0.03 0.60 -0.97 0.00 0.00 0.00 179.25 179.38 1ndz h ASN 222 N 0.00 0.95 -0.98 0.00 -1.24 -1.92 -0.15 115.58 112.24 1ndz h ASN 222 Ca 0.01 0.00 0.07 0.00 0.71 0.00 0.00 56.30 57.09 1ndz h ASN 222 Cb 0.06 -0.20 -0.07 0.00 0.73 0.00 0.00 38.32 38.84 1ndz h ASN 222 CO -0.00 0.62 0.64 1.62 -1.29 0.00 0.00 177.43 179.01 1ndz h VAL 223 N 1.08 1.08 -0.29 2.57 3.04 -1.60 -0.67 116.25 121.45 1ndz h VAL 223 Ca 0.39 -0.39 -0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1ndz h VAL 223 Cb 0.15 -0.16 -0.01 0.00 -2.01 0.00 0.00 31.29 29.25 1ndz h VAL 223 CO -0.14 0.21 0.18 0.58 -1.01 0.00 0.00 177.57 177.39 1ndz h VAL 224 N 1.14 1.10 -0.81 1.51 2.07 -1.40 -1.54 116.25 118.32 1ndz h VAL 224 Ca 0.43 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.70 1ndz h VAL 224 Cb 0.19 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 1ndz h VAL 224 CO -0.17 0.10 0.52 0.50 0.02 0.00 0.00 177.57 178.54 1ndz h LYS 225 N 0.38 1.08 -0.82 1.57 3.64 -0.66 -0.56 116.57 121.20 1ndz h LYS 225 Ca 0.11 -0.08 0.04 0.00 -1.27 0.00 0.00 60.65 59.44 1ndz h LYS 225 Cb 0.01 -0.24 -0.05 0.00 -0.41 0.00 0.00 32.23 31.55 1ndz h LYS 225 CO -0.02 0.73 0.54 0.93 -2.27 0.00 0.00 179.45 179.36 1ndz h GLU 226 N 1.10 0.98 -0.63 1.90 5.08 -1.04 0.20 114.58 122.16 1ndz h GLU 226 Ca 0.29 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.53 1ndz h GLU 226 Cb -0.10 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 28.91 1ndz h GLU 226 CO -0.06 0.65 0.12 0.00 -1.00 0.00 0.00 179.01 178.71 1ndz h ALA 227 N 1.52 1.02 0.01 3.43 0.00 -0.09 -1.35 119.26 123.79 1ndz h ALA 227 Ca 0.33 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1ndz h ALA 227 Cb 0.04 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.59 1ndz h ALA 227 CO -0.10 0.63 -0.33 0.28 0.00 0.00 0.00 179.25 179.74 1ndz h VAL 228 N 0.96 1.53 0.13 0.00 2.07 -0.64 -1.50 116.25 118.80 1ndz h VAL 228 Ca 0.20 -2.01 -0.31 0.00 0.82 0.00 0.00 66.70 65.40 1ndz h VAL 228 Cb 0.39 2.78 -0.00 0.00 -1.52 0.00 0.00 31.29 32.95 1ndz h VAL 228 CO 0.01 0.56 -1.50 0.44 0.02 0.00 0.00 177.57 177.09 1ndz h ASP 229 N -0.45 0.44 0.00 0.57 3.32 -0.64 -2.95 116.42 116.71 1ndz h ASP 229 Ca -0.04 -0.58 -0.43 0.00 0.02 0.00 0.00 57.03 56.00 1ndz h ASP 229 Cb 1.09 -0.14 -0.07 0.00 0.22 0.00 0.00 39.33 40.43 1ndz h ASP 229 CO 0.06 1.47 -2.46 0.41 -1.72 0.00 0.00 179.24 177.01 1ndz n THR 230 N -3.49 1.44 1.24 0.35 -1.04 -0.58 -4.46 114.28 107.75 1ndz n THR 230 Ca -0.16 -0.41 0.14 0.00 -2.04 0.00 0.00 64.05 61.58 1ndz n THR 230 Cb 1.05 -1.74 0.68 0.00 -1.82 0.00 0.00 70.33 68.50 1ndz n THR 230 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1ndz n LEU 231 N -3.95 0.04 -3.21 -4.42 4.77 -0.81 -4.92 117.00 104.49 1ndz n LEU 231 Ca -0.50 0.35 -0.22 0.00 -0.03 0.00 0.00 56.01 55.61 1ndz n LEU 231 Cb 0.89 -0.37 0.06 0.00 -2.33 0.00 0.00 43.42 41.67 1ndz n LEU 231 CO 0.08 0.01 0.13 0.29 -1.33 0.00 0.00 177.39 176.57 1ndz n LYS 232 N -1.36 -6.37 -1.71 3.23 4.76 -0.80 -4.77 118.16 111.14 1ndz n LYS 232 Ca 0.11 0.83 -0.32 0.00 -2.87 0.00 0.00 58.31 56.06 1ndz n LYS 232 Cb 0.29 -5.71 0.05 0.00 -1.84 0.00 0.00 35.03 27.81 1ndz n LYS 232 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1ndz s THR 233 N -3.24 3.55 -0.14 -0.18 -1.32 -0.63 -4.89 115.64 108.79 1ndz s THR 233 Ca 0.44 0.64 0.19 0.00 -1.21 0.00 0.00 61.69 61.76 1ndz s THR 233 Cb -0.20 -3.19 -0.28 0.00 -1.51 0.00 0.00 72.50 67.32 1ndz s THR 233 CO 0.55 -0.52 0.24 -0.62 -2.21 0.00 0.00 174.62 172.05 1ndz n GLU 234 N -2.64 0.68 -4.07 7.08 1.02 0.93 -4.83 120.64 118.80 1ndz n GLU 234 Ca 0.09 -0.06 -0.08 0.00 -0.02 0.00 0.00 57.16 57.09 1ndz n GLU 234 Cb 0.53 -1.53 -0.10 0.00 -0.02 0.00 0.00 31.44 30.31 1ndz n GLU 234 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1ndz s ARG 235 N -2.85 0.55 -0.13 3.49 0.52 -1.04 -4.24 118.95 115.25 1ndz s ARG 235 Ca -0.09 -1.08 -0.04 0.00 -0.52 0.00 0.00 55.73 53.99 1ndz s ARG 235 Cb 0.09 0.17 -0.03 0.00 0.52 0.00 0.00 34.95 35.69 1ndz s ARG 235 CO 0.86 -0.09 0.01 -0.51 0.02 0.00 0.00 175.30 175.59 1ndz s LEU 236 N -2.58 3.58 -0.42 2.53 1.43 0.86 -3.09 118.68 120.99 1ndz s LEU 236 Ca 0.02 0.06 -0.29 0.00 -1.03 0.00 0.00 54.13 52.89 1ndz s LEU 236 Cb 0.04 -1.86 0.01 0.00 0.03 0.00 0.00 46.19 44.41 1ndz s LEU 236 CO -0.08 0.26 1.33 -0.83 0.23 0.00 0.00 176.35 177.26 1ndz s GLY 237 N -0.18 1.18 0.00 -3.19 0.00 0.44 -0.50 107.32 105.07 1ndz s GLY 237 Ca 0.05 -0.22 0.00 0.00 0.00 0.00 0.00 44.72 44.55 1ndz s GLY 237 CO 0.02 2.65 0.00 1.42 0.00 0.00 0.00 173.10 177.19 1ndz n HIS 238 N 8.44 0.00 -1.01 1.90 8.25 -0.31 -1.64 115.22 130.85 1ndz n HIS 238 Ca 0.15 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.61 1ndz n HIS 238 Cb 0.48 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.59 1ndz n HIS 238 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ndz n GLY 239 N 0.00 0.22 0.37 -1.41 0.00 0.42 -4.57 105.19 100.22 1ndz n GLY 239 Ca 0.00 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.13 1ndz n GLY 239 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1ndz h TYR 240 N 0.00 0.70 -0.06 1.61 0.05 -1.23 -1.67 116.97 116.38 1ndz h TYR 240 Ca -0.01 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1ndz h TYR 240 Cb 0.64 -0.22 0.00 0.00 1.01 0.00 0.00 36.73 38.15 1ndz h TYR 240 CO 0.40 0.29 0.00 0.72 -1.05 0.00 0.00 178.16 178.51 1ndz n HIS 241 N -4.52 0.07 -0.26 4.88 8.25 0.72 -2.92 115.22 121.44 1ndz n HIS 241 Ca 0.15 -0.04 0.10 0.00 -0.26 0.00 0.00 57.72 57.68 1ndz n HIS 241 Cb 0.43 0.00 0.36 0.00 1.12 0.00 0.00 29.99 31.90 1ndz n HIS 241 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1ndz h THR 242 N 0.74 0.89 -0.06 1.59 2.02 -1.54 -1.20 112.91 115.34 1ndz h THR 242 Ca 0.00 -0.25 0.02 0.00 0.77 0.00 0.00 66.41 66.95 1ndz h THR 242 Cb 0.16 0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 66.66 1ndz h THR 242 CO 0.00 0.13 0.08 -0.07 0.37 0.00 0.00 175.52 176.04 1ndz h LEU 243 N 0.73 0.00 0.00 2.58 3.38 -1.76 -2.73 115.31 117.51 1ndz h LEU 243 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 1ndz h LEU 243 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1ndz h LEU 243 CO -0.18 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.73 1ndz n GLU 244 N -3.67 0.60 -3.49 1.13 1.02 -0.45 -4.48 120.64 111.29 1ndz n GLU 244 Ca -0.01 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.92 1ndz n GLU 244 Cb 0.17 -1.26 -0.13 0.00 -0.02 0.00 0.00 31.44 30.21 1ndz n GLU 244 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1ndz s ASP 245 N -1.71 1.96 0.09 1.62 3.68 -1.03 -4.97 116.67 116.30 1ndz s ASP 245 Ca 0.15 -0.60 0.01 0.00 2.13 0.00 0.00 52.55 54.25 1ndz s ASP 245 Cb 0.07 0.21 -0.25 0.00 -1.45 0.00 0.00 42.92 41.50 1ndz s ASP 245 CO 0.11 -0.37 1.17 0.74 0.13 0.00 0.00 175.17 176.95 1ndz h THR 246 N 6.33 1.55 -0.27 1.71 2.02 -1.81 -1.49 112.91 120.95 1ndz h THR 246 Ca -0.16 -3.20 -0.10 0.00 0.77 0.00 0.00 66.41 63.72 1ndz h THR 246 Cb 1.11 2.87 -0.00 0.00 -1.74 0.00 0.00 68.15 70.39 1ndz h THR 246 CO 0.33 0.91 -0.23 0.74 0.37 0.00 0.00 175.52 177.63 1ndz h THR 247 N 0.04 1.31 0.23 3.16 2.02 -1.96 0.11 112.91 117.81 1ndz h THR 247 Ca -0.09 -1.39 -0.01 0.00 0.77 0.00 0.00 66.41 65.70 1ndz h THR 247 Cb 1.89 1.60 -0.01 0.00 -1.74 0.00 0.00 68.15 69.89 1ndz h THR 247 CO 0.16 0.44 -0.15 0.25 0.37 0.00 0.00 175.52 176.59 1ndz h LEU 248 N 0.36 -0.38 -0.85 2.58 5.85 -1.86 0.15 115.31 121.17 1ndz h LEU 248 Ca 0.05 0.03 0.14 0.00 0.84 0.00 0.00 57.88 58.93 1ndz h LEU 248 Cb 0.79 0.12 -0.14 0.00 0.37 0.00 0.00 40.66 41.79 1ndz h LEU 248 CO 0.06 -0.24 -0.37 0.22 -0.34 0.00 0.00 178.44 177.77 1ndz h TYR 249 N -0.38 -1.03 -0.75 1.25 -0.00 -1.24 0.25 116.97 115.08 1ndz h TYR 249 Ca -0.02 0.09 -0.05 0.00 -0.00 0.00 0.00 58.73 58.76 1ndz h TYR 249 Cb 0.32 0.58 -0.03 0.00 -0.00 0.00 0.00 36.73 37.59 1ndz h TYR 249 CO -0.10 -0.40 0.28 -0.91 -0.00 0.00 0.00 178.16 177.04 1ndz h ASN 250 N -0.06 1.03 -0.39 -2.11 -0.26 -0.56 -0.08 115.58 113.16 1ndz h ASN 250 Ca 0.31 -0.16 -0.09 0.00 -0.56 0.00 0.00 56.30 55.79 1ndz h ASN 250 Cb 0.58 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 37.55 1ndz h ASN 250 CO -0.88 0.93 -0.06 -0.09 -1.06 0.00 0.00 177.43 176.27 1ndz h ARG 251 N 1.09 0.82 -0.32 0.81 2.43 0.35 -1.46 114.38 118.10 1ndz h ARG 251 Ca 0.25 -0.25 -0.12 0.00 -0.81 0.00 0.00 59.98 59.05 1ndz h ARG 251 Cb 0.23 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1ndz h ARG 251 CO -0.02 0.86 -0.30 -0.07 -1.51 0.00 0.00 179.97 178.93 1ndz h LEU 252 N 0.75 0.71 -0.74 3.80 3.38 0.09 0.28 115.31 123.57 1ndz h LEU 252 Ca 0.13 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 57.88 1ndz h LEU 252 Cb 0.54 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 1ndz h LEU 252 CO 0.03 0.96 0.44 0.08 0.09 0.00 0.00 178.44 180.05 1ndz h ARG 253 N 0.58 0.80 -0.30 1.13 -0.00 -0.86 -2.00 114.38 113.75 1ndz h ARG 253 Ca 0.07 -0.05 -0.09 0.00 -0.00 0.00 0.00 59.98 59.91 1ndz h ARG 253 Cb 0.80 -0.18 -0.01 0.00 -0.00 0.00 0.00 29.97 30.58 1ndz h ARG 253 CO 0.07 0.53 -0.21 1.96 -0.00 0.00 0.00 179.97 182.32 1ndz h GLN 254 N 0.83 0.55 0.00 0.08 4.20 -0.83 -2.59 115.11 117.35 1ndz h GLN 254 Ca 0.32 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1ndz h GLN 254 Cb 0.14 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.88 1ndz h GLN 254 CO -0.16 0.73 0.00 0.39 -0.67 0.00 0.00 178.83 179.12 1ndz n GLU 255 N -4.14 0.98 -2.57 1.46 1.02 0.94 -4.92 120.64 113.41 1ndz n GLU 255 Ca 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 56.99 1ndz n GLU 255 Cb 0.39 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.32 1ndz n GLU 255 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1ndz n ASN 256 N -1.00 -4.61 -4.68 1.62 5.15 -0.79 -4.94 115.26 106.00 1ndz n ASN 256 Ca 0.24 -0.12 -0.44 0.00 -0.60 0.00 0.00 54.58 53.66 1ndz n ASN 256 Cb 0.11 -3.59 -0.02 0.00 -0.53 0.00 0.00 39.78 35.75 1ndz n ASN 256 CO 0.00 0.00 0.00 0.80 1.40 0.00 0.00 177.26 179.46 1ndz n MET 257 N -2.76 2.08 -3.42 1.20 0.00 -0.95 -4.86 117.12 108.41 1ndz n MET 257 Ca -0.12 0.74 -0.37 0.00 -0.00 0.00 0.00 57.70 57.95 1ndz n MET 257 Cb 0.60 -2.37 -0.06 0.00 0.00 0.00 0.00 33.22 31.39 1ndz n MET 257 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 1ndz s HIS 258 N -0.37 3.54 -0.22 1.12 2.46 -1.26 -4.23 115.29 116.34 1ndz s HIS 258 Ca 0.64 0.82 -0.06 0.00 0.47 0.00 0.00 55.06 56.93 1ndz s HIS 258 Cb -0.62 -2.43 -0.03 0.00 -0.13 0.00 0.00 32.58 29.37 1ndz s HIS 258 CO 0.53 0.29 0.03 -0.06 -2.47 0.00 0.00 174.74 173.06 1ndz s PHE 259 N 0.22 3.07 -1.06 3.88 0.40 -0.23 -0.09 117.98 124.16 1ndz s PHE 259 Ca 0.23 -0.43 -0.22 0.00 -0.60 0.00 0.00 56.93 55.90 1ndz s PHE 259 Cb -0.15 -2.14 0.05 0.00 0.51 0.00 0.00 43.02 41.29 1ndz s PHE 259 CO 0.09 -0.27 1.49 -1.21 0.70 0.00 0.00 175.22 176.02 1ndz s GLU 260 N 1.20 3.65 0.21 0.44 2.02 0.35 -1.92 118.70 124.65 1ndz s GLU 260 Ca 0.04 -1.25 -0.25 0.00 0.02 0.00 0.00 54.97 53.52 1ndz s GLU 260 Cb -0.14 -5.38 -0.08 0.00 0.10 0.00 0.00 34.13 28.62 1ndz s GLU 260 CO 0.02 -2.21 0.81 0.42 0.02 0.00 0.00 175.26 174.32 1ndz s ILE 261 N 4.85 4.35 -0.42 -1.63 -1.09 -0.28 -1.16 121.20 125.83 1ndz s ILE 261 Ca 0.47 1.68 0.02 0.00 -2.23 0.00 0.00 60.65 60.59 1ndz s ILE 261 Cb 0.01 -4.08 0.14 0.00 -1.58 0.00 0.00 42.46 36.94 1ndz s ILE 261 CO -0.07 0.40 0.25 0.00 -1.23 0.00 0.00 174.94 174.28 1ndz h PRO 263 N 6.66 0.24 -0.08 0.00 0.11 -1.94 -1.11 132.00 135.89 1ndz h PRO 263 Ca 0.05 -0.06 -0.14 0.00 0.11 0.00 0.00 66.00 65.97 1ndz h PRO 263 Cb 0.93 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 32.02 1ndz h PRO 263 CO 0.40 0.38 -0.49 2.35 -0.21 0.00 0.00 178.00 180.43 1ndz h TRP 264 N 0.06 0.65 -0.66 0.65 2.91 -1.91 -2.82 115.95 114.83 1ndz h TRP 264 Ca 0.05 -0.30 0.11 0.00 1.13 0.00 0.00 58.89 59.88 1ndz h TRP 264 Cb 0.24 -0.10 -0.11 0.00 -0.51 0.00 0.00 29.16 28.68 1ndz h TRP 264 CO 0.00 1.07 -0.23 0.45 -1.03 0.00 0.00 178.44 178.71 1ndz n SER 265 N -4.26 -0.38 -0.01 2.65 2.88 -1.22 -2.43 113.62 110.86 1ndz n SER 265 Ca -0.08 1.15 -0.01 0.00 -1.33 0.00 0.00 58.87 58.60 1ndz n SER 265 Cb 0.60 -0.29 0.26 0.00 -0.75 0.00 0.00 64.21 64.02 1ndz n SER 265 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1ndz h SER 266 N 0.00 0.51 0.24 -3.46 4.64 -0.94 0.16 113.55 114.70 1ndz h SER 266 Ca 0.26 -0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 61.45 1ndz h SER 266 Cb 0.42 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 1ndz h SER 266 CO -0.67 0.64 -0.16 0.22 -0.87 0.00 0.00 176.83 175.99 1ndz h TYR 267 N 0.50 -0.41 0.00 4.77 5.03 -1.38 -0.57 116.97 124.91 1ndz h TYR 267 Ca 0.10 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.41 1ndz h TYR 267 Cb 0.44 0.15 0.00 0.00 1.55 0.00 0.00 36.73 38.87 1ndz h TYR 267 CO 0.02 -0.25 0.00 1.28 -1.32 0.00 0.00 178.16 177.89 1ndz n LEU 268 N -5.28 0.08 -1.06 2.82 4.77 -0.92 -2.28 117.00 115.12 1ndz n LEU 268 Ca -0.09 0.51 0.10 0.00 -0.03 0.00 0.00 56.01 56.51 1ndz n LEU 268 Cb 0.20 -0.50 0.22 0.00 -2.33 0.00 0.00 43.42 41.01 1ndz n LEU 268 CO 0.33 -0.16 0.68 0.35 -1.33 0.00 0.00 177.39 177.26 1ndz n THR 269 N -1.58 0.66 -0.05 -5.08 -2.24 -0.00 -4.11 114.28 101.88 1ndz n THR 269 Ca 0.05 -0.83 0.00 0.00 -2.27 0.00 0.00 64.05 61.00 1ndz n THR 269 Cb 0.26 0.81 0.00 0.00 -2.10 0.00 0.00 70.33 69.30 1ndz n THR 269 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ndz n GLY 270 N 1.30 1.82 0.37 3.38 0.00 -0.97 -4.88 105.19 106.22 1ndz n GLY 270 Ca 0.18 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.43 1ndz n GLY 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ndz h ALA 271 N 0.00 2.04 -3.30 4.61 0.00 -1.56 -3.39 119.26 117.67 1ndz h ALA 271 Ca 0.00 0.13 -0.59 0.00 0.00 0.00 0.00 54.91 54.44 1ndz h ALA 271 Cb 0.00 0.08 -0.34 0.00 0.00 0.00 0.00 17.79 17.52 1ndz h ALA 271 CO 0.00 -0.55 -0.84 -0.46 0.00 0.00 0.00 179.25 177.40 1ndz s TRP 272 N -5.63 2.02 -0.27 0.00 -0.00 -0.32 -4.94 118.94 109.80 1ndz s TRP 272 Ca -0.10 -0.91 -0.11 0.00 -0.00 0.00 0.00 56.10 54.98 1ndz s TRP 272 Cb 0.28 -1.43 -0.05 0.00 -0.00 0.00 0.00 33.47 32.27 1ndz s TRP 272 CO 0.80 -0.45 0.21 -1.59 -0.00 0.00 0.00 176.95 175.92 1ndz s LYS 273 N 0.84 3.98 0.36 5.86 0.00 -1.26 -4.42 119.74 125.10 1ndz s LYS 273 Ca -0.10 -0.27 0.22 0.00 0.00 0.00 0.00 55.97 55.83 1ndz s LYS 273 Cb -0.15 -3.64 1.21 0.00 0.00 0.00 0.00 37.83 35.24 1ndz s LYS 273 CO 0.01 -0.15 1.66 -1.00 0.00 0.00 0.00 175.35 175.87 1ndz h PRO 274 N 8.21 0.00 0.00 1.78 0.13 -1.95 -0.58 132.00 139.59 1ndz h PRO 274 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1ndz h PRO 274 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1ndz h PRO 274 CO 0.58 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.10 1ndz n ASP 275 N -2.31 0.00 -4.39 1.44 10.43 -1.26 -4.86 116.55 115.60 1ndz n ASP 275 Ca -0.01 -0.80 -0.19 0.00 2.57 0.00 0.00 54.79 56.35 1ndz n ASP 275 Cb 0.10 0.00 -0.10 0.00 1.84 0.00 0.00 41.12 42.96 1ndz n ASP 275 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 1ndz s THR 276 N -2.00 1.28 0.00 -3.53 -1.32 -0.23 -5.11 115.64 104.73 1ndz s THR 276 Ca 0.08 -2.06 0.00 0.00 -1.21 0.00 0.00 61.69 58.50 1ndz s THR 276 Cb 0.04 -2.47 0.00 0.00 -1.51 0.00 0.00 72.50 68.56 1ndz s THR 276 CO 0.06 -0.26 0.00 -1.84 -2.21 0.00 0.00 174.62 170.38 1ndz n GLU 277 N -0.53 0.00 -2.59 7.08 -0.00 -1.26 -4.92 120.64 118.42 1ndz n GLU 277 Ca -0.05 0.00 -0.42 0.00 -0.00 0.00 0.00 57.16 56.69 1ndz n GLU 277 Cb 0.64 0.00 -0.03 0.00 -0.00 0.00 0.00 31.44 32.06 1ndz n GLU 277 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 1ndz s HIS 278 N 0.00 3.41 0.00 -1.84 5.65 -1.26 -4.89 115.29 116.35 1ndz s HIS 278 Ca 0.00 1.45 0.00 0.00 0.25 0.00 0.00 55.06 56.76 1ndz s HIS 278 Cb 0.00 -3.28 0.00 0.00 -1.18 0.00 0.00 32.58 28.12 1ndz s HIS 278 CO 0.00 -0.68 0.00 0.00 -0.65 0.00 0.00 174.74 173.41 1ndz n ALA 279 N 4.85 0.00 0.25 1.58 0.00 -1.26 -0.08 120.51 125.85 1ndz n ALA 279 Ca 0.09 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.62 1ndz n ALA 279 Cb 0.48 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.57 1ndz n ALA 279 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1ndz h VAL 280 N 0.00 0.94 -0.56 0.00 3.04 -1.99 -1.18 116.25 116.51 1ndz h VAL 280 Ca 0.00 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 1ndz h VAL 280 Cb 0.00 1.15 -0.03 0.00 -2.01 0.00 0.00 31.29 30.41 1ndz h VAL 280 CO 0.00 0.08 0.36 -0.29 -1.01 0.00 0.00 177.57 176.71 1ndz h ILE 281 N 0.00 1.15 -0.79 3.17 6.09 -0.87 0.30 117.51 126.56 1ndz h ILE 281 Ca -0.00 -0.28 0.06 0.00 -1.37 0.00 0.00 64.86 63.27 1ndz h ILE 281 Cb 0.15 0.34 -0.06 0.00 0.47 0.00 0.00 36.82 37.72 1ndz h ILE 281 CO 0.01 0.14 0.47 -0.09 -3.07 0.00 0.00 178.15 175.62 1ndz h ARG 282 N 0.75 0.83 -0.21 2.19 9.65 -1.23 -2.22 114.38 124.14 1ndz h ARG 282 Ca 0.20 -0.05 -0.06 0.00 -1.10 0.00 0.00 59.98 58.97 1ndz h ARG 282 Cb -0.07 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 28.31 1ndz h ARG 282 CO -0.04 0.55 -0.15 0.74 2.80 0.00 0.00 179.97 183.87 1ndz h PHE 283 N 0.86 0.37 -0.37 2.20 0.04 -0.28 -1.02 116.94 118.74 1ndz h PHE 283 Ca 0.35 -0.05 -0.07 0.00 2.80 0.00 0.00 57.97 60.99 1ndz h PHE 283 Cb 0.20 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.23 1ndz h PHE 283 CO -0.05 0.49 -0.08 -0.22 -0.60 0.00 0.00 178.31 177.85 1ndz h LYS 284 N 0.32 0.63 0.00 1.51 3.64 0.14 -2.33 116.57 120.49 1ndz h LYS 284 Ca 0.06 -0.18 -0.06 0.00 -1.27 0.00 0.00 60.65 59.20 1ndz h LYS 284 Cb 0.46 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1ndz h LYS 284 CO 0.03 0.71 -0.30 -0.91 -2.27 0.00 0.00 179.45 176.71 1ndz h ASN 285 N 0.58 0.00 -0.22 4.20 2.35 -0.93 -2.81 115.58 118.75 1ndz h ASN 285 Ca 0.11 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1ndz h ASN 285 Cb 0.49 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1ndz h ASN 285 CO 0.03 0.30 0.00 0.47 -1.65 0.00 0.00 177.43 176.57 1ndz n ASP 286 N -3.43 2.17 -2.95 5.81 10.43 -0.43 -4.94 116.55 123.19 1ndz n ASP 286 Ca 0.00 -1.79 -0.20 0.00 2.57 0.00 0.00 54.79 55.36 1ndz n ASP 286 Cb 0.48 -0.14 0.01 0.00 1.84 0.00 0.00 41.12 43.31 1ndz n ASP 286 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1ndz n GLN 287 N 0.66 -3.51 -1.08 -1.24 3.00 -1.01 -4.96 117.38 109.24 1ndz n GLN 287 Ca 0.17 0.71 -0.32 0.00 -0.01 0.00 0.00 57.00 57.55 1ndz n GLN 287 Cb 0.41 -5.44 0.12 0.00 0.00 0.00 0.00 30.24 25.33 1ndz n GLN 287 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1ndz s VAL 288 N -2.96 2.63 -0.69 5.09 1.01 -0.91 -4.95 120.40 119.62 1ndz s VAL 288 Ca 0.24 0.22 -0.22 0.00 0.00 0.00 0.00 61.98 62.23 1ndz s VAL 288 Cb -0.12 -2.53 0.08 0.00 0.00 0.00 0.00 36.38 33.82 1ndz s VAL 288 CO 0.30 -0.24 0.96 0.21 0.00 0.00 0.00 175.10 176.32 1ndz s ASN 289 N -2.82 6.23 0.22 3.32 2.47 -1.26 -4.94 114.94 118.16 1ndz s ASN 289 Ca 0.66 -1.18 -0.04 0.00 0.42 0.00 0.00 52.86 52.72 1ndz s ASN 289 Cb -0.22 -2.40 -0.03 0.00 -1.45 0.00 0.00 41.25 37.15 1ndz s ASN 289 CO 0.54 -1.36 0.23 -0.72 -3.72 0.00 0.00 177.10 172.07 1ndz s TYR 290 N 3.74 0.96 0.32 0.43 1.13 -1.26 -1.06 117.35 121.61 1ndz s TYR 290 Ca 0.22 -1.21 0.03 0.00 -1.41 0.00 0.00 57.07 54.70 1ndz s TYR 290 Cb -0.16 -0.36 -0.04 0.00 -1.10 0.00 0.00 41.96 40.29 1ndz s TYR 290 CO 0.07 -0.74 0.12 -1.54 -2.51 0.00 0.00 175.55 170.95 1ndz s SER 291 N -3.13 1.92 -0.03 -0.18 1.04 -0.81 -4.56 113.70 107.95 1ndz s SER 291 Ca 0.35 -1.52 0.06 0.00 0.48 0.00 0.00 55.95 55.32 1ndz s SER 291 Cb 0.05 0.28 -0.02 0.00 0.10 0.00 0.00 66.02 66.43 1ndz s SER 291 CO 0.12 -0.82 -0.21 -0.76 0.98 0.00 0.00 173.24 172.55 1ndz s LEU 292 N -3.44 2.36 0.16 2.42 1.02 -1.26 -1.12 118.68 118.82 1ndz s LEU 292 Ca 0.33 -0.34 -0.15 0.00 0.02 0.00 0.00 54.13 53.99 1ndz s LEU 292 Cb 0.06 -1.44 0.02 0.00 0.02 0.00 0.00 46.19 44.85 1ndz s LEU 292 CO 0.16 0.33 0.41 0.20 0.02 0.00 0.00 176.35 177.47 1ndz s ASN 293 N -0.65 -0.16 -0.18 2.29 0.01 0.23 -4.72 114.94 111.75 1ndz s ASN 293 Ca 0.10 -0.52 0.18 0.00 -0.71 0.00 0.00 52.86 51.92 1ndz s ASN 293 Cb -0.10 0.50 -0.26 0.00 0.41 0.00 0.00 41.25 41.79 1ndz s ASN 293 CO -0.00 -0.93 0.12 0.35 -1.51 0.00 0.00 177.10 175.12 1ndz n THR 294 N -0.26 1.25 0.00 1.60 -2.24 -1.24 -4.17 114.28 109.22 1ndz n THR 294 Ca -0.12 -0.82 0.00 0.00 -2.27 0.00 0.00 64.05 60.84 1ndz n THR 294 Cb 0.63 -0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 1ndz n THR 294 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1ndz n ASP 295 N -2.70 0.00 -3.02 3.42 4.64 -0.63 -4.28 116.55 113.98 1ndz n ASP 295 Ca -0.30 0.00 -0.16 0.00 -1.38 0.00 0.00 54.79 52.96 1ndz n ASP 295 Cb 1.10 0.00 -0.03 0.00 -1.04 0.00 0.00 41.12 41.15 1ndz n ASP 295 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 1ndz n ASP 296 N 2.20 -1.73 -0.36 1.67 8.00 -1.26 -0.09 116.55 124.99 1ndz n ASP 296 Ca 0.00 -2.82 0.08 0.00 0.71 0.00 0.00 54.79 52.76 1ndz n ASP 296 Cb 0.00 0.62 0.25 0.00 -0.02 0.00 0.00 41.12 41.98 1ndz n ASP 296 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1ndz h PRO 297 N 4.70 0.92 -0.62 -0.24 0.13 -1.73 0.12 132.00 135.28 1ndz h PRO 297 Ca 0.07 -0.06 0.06 0.00 -0.87 0.00 0.00 66.00 65.20 1ndz h PRO 297 Cb 0.99 -0.21 -0.09 0.00 0.13 0.00 0.00 31.00 31.82 1ndz h PRO 297 CO 0.28 0.61 -0.50 1.25 -0.23 0.00 0.00 178.00 179.41 1ndz h LEU 298 N 0.95 -1.76 -0.56 1.56 5.85 -1.78 0.45 115.31 120.03 1ndz h LEU 298 Ca 0.51 0.25 -0.08 0.00 0.84 0.00 0.00 57.88 59.40 1ndz h LEU 298 Cb 0.56 0.75 -0.02 0.00 0.37 0.00 0.00 40.66 42.32 1ndz h LEU 298 CO -0.29 -0.27 0.03 0.40 -0.34 0.00 0.00 178.44 177.98 1ndz h ILE 299 N -0.16 1.26 -0.53 4.05 2.04 -1.64 -3.04 117.51 119.49 1ndz h ILE 299 Ca 0.10 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 64.90 1ndz h ILE 299 Cb 0.43 0.85 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1ndz h ILE 299 CO -0.67 0.38 0.00 0.49 0.00 0.00 0.00 178.15 178.35 1ndz n PHE 300 N -4.28 1.14 -2.75 1.37 3.72 0.39 -0.55 117.46 116.50 1ndz n PHE 300 Ca 0.02 -0.47 -0.20 0.00 -0.05 0.00 0.00 57.45 56.75 1ndz n PHE 300 Cb 0.31 -0.18 0.02 0.00 -0.94 0.00 0.00 39.48 38.69 1ndz n PHE 300 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1ndz n LYS 301 N 0.91 -3.50 -4.34 -1.08 5.02 0.12 -4.82 118.16 110.47 1ndz n LYS 301 Ca 0.20 0.88 -0.19 0.00 -2.02 0.00 0.00 58.31 57.18 1ndz n LYS 301 Cb 0.70 -5.56 -0.09 0.00 -0.02 0.00 0.00 35.03 30.07 1ndz n LYS 301 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1ndz s SER 302 N -2.51 1.64 0.28 4.39 1.04 0.73 -5.01 113.70 114.25 1ndz s SER 302 Ca 0.18 -1.58 0.06 0.00 0.48 0.00 0.00 55.95 55.09 1ndz s SER 302 Cb -0.08 0.41 -0.02 0.00 0.10 0.00 0.00 66.02 66.42 1ndz s SER 302 CO 0.22 -0.90 0.22 0.35 0.98 0.00 0.00 173.24 174.11 1ndz n THR 303 N -0.61 0.00 0.00 2.02 -2.24 -1.26 -4.59 114.28 107.60 1ndz n THR 303 Ca 0.01 -1.98 -0.01 0.00 -2.27 0.00 0.00 64.05 59.80 1ndz n THR 303 Cb 0.65 0.97 0.28 0.00 -2.10 0.00 0.00 70.33 70.13 1ndz n THR 303 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1ndz h LEU 304 N 0.00 0.49 -2.00 3.22 5.85 -1.96 0.37 115.31 121.28 1ndz h LEU 304 Ca -0.20 -0.10 0.19 0.00 0.84 0.00 0.00 57.88 58.61 1ndz h LEU 304 Cb 0.98 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.85 1ndz h LEU 304 CO 0.29 0.58 0.49 -0.78 -0.34 0.00 0.00 178.44 178.69 1ndz h ASP 305 N 0.49 0.00 -0.15 1.25 3.58 -1.96 0.06 116.42 119.68 1ndz h ASP 305 Ca 0.10 0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.59 1ndz h ASP 305 Cb 0.38 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.39 1ndz h ASP 305 CO 0.02 0.00 -0.08 0.74 -2.88 0.00 0.00 179.24 177.04 1ndz h THR 306 N 0.00 0.75 -0.01 2.25 2.02 -1.30 0.67 112.91 117.28 1ndz h THR 306 Ca 0.31 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.41 1ndz h THR 306 Cb 1.29 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 1ndz h THR 306 CO -0.00 0.00 -0.39 0.44 0.37 0.00 0.00 175.52 175.94 1ndz h ASP 307 N -0.07 0.03 -0.00 4.18 5.19 -1.09 0.91 116.42 125.56 1ndz h ASP 307 Ca 0.08 -0.01 -0.11 0.00 -0.62 0.00 0.00 57.03 56.38 1ndz h ASP 307 Cb 0.20 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.69 1ndz h ASP 307 CO -0.19 0.42 -0.31 1.88 -3.12 0.00 0.00 179.24 177.91 1ndz h TYR 308 N 0.02 0.52 -0.12 4.55 -1.99 -0.83 -2.03 116.97 117.10 1ndz h TYR 308 Ca -0.00 -0.13 -0.14 0.00 2.00 0.00 0.00 58.73 60.47 1ndz h TYR 308 Cb 0.70 -0.12 -0.01 0.00 2.00 0.00 0.00 36.73 39.30 1ndz h TYR 308 CO 0.00 0.72 -0.53 1.96 -0.00 0.00 0.00 178.16 180.31 1ndz h GLN 309 N 0.39 0.34 0.29 4.88 1.08 0.14 -1.19 115.11 121.04 1ndz h GLN 309 Ca 0.05 -0.20 -0.01 0.00 -1.45 0.00 0.00 58.65 57.03 1ndz h GLN 309 Cb 0.75 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 28.20 1ndz h GLN 309 CO 0.06 0.78 -0.16 1.98 -0.95 0.00 0.00 178.83 180.54 1ndz h MET 310 N 0.26 -0.40 -0.60 1.46 4.05 -0.67 0.25 114.93 119.27 1ndz h MET 310 Ca 0.01 0.03 -0.02 0.00 -0.28 0.00 0.00 59.70 59.43 1ndz h MET 310 Cb 1.02 0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.88 1ndz h MET 310 CO 0.09 -0.27 0.29 1.79 0.23 0.00 0.00 176.91 179.04 1ndz h THR 311 N -0.42 1.21 -0.08 -0.77 1.35 -1.39 0.42 112.91 113.23 1ndz h THR 311 Ca -0.03 -0.60 -0.00 0.00 -0.55 0.00 0.00 66.41 65.22 1ndz h THR 311 Cb 0.34 0.50 -0.00 0.00 -1.73 0.00 0.00 68.15 67.25 1ndz h THR 311 CO 0.04 0.25 0.05 0.50 -0.25 0.00 0.00 175.52 176.10 1ndz h LYS 312 N 0.83 0.11 -0.03 4.72 3.64 -1.11 -0.51 116.57 124.22 1ndz h LYS 312 Ca 0.21 -0.01 -0.21 0.00 -1.27 0.00 0.00 60.65 59.37 1ndz h LYS 312 Cb 0.12 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1ndz h LYS 312 CO -0.03 0.14 -0.85 0.87 -2.27 0.00 0.00 179.45 177.32 1ndz h LYS 313 N 0.05 0.40 0.00 1.90 1.79 -0.37 -0.99 116.57 119.35 1ndz h LYS 313 Ca 0.03 -0.39 0.00 0.00 -2.18 0.00 0.00 60.65 58.11 1ndz h LYS 313 Cb 0.06 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.81 1ndz h LYS 313 CO -0.00 1.05 -1.76 -0.25 -1.08 0.00 0.00 179.45 177.41 1ndz n ASP 314 N -3.78 0.45 0.00 0.86 10.43 0.13 -4.57 116.55 120.07 1ndz n ASP 314 Ca -0.06 -0.17 0.00 0.00 2.57 0.00 0.00 54.79 57.14 1ndz n ASP 314 Cb 0.78 1.77 0.00 0.00 1.84 0.00 0.00 41.12 45.51 1ndz n ASP 314 CO 0.00 0.00 0.00 0.23 -1.07 0.00 0.00 177.20 176.36 1ndz n MET 315 N -2.08 0.47 -2.33 -1.24 2.81 -0.83 -5.02 117.12 108.89 1ndz n MET 315 Ca -0.02 -0.19 -0.13 0.00 -1.81 0.00 0.00 57.70 55.54 1ndz n MET 315 Cb 0.49 -0.64 -0.00 0.00 -0.71 0.00 0.00 33.22 32.36 1ndz n MET 315 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ndz n GLY 316 N 0.12 -0.13 3.76 3.03 0.00 -0.30 -4.93 105.19 106.75 1ndz n GLY 316 Ca 0.00 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.31 1ndz n GLY 316 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ndz s PHE 317 N -2.69 2.72 0.42 1.61 0.40 -0.62 -4.97 117.98 114.85 1ndz s PHE 317 Ca 0.04 1.45 0.07 0.00 -0.60 0.00 0.00 56.93 57.89 1ndz s PHE 317 Cb -0.02 -3.59 -0.04 0.00 0.51 0.00 0.00 43.02 39.89 1ndz s PHE 317 CO 0.05 -2.05 0.25 0.95 0.70 0.00 0.00 175.22 175.12 1ndz s THR 318 N -1.38 2.42 0.19 0.64 -4.23 -1.26 -4.51 115.64 107.51 1ndz s THR 318 Ca 0.63 -1.57 -0.12 0.00 -1.18 0.00 0.00 61.69 59.44 1ndz s THR 318 Cb -0.35 -2.99 0.09 0.00 1.34 0.00 0.00 72.50 70.59 1ndz s THR 318 CO 0.43 0.00 1.78 -0.08 -0.54 0.00 0.00 174.62 176.21 1ndz h GLU 319 N 1.28 0.50 0.00 3.99 4.81 -1.95 -1.20 114.58 122.01 1ndz h GLU 319 Ca -0.42 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 58.74 1ndz h GLU 319 Cb 1.26 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.52 1ndz h GLU 319 CO 0.66 0.33 -0.15 0.93 -0.73 0.00 0.00 179.01 180.04 1ndz h GLU 320 N 0.51 0.00 -0.81 1.92 5.08 -2.00 -1.23 114.58 118.07 1ndz h GLU 320 Ca 0.24 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.62 1ndz h GLU 320 Cb 0.17 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 1ndz h GLU 320 CO -0.18 0.15 0.53 0.93 -1.00 0.00 0.00 179.01 179.44 1ndz h GLU 321 N 0.00 1.03 -0.82 2.33 4.39 -1.91 -0.71 114.58 118.88 1ndz h GLU 321 Ca -0.00 -0.06 0.04 0.00 0.34 0.00 0.00 59.36 59.67 1ndz h GLU 321 Cb 0.95 -0.23 -0.05 0.00 -0.10 0.00 0.00 28.75 29.32 1ndz h GLU 321 CO 0.02 0.68 0.54 0.74 -1.16 0.00 0.00 179.01 179.83 1ndz h PHE 322 N 1.06 0.98 -0.08 4.33 0.05 -0.39 -0.83 116.94 122.06 1ndz h PHE 322 Ca 0.31 0.02 -0.00 0.00 3.82 0.00 0.00 57.97 62.12 1ndz h PHE 322 Cb -0.07 -0.33 -0.00 0.00 2.00 0.00 0.00 35.95 37.54 1ndz h PHE 322 CO -0.02 0.57 0.04 0.87 -0.18 0.00 0.00 178.31 179.59 1ndz h LYS 323 N 1.02 0.11 -0.39 1.51 1.57 -1.05 -1.82 116.57 117.52 1ndz h LYS 323 Ca 0.33 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 59.16 1ndz h LYS 323 Cb 0.04 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.27 1ndz h LYS 323 CO -0.10 0.19 0.05 -0.09 -0.57 0.00 0.00 179.45 178.93 1ndz h ARG 324 N 0.00 0.16 0.00 3.15 2.43 -0.49 -1.16 114.38 118.47 1ndz h ARG 324 Ca 0.03 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.10 1ndz h ARG 324 Cb 0.11 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1ndz h ARG 324 CO -0.00 0.11 -0.42 1.37 -1.51 0.00 0.00 179.97 179.51 1ndz h LEU 325 N 0.16 0.00 -0.97 3.80 -0.00 -1.12 0.23 115.31 117.42 1ndz h LEU 325 Ca 0.19 0.00 -0.11 0.00 -0.00 0.00 0.00 57.88 57.96 1ndz h LEU 325 Cb 0.24 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.89 1ndz h LEU 325 CO -0.28 0.42 -0.46 0.78 -0.00 0.00 0.00 178.44 178.91 1ndz h ASN 326 N 0.00 0.14 -0.72 0.17 2.35 -0.67 0.17 115.58 117.02 1ndz h ASN 326 Ca -0.00 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.67 1ndz h ASN 326 Cb 0.98 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 39.27 1ndz h ASN 326 CO 0.05 0.58 0.39 0.40 -1.65 0.00 0.00 177.43 177.20 1ndz h ILE 327 N 0.11 1.22 -0.56 2.81 1.08 -0.84 -1.34 117.51 119.99 1ndz h ILE 327 Ca 0.01 -0.57 -0.08 0.00 -0.39 0.00 0.00 64.86 63.83 1ndz h ILE 327 Cb 0.85 0.28 -0.02 0.00 -3.07 0.00 0.00 36.82 34.86 1ndz h ILE 327 CO 0.07 0.25 0.05 0.78 -0.69 0.00 0.00 178.15 178.60 1ndz h ASN 328 N 1.00 0.89 -0.67 1.72 2.35 -0.77 0.11 115.58 120.20 1ndz h ASN 328 Ca 0.25 -0.21 0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1ndz h ASN 328 Cb 0.05 -0.24 -0.04 0.00 0.05 0.00 0.00 38.32 38.15 1ndz h ASN 328 CO -0.04 0.92 0.44 0.00 -1.65 0.00 0.00 177.43 177.10 1ndz h ALA 329 N 1.18 0.86 -0.27 -0.83 0.00 -0.43 -0.87 119.26 118.90 1ndz h ALA 329 Ca 0.17 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1ndz h ALA 329 Cb 0.44 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1ndz h ALA 329 CO 0.02 0.25 -0.20 0.00 0.00 0.00 0.00 179.25 179.32 1ndz h ALA 330 N 1.26 0.39 -0.88 0.00 0.00 -0.85 -0.66 119.26 118.51 1ndz h ALA 330 Ca 0.25 -0.36 0.14 0.00 0.00 0.00 0.00 54.91 54.94 1ndz h ALA 330 Cb -0.07 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.56 1ndz h ALA 330 CO -0.07 0.33 0.57 0.87 0.00 0.00 0.00 179.25 180.95 1ndz h LYS 331 N 0.34 0.68 -0.58 0.00 1.57 -0.73 -1.85 116.57 116.01 1ndz h LYS 331 Ca 0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1ndz h LYS 331 Cb 0.75 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1ndz h LYS 331 CO 0.05 0.45 0.00 0.43 -0.57 0.00 0.00 179.45 179.81 1ndz n SER 332 N -4.56 3.24 -4.68 0.86 7.64 -0.34 -4.96 113.62 110.82 1ndz n SER 332 Ca 0.17 -2.15 -0.30 0.00 1.01 0.00 0.00 58.87 57.61 1ndz n SER 332 Cb 0.45 -0.42 0.16 0.00 -1.01 0.00 0.00 64.21 63.39 1ndz n SER 332 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ndz s SER 333 N -0.91 3.05 -0.41 6.43 1.04 -0.28 -4.93 113.70 117.68 1ndz s SER 333 Ca 0.37 1.61 0.02 0.00 0.48 0.00 0.00 55.95 58.43 1ndz s SER 333 Cb 0.21 -2.26 0.50 0.00 0.10 0.00 0.00 66.02 64.57 1ndz s SER 333 CO 0.22 -2.92 1.82 0.49 0.98 0.00 0.00 173.24 173.83 1ndz n PHE 334 N -4.08 2.56 -2.93 5.02 3.72 -1.26 -4.98 117.46 115.51 1ndz n PHE 334 Ca 0.07 -1.88 -0.26 0.00 -0.05 0.00 0.00 57.45 55.33 1ndz n PHE 334 Cb 0.54 -0.94 -0.01 0.00 -0.94 0.00 0.00 39.48 38.14 1ndz n PHE 334 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1ndz s LEU 335 N -2.82 3.79 0.46 4.37 1.43 -1.26 -4.90 118.68 119.75 1ndz s LEU 335 Ca 0.48 0.77 -0.21 0.00 -1.03 0.00 0.00 54.13 54.15 1ndz s LEU 335 Cb 0.40 -3.69 -0.12 0.00 0.03 0.00 0.00 46.19 42.81 1ndz s LEU 335 CO 0.07 -0.45 0.48 -2.65 0.23 0.00 0.00 176.35 174.02 1ndz n PRO 336 N -1.97 0.50 -0.10 1.29 -0.02 -1.26 -4.60 135.00 128.84 1ndz n PRO 336 Ca -0.01 0.19 0.02 0.00 -2.02 0.00 0.00 63.50 61.67 1ndz n PRO 336 Cb 0.55 -1.49 0.32 0.00 -0.02 0.00 0.00 33.50 32.86 1ndz n PRO 336 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1ndz h GLU 337 N 0.61 0.76 -0.49 -0.52 4.57 -1.98 0.21 114.58 117.74 1ndz h GLU 337 Ca -0.41 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 57.71 1ndz h GLU 337 Cb 1.40 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 29.81 1ndz h GLU 337 CO 0.50 0.53 0.32 0.38 -1.18 0.00 0.00 179.01 179.56 1ndz h ASP 338 N 0.77 0.55 0.06 1.04 -0.00 -2.01 -1.89 116.42 114.94 1ndz h ASP 338 Ca 0.20 -0.01 -0.08 0.00 -0.00 0.00 0.00 57.03 57.14 1ndz h ASP 338 Cb -0.03 -0.13 -0.01 0.00 -0.00 0.00 0.00 39.33 39.16 1ndz h ASP 338 CO -0.04 0.40 -0.25 -0.33 -0.00 0.00 0.00 179.24 179.01 1ndz h GLU 339 N 0.65 0.33 -0.20 4.15 5.08 -1.64 -2.88 114.58 120.07 1ndz h GLU 339 Ca 0.18 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1ndz h GLU 339 Cb -0.07 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1ndz h GLU 339 CO -0.04 0.57 0.01 -0.22 -1.00 0.00 0.00 179.01 178.32 1ndz h LYS 340 N 0.29 0.35 -0.57 2.33 3.64 -0.45 -0.56 116.57 121.60 1ndz h LYS 340 Ca 0.05 -0.11 0.10 0.00 -1.27 0.00 0.00 60.65 59.41 1ndz h LYS 340 Cb 0.61 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.36 1ndz h LYS 340 CO 0.04 0.54 0.38 0.87 -2.27 0.00 0.00 179.45 179.01 1ndz h LYS 341 N 0.12 0.36 -0.14 1.90 6.56 -1.17 -1.46 116.57 122.74 1ndz h LYS 341 Ca 0.06 -0.02 -0.04 0.00 -1.06 0.00 0.00 60.65 59.59 1ndz h LYS 341 Cb 0.37 -0.08 -0.00 0.00 -0.57 0.00 0.00 32.23 31.95 1ndz h LYS 341 CO 0.01 0.24 -0.05 0.93 -2.06 0.00 0.00 179.45 178.51 1ndz h GLU 342 N 0.37 0.29 -0.79 3.15 5.08 -1.39 0.44 114.58 121.74 1ndz h GLU 342 Ca 0.26 -0.12 0.13 0.00 -1.00 0.00 0.00 59.36 58.63 1ndz h GLU 342 Cb 0.54 -0.01 -0.14 0.00 0.50 0.00 0.00 28.75 29.64 1ndz h GLU 342 CO -0.07 0.60 -0.35 1.25 -1.00 0.00 0.00 179.01 179.44 1ndz h LEU 343 N -0.04 -1.26 -0.35 1.33 5.85 -0.86 -0.84 115.31 119.14 1ndz h LEU 343 Ca 0.03 0.27 -0.02 0.00 0.84 0.00 0.00 57.88 59.00 1ndz h LEU 343 Cb 0.50 0.65 -0.02 0.00 0.37 0.00 0.00 40.66 42.17 1ndz h LEU 343 CO 0.02 -0.30 0.14 -0.07 -0.34 0.00 0.00 178.44 177.89 1ndz h LEU 344 N -0.08 0.49 -0.09 2.25 3.38 -1.06 0.96 115.31 121.16 1ndz h LEU 344 Ca 0.29 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 58.14 1ndz h LEU 344 Cb 0.58 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 1ndz h LEU 344 CO -0.83 0.53 -0.26 -0.78 0.09 0.00 0.00 178.44 177.19 1ndz h ASP 345 N 0.43 -0.79 -0.45 -0.43 3.58 -0.82 0.42 116.42 118.36 1ndz h ASP 345 Ca 0.12 0.12 0.08 0.00 0.42 0.00 0.00 57.03 57.77 1ndz h ASP 345 Cb 0.19 0.34 -0.10 0.00 1.72 0.00 0.00 39.33 41.48 1ndz h ASP 345 CO -0.01 -0.31 -0.38 0.25 -2.88 0.00 0.00 179.24 175.91 1ndz h LEU 346 N -0.34 -1.28 -0.33 2.28 5.85 -0.87 -0.01 115.31 120.60 1ndz h LEU 346 Ca 0.09 0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.99 1ndz h LEU 346 Cb 0.48 0.59 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1ndz h LEU 346 CO -0.29 -0.34 0.06 -0.07 -0.34 0.00 0.00 178.44 177.46 1ndz h LEU 347 N -0.27 0.52 -1.42 2.25 4.07 -0.41 -1.82 115.31 118.23 1ndz h LEU 347 Ca 0.17 -0.25 -0.02 0.00 0.08 0.00 0.00 57.88 57.86 1ndz h LEU 347 Cb 0.56 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.15 1ndz h LEU 347 CO -0.59 0.64 0.17 1.88 -1.08 0.00 0.00 178.44 179.45 1ndz h TYR 348 N 0.38 0.55 -0.14 1.13 0.05 0.19 -1.44 116.97 117.70 1ndz h TYR 348 Ca 0.10 -0.01 0.04 0.00 0.05 0.00 0.00 58.73 58.90 1ndz h TYR 348 Cb 0.33 -0.18 -0.04 0.00 1.01 0.00 0.00 36.73 37.86 1ndz h TYR 348 CO 0.02 0.43 -0.10 0.87 -1.05 0.00 0.00 178.16 178.33 1ndz h LYS 349 N 0.56 -0.10 -0.80 4.88 1.57 -0.22 -2.87 116.57 119.59 1ndz h LYS 349 Ca 0.14 0.01 0.17 0.00 -1.87 0.00 0.00 60.65 59.09 1ndz h LYS 349 Cb 0.10 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.38 1ndz h LYS 349 CO -0.02 -0.07 0.53 0.00 -0.57 0.00 0.00 179.45 179.33 1ndz h ALA 350 N 1.00 2.15 0.00 3.86 0.00 -1.15 -2.77 119.26 122.35 1ndz h ALA 350 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ndz h ALA 350 Cb 0.24 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ndz h ALA 350 CO -0.21 -0.37 0.00 0.66 0.00 0.00 0.00 179.25 179.33 1ndz n TYR 351 N -4.48 0.16 1.88 0.00 0.53 -0.56 -4.99 117.16 109.70 1ndz n TYR 351 Ca 0.16 0.05 0.15 0.00 -1.02 0.00 0.00 57.90 57.24 1ndz n TYR 351 Cb 0.58 -0.58 0.89 0.00 -1.03 0.00 0.00 39.34 39.21 1ndz n TYR 351 CO 0.00 0.00 0.00 -2.13 -1.02 0.00 0.00 176.86 173.71