#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wri s ASN 3 N 0.00 1.25 0.00 1.61 4.22 -1.26 -5.12 114.94 115.64 2wri s ASN 3 Ca 0.00 -1.61 0.00 0.00 -2.14 0.00 0.00 52.86 49.11 2wri s ASN 3 Cb 0.00 0.66 0.00 0.00 1.28 0.00 0.00 41.25 43.19 2wri s ASN 3 CO 0.00 -1.28 0.00 0.29 -2.04 0.00 0.00 177.10 174.07 2wri n LYS 4 N -0.62 0.00 -1.81 3.55 5.02 -1.26 -5.07 118.16 117.97 2wri n LYS 4 Ca 0.03 0.08 -0.34 0.00 -2.02 0.00 0.00 58.31 56.06 2wri n LYS 4 Cb 0.61 -0.06 0.04 0.00 -0.02 0.00 0.00 35.03 35.61 2wri n LYS 4 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2wri s ILE 5 N 0.00 3.11 -0.08 -0.18 -0.00 -1.26 -4.91 121.20 117.87 2wri s ILE 5 Ca 0.00 0.55 -0.36 0.00 -0.00 0.00 0.00 60.65 60.84 2wri s ILE 5 Cb 0.00 -3.09 -0.14 0.00 -0.00 0.00 0.00 42.46 39.23 2wri s ILE 5 CO 0.00 -0.29 1.74 1.57 -0.00 0.00 0.00 174.94 177.96 2wri n HIS 6 N -2.25 2.16 0.08 1.37 -0.00 -1.26 -4.78 115.22 110.53 2wri n HIS 6 Ca 0.11 0.26 0.05 0.00 -0.00 0.00 0.00 57.72 58.14 2wri n HIS 6 Cb 0.52 -2.55 0.27 0.00 -0.00 0.00 0.00 29.99 28.23 2wri n HIS 6 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2wri n PRO 7 N 5.33 0.06 -0.00 1.57 -0.04 -1.26 -2.48 135.00 138.18 2wri n PRO 7 Ca 0.22 0.56 -0.00 0.00 -0.04 0.00 0.00 63.50 64.24 2wri n PRO 7 Cb 0.24 -1.73 -0.00 0.00 -0.04 0.00 0.00 33.50 31.97 2wri n PRO 7 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2wri h ILE 8 N 0.00 0.00 0.00 0.52 1.08 -1.87 -3.35 117.51 113.89 2wri h ILE 8 Ca 0.00 -0.08 0.00 0.00 -0.39 0.00 0.00 64.86 64.39 2wri h ILE 8 Cb 0.03 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.78 2wri h ILE 8 CO 0.00 0.00 0.40 1.23 -0.69 0.00 0.00 178.15 179.09 2wri h GLY 9 N -0.08 0.00 2.00 5.37 0.00 -1.95 1.29 103.07 109.70 2wri h GLY 9 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 2wri h GLY 9 CO 0.00 0.00 -0.50 -2.75 0.00 0.00 0.00 176.54 173.29 2wri h PHE 10 N 0.00 0.00 0.00 5.60 3.57 -1.65 -3.39 116.94 121.06 2wri h PHE 10 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2wri h PHE 10 Cb 0.80 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.54 2wri h PHE 10 CO 0.00 0.50 0.00 0.54 -2.23 0.00 0.00 178.31 177.12 2wri n ARG 11 N -3.39 0.00 0.00 1.11 5.12 0.44 -4.81 116.66 115.12 2wri n ARG 11 Ca 0.01 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.93 2wri n ARG 11 Cb 0.65 -0.10 0.00 0.00 -1.16 0.00 0.00 32.46 31.85 2wri n ARG 11 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2wri n LEU 12 N -0.84 0.00 -0.29 0.55 4.77 -0.82 -2.56 117.00 117.81 2wri n LEU 12 Ca 0.00 0.00 0.28 0.00 -0.03 0.00 0.00 56.01 56.26 2wri n LEU 12 Cb 0.00 0.00 0.52 0.00 -2.33 0.00 0.00 43.42 41.61 2wri n LEU 12 CO 0.00 0.00 0.94 0.61 -1.33 0.00 0.00 177.39 177.61 2wri n GLY 13 N 0.00 -0.69 3.13 -0.72 0.00 -1.26 -4.39 105.19 101.25 2wri n GLY 13 Ca 0.00 0.73 -0.08 0.00 0.00 0.00 0.00 46.02 46.67 2wri n GLY 13 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2wri s ILE 14 N -5.38 0.18 0.00 -0.61 2.07 -1.06 -4.99 121.20 111.41 2wri s ILE 14 Ca -0.08 -1.72 0.00 0.00 -1.41 0.00 0.00 60.65 57.44 2wri s ILE 14 Cb 0.30 -1.61 0.00 0.00 0.13 0.00 0.00 42.46 41.29 2wri s ILE 14 CO 0.70 -0.81 0.00 0.41 -1.91 0.00 0.00 174.94 173.33 2wri n THR 15 N 0.03 0.00 -3.22 4.00 -1.04 -1.26 -4.66 114.28 108.12 2wri n THR 15 Ca -0.12 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.56 2wri n THR 15 Cb 0.62 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 69.07 2wri n THR 15 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 2wri s ARG 16 N 0.00 3.96 0.41 -2.82 6.06 -1.26 -4.97 118.95 120.32 2wri s ARG 16 Ca 0.00 0.56 0.07 0.00 -2.50 0.00 0.00 55.73 53.87 2wri s ARG 16 Cb 0.00 -2.55 -0.04 0.00 0.06 0.00 0.00 34.95 32.42 2wri s ARG 16 CO 0.00 0.24 0.23 -0.51 -2.50 0.00 0.00 175.30 172.75 2wri s ASP 17 N -2.22 4.61 0.55 -2.12 -0.00 -1.26 -3.28 116.67 112.94 2wri s ASP 17 Ca 0.51 -0.96 -0.21 0.00 -0.00 0.00 0.00 52.55 51.88 2wri s ASP 17 Cb -0.11 -0.53 -0.05 0.00 -0.00 0.00 0.00 42.92 42.23 2wri s ASP 17 CO 0.19 -0.55 1.33 0.26 -0.00 0.00 0.00 175.17 176.40 2wri s TRP 18 N -2.55 2.32 -2.08 4.23 0.51 -1.26 -4.90 118.94 115.21 2wri s TRP 18 Ca 0.43 1.40 0.13 0.00 -2.12 0.00 0.00 56.10 55.93 2wri s TRP 18 Cb 0.01 -3.75 0.54 0.00 -0.81 0.00 0.00 33.47 29.47 2wri s TRP 18 CO 0.24 -2.78 1.38 -1.91 -0.51 0.00 0.00 176.95 173.38 2wri n GLU 19 N -1.07 1.44 -3.31 4.98 2.13 -1.26 -4.63 120.64 118.92 2wri n GLU 19 Ca 0.11 -0.67 0.03 0.00 0.66 0.00 0.00 57.16 57.28 2wri n GLU 19 Cb 0.46 -1.25 -0.04 0.00 0.27 0.00 0.00 31.44 30.88 2wri n GLU 19 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2wri s SER 20 N -1.29 -0.45 -0.40 4.31 1.04 -1.26 -3.05 113.70 112.60 2wri s SER 20 Ca 0.22 0.56 0.03 0.00 0.48 0.00 0.00 55.95 57.24 2wri s SER 20 Cb 0.11 1.49 0.11 0.00 0.10 0.00 0.00 66.02 67.84 2wri s SER 20 CO 0.17 -0.09 0.14 0.00 0.98 0.00 0.00 173.24 174.44 2wri s ARG 21 N 2.43 1.49 0.00 4.02 1.70 -0.79 -4.97 118.95 122.83 2wri s ARG 21 Ca -0.01 -1.99 0.00 0.00 -0.47 0.00 0.00 55.73 53.26 2wri s ARG 21 Cb -0.05 -2.96 0.00 0.00 -0.57 0.00 0.00 34.95 31.36 2wri s ARG 21 CO -0.16 -1.02 0.00 -2.67 -1.08 0.00 0.00 175.30 170.37 2wri n TRP 22 N 3.94 -0.05 -4.16 5.89 4.27 -1.26 -4.14 117.44 121.93 2wri n TRP 22 Ca 0.04 0.00 -0.10 0.00 -3.89 0.00 0.00 57.50 53.55 2wri n TRP 22 Cb 0.38 0.00 -0.10 0.00 -1.36 0.00 0.00 31.31 30.23 2wri n TRP 22 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 2wri s TYR 23 N -2.20 0.85 -0.28 -2.67 5.04 -1.26 -5.07 117.35 111.76 2wri s TYR 23 Ca 0.00 -0.97 -0.25 0.00 -2.44 0.00 0.00 57.07 53.40 2wri s TYR 23 Cb 0.00 -0.51 0.14 0.00 0.35 0.00 0.00 41.96 41.94 2wri s TYR 23 CO 0.00 -0.22 1.11 0.00 -1.34 0.00 0.00 175.55 175.10 2wri s ALA 24 N -3.71 -2.02 0.66 3.97 0.00 -1.26 -4.96 121.76 114.45 2wri s ALA 24 Ca 0.13 1.83 -0.12 0.00 0.00 0.00 0.00 51.96 53.79 2wri s ALA 24 Cb 0.06 -1.47 -0.01 0.00 0.00 0.00 0.00 23.12 21.71 2wri s ALA 24 CO -0.05 -0.21 1.05 0.20 0.00 0.00 0.00 175.76 176.76 2wri s GLY 25 N 0.11 1.78 0.00 0.00 0.00 -1.26 -4.58 107.32 103.37 2wri s GLY 25 Ca 0.04 0.15 0.00 0.00 0.00 0.00 0.00 44.72 44.91 2wri s GLY 25 CO -0.08 0.45 0.26 0.58 0.00 0.00 0.00 173.10 174.32 2wri n LYS 26 N -2.81 0.20 0.00 2.90 2.85 -1.26 -0.50 118.16 119.53 2wri n LYS 26 Ca 0.08 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 2wri n LYS 26 Cb 0.53 -1.40 0.00 0.00 -0.65 0.00 0.00 35.03 33.51 2wri n LYS 26 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2wri n LYS 27 N 1.25 2.39 -0.03 -1.58 5.02 -1.26 -4.86 118.16 119.08 2wri n LYS 27 Ca 0.00 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.25 2wri n LYS 27 Cb 0.10 -0.77 -0.04 0.00 -0.02 0.00 0.00 35.03 34.29 2wri n LYS 27 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2wri n GLN 28 N -1.13 1.43 -0.20 1.97 1.13 0.35 -4.74 117.38 116.19 2wri n GLN 28 Ca 0.00 0.02 0.02 0.00 -1.94 0.00 0.00 57.00 55.10 2wri n GLN 28 Cb 0.17 -1.15 0.05 0.00 0.11 0.00 0.00 30.24 29.42 2wri n GLN 28 CO 0.00 0.00 0.00 0.98 -1.44 0.00 0.00 177.06 176.60 2wri n TYR 29 N -2.50 0.12 -0.20 1.08 -0.00 -0.86 0.67 117.16 115.47 2wri n TYR 29 Ca -0.12 0.65 -0.03 0.00 -0.00 0.00 0.00 57.90 58.40 2wri n TYR 29 Cb 0.66 -0.76 0.07 0.00 -0.00 0.00 0.00 39.34 39.31 2wri n TYR 29 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.86 176.77 2wri h ARG 30 N 0.00 0.59 -0.02 2.98 2.43 -1.86 -1.54 114.38 116.96 2wri h ARG 30 Ca 0.23 -0.04 -0.17 0.00 -0.81 0.00 0.00 59.98 59.19 2wri h ARG 30 Cb 0.36 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 2wri h ARG 30 CO -0.54 0.39 -0.73 0.45 -1.51 0.00 0.00 179.97 178.03 2wri h HIS 31 N 0.61 0.23 0.00 2.20 3.86 -0.08 -2.23 115.15 119.74 2wri h HIS 31 Ca 0.25 -0.11 -0.10 0.00 -1.16 0.00 0.00 60.37 59.26 2wri h HIS 31 Cb 0.13 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 2wri h HIS 31 CO -0.08 0.84 -0.48 -0.07 0.86 0.00 0.00 177.93 178.99 2wri h LEU 32 N 0.11 0.00 -0.09 2.43 3.38 -1.20 -2.27 115.31 117.67 2wri h LEU 32 Ca -0.02 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2wri h LEU 32 Cb 1.30 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.04 2wri h LEU 32 CO 0.11 0.48 -0.10 0.25 0.09 0.00 0.00 178.44 179.28 2wri h LEU 33 N 0.00 0.24 -0.75 1.67 5.85 -1.05 -2.41 115.31 118.85 2wri h LEU 33 Ca -0.00 -0.50 0.05 0.00 0.84 0.00 0.00 57.88 58.27 2wri h LEU 33 Cb 1.09 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.99 2wri h LEU 33 CO 0.06 0.68 0.45 0.25 -0.34 0.00 0.00 178.44 179.55 2wri h LEU 34 N -0.21 0.71 0.00 2.25 6.46 -1.34 -2.07 115.31 121.10 2wri h LEU 34 Ca 0.01 0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.79 2wri h LEU 34 Cb 0.62 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.42 2wri h LEU 34 CO 0.02 0.46 0.00 1.21 -0.62 0.00 0.00 178.44 179.52 2wri n GLU 35 N -4.69 0.00 -0.31 1.25 2.13 -0.86 -1.65 120.64 116.51 2wri n GLU 35 Ca 0.10 0.66 -0.07 0.00 0.66 0.00 0.00 57.16 58.51 2wri n GLU 35 Cb 0.15 -1.34 -0.04 0.00 0.27 0.00 0.00 31.44 30.49 2wri n GLU 35 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 2wri h ASP 36 N 0.00 -1.69 -1.00 4.31 3.45 -1.26 0.04 116.42 120.27 2wri h ASP 36 Ca 0.00 0.29 0.27 0.00 0.43 0.00 0.00 57.03 58.02 2wri h ASP 36 Cb 0.00 0.78 -0.13 0.00 -0.56 0.00 0.00 39.33 39.42 2wri h ASP 36 CO 0.00 -0.30 0.58 -0.61 -1.57 0.00 0.00 179.24 177.34 2wri h GLN 37 N -0.11 0.47 -0.00 3.56 5.75 -1.12 1.33 115.11 124.98 2wri h GLN 37 Ca 0.21 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.68 2wri h GLN 37 Cb 0.53 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 28.97 2wri h GLN 37 CO -0.83 0.31 -0.12 2.89 -2.65 0.00 0.00 178.83 178.43 2wri n ARG 38 N -4.95 0.34 -0.06 1.69 1.85 -0.07 -2.26 116.66 113.20 2wri n ARG 38 Ca 0.29 -0.09 -0.04 0.00 -1.00 0.00 0.00 57.85 57.00 2wri n ARG 38 Cb 0.83 -1.50 -0.02 0.00 -1.05 0.00 0.00 32.46 30.72 2wri n ARG 38 CO 0.00 0.00 0.00 0.82 -0.01 0.00 0.00 177.63 178.44 2wri h ILE 39 N 0.22 0.13 -0.96 8.89 2.04 0.23 -3.01 117.51 125.05 2wri h ILE 39 Ca 0.00 -1.13 0.27 0.00 1.00 0.00 0.00 64.86 65.00 2wri h ILE 39 Cb 0.41 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 2wri h ILE 39 CO 0.00 0.05 0.69 0.03 0.00 0.00 0.00 178.15 178.91 2wri h ARG 40 N -1.00 0.05 0.22 2.37 3.08 -0.80 0.61 114.38 118.91 2wri h ARG 40 Ca -0.02 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 2wri h ARG 40 Cb 0.38 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.42 2wri h ARG 40 CO -0.01 0.03 -0.11 0.78 -1.07 0.00 0.00 179.97 179.60 2wri h GLY 41 N 0.05 -0.31 0.53 0.04 0.00 -1.57 -1.06 103.07 100.75 2wri h GLY 41 Ca 0.47 0.11 0.13 0.00 0.00 0.00 0.00 47.33 48.04 2wri h GLY 41 CO -0.03 -0.11 0.59 -2.00 0.00 0.00 0.00 176.54 174.98 2wri h LEU 42 N -0.84 0.75 -0.00 3.11 5.85 -0.83 -2.59 115.31 120.76 2wri h LEU 42 Ca -0.03 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 2wri h LEU 42 Cb 0.51 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.43 2wri h LEU 42 CO 0.05 0.39 -0.04 -0.07 -0.34 0.00 0.00 178.44 178.43 2wri h LEU 43 N 0.81 0.04 0.00 2.25 3.38 -1.02 -3.17 115.31 117.60 2wri h LEU 43 Ca 0.46 -0.76 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2wri h LEU 43 Cb 0.61 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2wri h LEU 43 CO -0.22 0.80 0.14 -0.62 0.09 0.00 0.00 178.44 178.63 2wri n GLU 44 N -4.68 0.00 0.00 1.13 1.02 -0.40 -3.28 120.64 114.42 2wri n GLU 44 Ca -0.09 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2wri n GLU 44 Cb 0.40 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 2wri n GLU 44 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2wri n LYS 45 N -1.09 0.00 -1.66 3.49 5.02 -1.15 -4.38 118.16 118.38 2wri n LYS 45 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 2wri n LYS 45 Cb 0.14 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.12 2wri n LYS 45 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2wri s GLU 46 N 0.42 2.29 0.00 1.97 8.01 -1.20 -0.75 118.70 129.44 2wri s GLU 46 Ca 0.00 1.30 0.00 0.00 0.01 0.00 0.00 54.97 56.28 2wri s GLU 46 Cb 0.00 -4.53 0.00 0.00 -4.31 0.00 0.00 34.13 25.29 2wri s GLU 46 CO 0.00 -3.07 0.00 -0.11 0.01 0.00 0.00 175.26 172.09 2wri n LEU 47 N 14.92 0.00 0.27 1.80 7.94 -1.25 -4.74 117.00 135.93 2wri n LEU 47 Ca 0.33 0.00 0.13 0.00 -1.11 0.00 0.00 56.01 55.36 2wri n LEU 47 Cb 0.53 0.00 0.75 0.00 0.53 0.00 0.00 43.42 45.24 2wri n LEU 47 CO 0.71 0.00 1.00 0.22 -1.11 0.00 0.00 177.39 178.21 2wri h TYR 48 N 0.00 0.00 0.00 1.96 3.20 -1.14 0.44 116.97 121.43 2wri h TYR 48 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2wri h TYR 48 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 2wri h TYR 48 CO 0.00 0.10 0.00 0.77 -1.64 0.00 0.00 178.16 177.39 2wri h SER 49 N 0.00 0.00 0.00 -2.11 0.02 -1.93 -1.50 113.55 108.02 2wri h SER 49 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2wri h SER 49 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2wri h SER 49 CO 0.01 0.00 -1.21 0.00 -1.14 0.00 0.00 176.83 174.50 2wri n ALA 50 N -2.06 3.47 -2.86 3.77 0.00 0.09 -4.98 120.51 117.94 2wri n ALA 50 Ca -0.02 -0.43 -0.04 0.00 0.00 0.00 0.00 53.44 52.94 2wri n ALA 50 Cb 0.13 -0.59 0.01 0.00 0.00 0.00 0.00 19.45 19.00 2wri n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wri n GLY 51 N 1.46 -1.25 3.73 0.00 0.00 -0.57 -3.58 105.19 104.98 2wri n GLY 51 Ca 0.00 0.87 -0.41 0.00 0.00 0.00 0.00 46.02 46.49 2wri n GLY 51 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2wri s LEU 52 N -3.11 4.53 -0.08 0.99 2.34 -1.26 -4.17 118.68 117.92 2wri s LEU 52 Ca 0.14 1.85 0.14 0.00 0.06 0.00 0.00 54.13 56.32 2wri s LEU 52 Cb -0.04 -3.59 0.46 0.00 -0.56 0.00 0.00 46.19 42.46 2wri s LEU 52 CO 0.72 -0.03 1.38 0.00 -1.06 0.00 0.00 176.35 177.36 2wri n ALA 53 N 2.48 2.62 -3.61 1.48 0.00 -0.76 -4.94 120.51 117.78 2wri n ALA 53 Ca 0.01 -1.64 -0.05 0.00 0.00 0.00 0.00 53.44 51.77 2wri n ALA 53 Cb 0.48 -0.63 -0.03 0.00 0.00 0.00 0.00 19.45 19.27 2wri n ALA 53 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2wri s ARG 54 N -1.79 0.26 -0.40 0.00 0.52 -1.23 -4.88 118.95 111.42 2wri s ARG 54 Ca 0.35 -0.01 0.08 0.00 -0.52 0.00 0.00 55.73 55.63 2wri s ARG 54 Cb 0.23 0.12 0.25 0.00 0.52 0.00 0.00 34.95 36.08 2wri s ARG 54 CO 0.15 -0.10 0.55 0.28 0.02 0.00 0.00 175.30 176.20 2wri n VAL 55 N 0.31 -0.64 -1.79 3.52 0.31 -1.26 -2.76 118.33 116.02 2wri n VAL 55 Ca -0.02 -3.86 -0.43 0.00 -0.01 0.00 0.00 64.34 60.03 2wri n VAL 55 Cb 0.58 -1.67 -0.03 0.00 -0.91 0.00 0.00 33.84 31.81 2wri n VAL 55 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2wri s ASP 56 N -1.25 6.06 -0.10 4.52 2.15 -0.97 -4.82 116.67 122.26 2wri s ASP 56 Ca 0.35 2.05 0.04 0.00 0.43 0.00 0.00 52.55 55.41 2wri s ASP 56 Cb 0.18 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.28 2wri s ASP 56 CO -0.12 -1.46 -0.22 -0.63 -0.17 0.00 0.00 175.17 172.57 2wri s ILE 57 N 6.12 1.94 0.31 4.11 1.01 -1.17 0.01 121.20 133.53 2wri s ILE 57 Ca 0.87 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 60.60 2wri s ILE 57 Cb -0.33 -1.68 -0.05 0.00 0.01 0.00 0.00 42.46 40.40 2wri s ILE 57 CO 0.35 0.53 0.09 -1.61 0.00 0.00 0.00 174.94 174.31 2wri s GLU 58 N 0.38 1.59 -0.07 2.79 2.02 -1.26 -1.88 118.70 122.27 2wri s GLU 58 Ca -0.18 -1.89 -0.31 0.00 0.02 0.00 0.00 54.97 52.61 2wri s GLU 58 Cb -0.18 -0.54 0.12 0.00 0.10 0.00 0.00 34.13 33.63 2wri s GLU 58 CO 0.08 -0.29 1.00 1.03 0.02 0.00 0.00 175.26 177.11 2wri s ARG 59 N -3.92 0.64 0.00 1.61 0.52 -1.26 0.87 118.95 117.41 2wri s ARG 59 Ca 0.35 -0.23 0.00 0.00 -0.52 0.00 0.00 55.73 55.33 2wri s ARG 59 Cb 0.07 0.29 0.00 0.00 0.52 0.00 0.00 34.95 35.84 2wri s ARG 59 CO 0.15 -0.28 0.00 0.00 0.02 0.00 0.00 175.30 175.19 2wri n ALA 60 N -0.19 0.08 0.00 2.13 0.00 -1.26 -4.69 120.51 116.58 2wri n ALA 60 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2wri n ALA 60 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 2wri n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wri n ALA 61 N -0.05 0.00 0.00 0.00 0.00 -1.26 -4.94 120.51 114.26 2wri n ALA 61 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2wri n ALA 61 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2wri n ALA 61 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2wri n ASP 62 N 0.00 0.00 -3.78 0.00 9.92 -1.26 -4.89 116.55 116.54 2wri n ASP 62 Ca 0.00 0.00 -0.39 0.00 -0.53 0.00 0.00 54.79 53.87 2wri n ASP 62 Cb 0.00 -0.00 -0.09 0.00 -0.64 0.00 0.00 41.12 40.39 2wri n ASP 62 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 2wri n ASN 63 N 0.46 1.77 -4.70 -2.24 6.94 -1.26 -3.90 115.26 112.32 2wri n ASN 63 Ca 0.00 -2.58 -0.42 0.00 -0.02 0.00 0.00 54.58 51.56 2wri n ASN 63 Cb 0.00 -0.98 -0.03 0.00 -2.36 0.00 0.00 39.78 36.41 2wri n ASN 63 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2wri s VAL 64 N 7.98 2.55 0.00 3.53 1.01 -1.13 -4.16 120.40 130.18 2wri s VAL 64 Ca 0.67 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.80 2wri s VAL 64 Cb 0.11 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.39 2wri s VAL 64 CO 0.23 0.00 0.29 0.00 0.00 0.00 0.00 175.10 175.63 2wri n ALA 65 N 5.28 0.00 -2.66 5.51 0.00 0.25 -0.76 120.51 128.13 2wri n ALA 65 Ca 0.17 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.59 2wri n ALA 65 Cb 0.38 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.84 2wri n ALA 65 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wri n VAL 66 N -0.41 -7.60 -3.43 0.00 0.31 -1.15 -3.53 118.33 102.53 2wri n VAL 66 Ca 0.00 -0.29 -0.44 0.00 -0.01 0.00 0.00 64.34 63.60 2wri n VAL 66 Cb 0.00 -5.95 -0.06 0.00 -0.91 0.00 0.00 33.84 26.92 2wri n VAL 66 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2wri s THR 67 N -3.04 4.79 -0.89 2.52 2.01 0.10 0.38 115.64 121.51 2wri s THR 67 Ca 0.05 -1.81 -0.25 0.00 0.31 0.00 0.00 61.69 59.99 2wri s THR 67 Cb -0.01 -4.09 0.04 0.00 0.01 0.00 0.00 72.50 68.45 2wri s THR 67 CO 0.55 -0.85 1.38 -0.69 -0.69 0.00 0.00 174.62 174.31 2wri s VAL 68 N 1.24 3.83 -0.23 3.82 1.01 -0.89 -2.29 120.40 126.89 2wri s VAL 68 Ca 0.07 -0.23 -0.29 0.00 0.00 0.00 0.00 61.98 61.53 2wri s VAL 68 Cb -0.25 -4.99 -0.01 0.00 0.00 0.00 0.00 36.38 31.13 2wri s VAL 68 CO -0.00 -1.90 1.36 -1.00 0.00 0.00 0.00 175.10 173.56 2wri s HIS 69 N 5.36 2.59 0.37 5.22 3.76 -1.11 -3.23 115.29 128.25 2wri s HIS 69 Ca 0.41 0.82 0.02 0.00 -0.15 0.00 0.00 55.06 56.16 2wri s HIS 69 Cb -0.04 -3.80 -0.01 0.00 1.11 0.00 0.00 32.58 29.84 2wri s HIS 69 CO 0.01 -2.04 0.09 0.28 -0.85 0.00 0.00 174.74 172.23 2wri n VAL 70 N 5.96 0.00 -0.43 -0.90 0.31 -0.55 -1.83 118.33 120.88 2wri n VAL 70 Ca 0.15 -2.01 0.00 0.00 -0.01 0.00 0.00 64.34 62.48 2wri n VAL 70 Cb 0.46 0.62 0.00 0.00 -0.91 0.00 0.00 33.84 34.01 2wri n VAL 70 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wri n ALA 71 N -1.45 1.45 -3.15 3.52 0.00 -1.25 -2.87 120.51 116.76 2wri n ALA 71 Ca -0.15 -0.40 -0.23 0.00 0.00 0.00 0.00 53.44 52.66 2wri n ALA 71 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.93 2wri n ALA 71 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2wri n LYS 72 N -0.07 1.74 0.33 0.00 3.00 -1.24 -4.68 118.16 117.24 2wri n LYS 72 Ca 0.00 -3.92 0.14 0.00 -0.00 0.00 0.00 58.31 54.53 2wri n LYS 72 Cb 0.17 -1.83 0.74 0.00 0.00 0.00 0.00 35.03 34.12 2wri n LYS 72 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 2wri h PRO 73 N 3.35 0.00 0.00 1.64 0.13 -1.86 -3.17 132.00 132.09 2wri h PRO 73 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2wri h PRO 73 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 2wri h PRO 73 CO 0.62 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.80 2wri n GLY 74 N -1.24 -3.16 0.41 1.56 0.00 -1.26 -2.75 105.19 98.76 2wri n GLY 74 Ca -0.02 0.36 0.21 0.00 0.00 0.00 0.00 46.02 46.58 2wri n GLY 74 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wri h VAL 75 N 0.00 0.66 0.00 1.61 2.07 -1.84 -1.03 116.25 117.73 2wri h VAL 75 Ca 0.00 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 2wri h VAL 75 Cb 0.00 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 2wri h VAL 75 CO 0.00 0.04 -0.19 -0.37 0.02 0.00 0.00 177.57 177.07 2wri h VAL 76 N 0.23 0.67 0.00 2.57 -1.51 -1.66 -2.99 116.25 113.56 2wri h VAL 76 Ca 0.41 -0.81 -0.12 0.00 -1.23 0.00 0.00 66.70 64.95 2wri h VAL 76 Cb 1.26 1.51 -0.02 0.00 -2.13 0.00 0.00 31.29 31.91 2wri h VAL 76 CO -0.10 0.19 -1.74 -0.38 -1.23 0.00 0.00 177.57 174.31 2wri n ILE 77 N -3.64 0.70 -2.40 7.19 5.41 -0.43 -2.86 119.36 123.33 2wri n ILE 77 Ca -0.01 -0.63 0.00 0.00 1.00 0.00 0.00 62.75 63.11 2wri n ILE 77 Cb 0.32 -0.35 0.00 0.00 -0.71 0.00 0.00 39.64 38.90 2wri n ILE 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wri n GLY 78 N 1.38 -1.91 3.24 7.39 0.00 -0.96 -2.70 105.19 111.63 2wri n GLY 78 Ca -0.10 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 2wri n GLY 78 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2wri s ARG 79 N 0.00 3.38 0.00 1.61 1.70 -1.26 -4.32 118.95 120.06 2wri s ARG 79 Ca 0.00 -2.72 0.00 0.00 -0.47 0.00 0.00 55.73 52.54 2wri s ARG 79 Cb 0.00 -4.20 0.00 0.00 -0.57 0.00 0.00 34.95 30.18 2wri s ARG 79 CO 0.00 -1.25 0.00 0.41 -1.08 0.00 0.00 175.30 173.38 2wri n GLY 80 N 3.40 1.59 0.00 3.88 0.00 -1.26 -4.67 105.19 108.14 2wri n GLY 80 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2wri n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wri n GLY 81 N -0.88 0.87 0.00 -0.02 0.00 -1.19 -5.03 105.19 98.95 2wri n GLY 81 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 2wri n GLY 81 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wri n GLU 82 N 0.00 3.76 -0.03 1.61 4.71 -1.17 -4.57 120.64 124.94 2wri n GLU 82 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 57.16 57.12 2wri n GLU 82 Cb 0.00 -0.45 -0.01 0.00 -1.01 0.00 0.00 31.44 29.97 2wri n GLU 82 CO 0.00 0.00 0.00 -2.13 0.09 0.00 0.00 177.13 175.09 2wri n ARG 83 N -0.70 0.19 0.00 3.49 3.00 -1.16 -3.57 116.66 117.90 2wri n ARG 83 Ca 0.00 0.21 0.00 0.00 -0.00 0.00 0.00 57.85 58.06 2wri n ARG 83 Cb 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 32.46 31.49 2wri n ARG 83 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.63 179.14 2wri n ILE 84 N -3.21 1.27 -0.02 5.15 3.06 -1.10 0.15 119.36 124.66 2wri n ILE 84 Ca -0.04 0.49 -0.14 0.00 -2.50 0.00 0.00 62.75 60.56 2wri n ILE 84 Cb 0.15 -1.49 -0.14 0.00 0.54 0.00 0.00 39.64 38.70 2wri n ILE 84 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 2wri n ARG 85 N -1.31 0.68 0.11 9.51 3.00 -1.26 -2.70 116.66 124.69 2wri n ARG 85 Ca 0.00 0.25 -0.02 0.00 -0.01 0.00 0.00 57.85 58.07 2wri n ARG 85 Cb 0.17 -1.73 0.23 0.00 0.00 0.00 0.00 32.46 31.14 2wri n ARG 85 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.63 177.24 2wri h VAL 86 N 0.02 1.32 0.07 1.55 -1.51 0.13 -2.65 116.25 115.18 2wri h VAL 86 Ca -0.37 -1.56 -0.00 0.00 -1.23 0.00 0.00 66.70 63.54 2wri h VAL 86 Cb 2.04 1.73 0.00 0.00 -2.13 0.00 0.00 31.29 32.93 2wri h VAL 86 CO 0.07 0.46 -0.03 -0.07 -1.23 0.00 0.00 177.57 176.77 2wri h LEU 87 N 0.16 -0.08 -1.67 4.19 3.38 -1.40 0.20 115.31 120.09 2wri h LEU 87 Ca 0.01 -0.52 0.27 0.00 0.09 0.00 0.00 57.88 57.73 2wri h LEU 87 Cb 0.83 0.02 -0.07 0.00 0.09 0.00 0.00 40.66 41.54 2wri h LEU 87 CO 0.06 0.53 0.69 0.03 0.09 0.00 0.00 178.44 179.85 2wri h ARG 88 N -0.75 0.21 -0.01 1.13 3.08 -1.52 1.34 114.38 117.87 2wri h ARG 88 Ca -0.01 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 2wri h ARG 88 Cb 0.60 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 2wri h ARG 88 CO 0.02 0.14 -0.00 1.49 -1.07 0.00 0.00 179.97 180.55 2wri h GLU 89 N 0.22 0.01 -0.45 0.04 4.57 -1.18 -3.08 114.58 114.71 2wri h GLU 89 Ca 0.53 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.70 2wri h GLU 89 Cb 1.66 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.22 2wri h GLU 89 CO -0.14 0.33 0.27 0.93 -1.18 0.00 0.00 179.01 179.21 2wri h GLU 90 N -0.31 0.62 0.43 1.92 4.39 0.48 0.15 114.58 122.26 2wri h GLU 90 Ca 0.00 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 2wri h GLU 90 Cb 0.32 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 2wri h GLU 90 CO 0.00 0.47 -0.49 -0.07 -1.16 0.00 0.00 179.01 177.75 2wri h LEU 91 N 0.60 -1.38 -2.73 1.33 3.38 -0.49 0.41 115.31 116.43 2wri h LEU 91 Ca 0.16 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 2wri h LEU 91 Cb 0.01 0.47 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 2wri h LEU 91 CO -0.03 -0.64 -0.00 0.00 0.09 0.00 0.00 178.44 177.86 2wri h ALA 92 N -0.75 1.20 0.00 1.53 0.00 -1.48 0.29 119.26 120.05 2wri h ALA 92 Ca -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2wri h ALA 92 Cb 0.84 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2wri h ALA 92 CO -0.10 0.01 0.00 1.17 0.00 0.00 0.00 179.25 180.32 2wri n LYS 93 N -3.38 0.02 -2.00 0.00 4.81 0.14 -2.06 118.16 115.69 2wri n LYS 93 Ca -0.03 0.37 0.01 0.00 -0.87 0.00 0.00 58.31 57.80 2wri n LYS 93 Cb 0.09 -1.50 0.03 0.00 0.02 0.00 0.00 35.03 33.67 2wri n LYS 93 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04 2wri n LEU 94 N -1.43 0.89 0.00 3.14 -0.00 0.10 -4.93 117.00 114.76 2wri n LEU 94 Ca 0.01 -2.44 0.00 0.00 -0.00 0.00 0.00 56.01 53.59 2wri n LEU 94 Cb 0.04 0.18 0.00 0.00 -0.00 0.00 0.00 43.42 43.64 2wri n LEU 94 CO 0.03 0.85 0.00 0.35 -0.00 0.00 0.00 177.39 178.62 2wri n THR 95 N -0.06 0.00 -1.49 1.47 -2.24 -0.88 -5.07 114.28 106.02 2wri n THR 95 Ca 0.02 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.64 2wri n THR 95 Cb 0.97 0.00 -0.15 0.00 -2.10 0.00 0.00 70.33 69.06 2wri n THR 95 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wri n GLY 96 N 0.00 -0.33 3.48 3.38 0.00 -1.11 -4.39 105.19 106.22 2wri n GLY 96 Ca 0.00 0.12 -0.09 0.00 0.00 0.00 0.00 46.02 46.04 2wri n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wri s LYS 97 N 7.65 1.36 -1.21 1.61 1.02 -1.26 -5.06 119.74 123.85 2wri s LYS 97 Ca 1.04 -1.12 -0.19 0.00 0.02 0.00 0.00 55.97 55.72 2wri s LYS 97 Cb -0.47 0.45 -0.02 0.00 -0.52 0.00 0.00 37.83 37.28 2wri s LYS 97 CO 0.32 -0.55 1.93 -1.71 -0.92 0.00 0.00 175.35 174.42 2wri n ASN 98 N -0.31 3.81 -4.65 2.83 2.85 -1.25 -4.71 115.26 113.83 2wri n ASN 98 Ca -0.06 -2.80 -0.43 0.00 -0.11 0.00 0.00 54.58 51.18 2wri n ASN 98 Cb 0.62 -1.62 -0.02 0.00 1.24 0.00 0.00 39.78 40.00 2wri n ASN 98 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 2wri s VAL 99 N 5.86 3.95 -0.78 3.44 -7.23 -1.26 -2.84 120.40 121.54 2wri s VAL 99 Ca 0.57 1.11 -0.02 0.00 -1.81 0.00 0.00 61.98 61.83 2wri s VAL 99 Cb 0.07 -3.84 0.30 0.00 0.56 0.00 0.00 36.38 33.47 2wri s VAL 99 CO 0.06 -0.24 2.15 0.00 -0.31 0.00 0.00 175.10 176.77 2wri n ALA 100 N 7.45 6.51 -1.64 1.32 0.00 0.06 -4.99 120.51 129.23 2wri n ALA 100 Ca 0.16 -3.93 -0.57 0.00 0.00 0.00 0.00 53.44 49.10 2wri n ALA 100 Cb 0.45 -2.02 -0.07 0.00 0.00 0.00 0.00 19.45 17.80 2wri n ALA 100 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2wri n LEU 101 N -0.31 1.54 -4.55 0.00 0.00 -1.23 -4.51 117.00 107.94 2wri n LEU 101 Ca 0.53 1.12 -0.26 0.00 0.00 0.00 0.00 56.01 57.41 2wri n LEU 101 Cb 0.29 -1.09 -0.11 0.00 0.00 0.00 0.00 43.42 42.52 2wri n LEU 101 CO 0.48 -0.97 -0.33 0.20 0.00 0.00 0.00 177.39 176.77 2wri s ASN 102 N 1.72 3.51 -0.03 1.96 0.01 0.16 -4.99 114.94 117.28 2wri s ASN 102 Ca 0.93 -1.29 0.02 0.00 -0.71 0.00 0.00 52.86 51.80 2wri s ASN 102 Cb -1.12 -0.32 0.01 0.00 0.41 0.00 0.00 41.25 40.23 2wri s ASN 102 CO 0.59 -0.38 -0.08 -0.69 -1.51 0.00 0.00 177.10 175.04 2wri s VAL 103 N -2.79 0.70 0.04 1.60 1.01 -1.26 -2.09 120.40 117.62 2wri s VAL 103 Ca 0.34 -0.29 0.06 0.00 0.00 0.00 0.00 61.98 62.08 2wri s VAL 103 Cb 0.07 -0.65 -0.02 0.00 0.00 0.00 0.00 36.38 35.77 2wri s VAL 103 CO 0.16 0.24 -0.16 -1.10 0.00 0.00 0.00 175.10 174.24 2wri s GLN 104 N 0.39 1.09 0.56 2.72 -1.52 -1.20 -4.98 119.66 116.73 2wri s GLN 104 Ca -0.06 -0.81 0.08 0.00 -1.95 0.00 0.00 55.36 52.61 2wri s GLN 104 Cb -0.10 -1.13 0.10 0.00 -0.22 0.00 0.00 33.01 31.65 2wri s GLN 104 CO 0.01 0.28 0.78 -1.91 -0.25 0.00 0.00 175.29 174.20 2wri n GLU 105 N 1.89 0.52 -3.52 2.91 2.13 -1.25 -1.48 120.64 121.85 2wri n GLU 105 Ca -0.18 -2.85 -0.16 0.00 0.66 0.00 0.00 57.16 54.64 2wri n GLU 105 Cb 0.54 -0.29 -0.12 0.00 0.27 0.00 0.00 31.44 31.84 2wri n GLU 105 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2wri s VAL 106 N -2.43 -0.38 0.07 6.31 1.01 -1.14 -4.68 120.40 119.16 2wri s VAL 106 Ca 0.58 0.00 -0.14 0.00 0.00 0.00 0.00 61.98 62.42 2wri s VAL 106 Cb -0.04 -0.63 -0.03 0.00 0.00 0.00 0.00 36.38 35.68 2wri s VAL 106 CO 0.37 -0.10 1.15 0.00 0.00 0.00 0.00 175.10 176.51 2wri n GLN 107 N 5.33 -0.20 -3.96 2.72 6.02 -1.26 -3.84 117.38 122.19 2wri n GLN 107 Ca -0.05 1.14 -0.31 0.00 -0.01 0.00 0.00 57.00 57.77 2wri n GLN 107 Cb 0.50 -1.68 -0.15 0.00 1.02 0.00 0.00 30.24 29.92 2wri n GLN 107 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2wri s ASN 108 N -4.24 4.28 0.57 1.08 0.01 -1.26 -4.91 114.94 110.47 2wri s ASN 108 Ca -0.05 -1.60 0.35 0.00 -0.71 0.00 0.00 52.86 50.85 2wri s ASN 108 Cb 0.05 -1.34 1.57 0.00 0.41 0.00 0.00 41.25 41.94 2wri s ASN 108 CO 0.28 -0.30 2.06 1.55 -1.51 0.00 0.00 177.10 179.18 2wri h PRO 109 N 7.83 0.00 0.00 -0.60 0.13 -1.95 -0.06 132.00 137.35 2wri h PRO 109 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.00 2wri h PRO 109 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 2wri h PRO 109 CO 0.46 0.01 0.00 -1.71 -0.23 0.00 0.00 178.00 176.53 2wri n ASN 110 N -3.11 0.00 -0.45 1.44 5.15 -1.26 -1.90 115.26 115.13 2wri n ASN 110 Ca -0.00 -0.70 0.04 0.00 -0.60 0.00 0.00 54.58 53.31 2wri n ASN 110 Cb 0.26 0.00 0.06 0.00 -0.53 0.00 0.00 39.78 39.57 2wri n ASN 110 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2wri n LEU 111 N -0.78 0.95 -3.94 1.20 4.77 -0.03 -4.44 117.00 114.74 2wri n LEU 111 Ca 0.06 -1.88 -0.31 0.00 -0.03 0.00 0.00 56.01 53.86 2wri n LEU 111 Cb 0.03 -0.16 -0.15 0.00 -2.33 0.00 0.00 43.42 40.81 2wri n LEU 111 CO 0.05 0.47 -0.31 -0.55 -1.33 0.00 0.00 177.39 175.71 2wri s SER 112 N -1.78 4.52 0.25 -1.43 0.15 -0.80 -5.01 113.70 109.61 2wri s SER 112 Ca 0.15 -2.13 -0.04 0.00 0.70 0.00 0.00 55.95 54.63 2wri s SER 112 Cb 0.14 -1.43 0.50 0.00 -1.71 0.00 0.00 66.02 63.51 2wri s SER 112 CO -0.01 -0.37 1.37 0.00 1.20 0.00 0.00 173.24 175.43 2wri n ALA 113 N 4.26 0.29 0.11 5.45 0.00 -1.26 0.15 120.51 129.51 2wri n ALA 113 Ca 0.03 0.95 0.19 0.00 0.00 0.00 0.00 53.44 54.61 2wri n ALA 113 Cb 0.41 -0.62 0.76 0.00 0.00 0.00 0.00 19.45 20.00 2wri n ALA 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2wri h PRO 114 N 0.00 0.00 0.00 0.00 0.11 -1.88 -1.22 132.00 129.01 2wri h PRO 114 Ca 0.46 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.52 2wri h PRO 114 Cb 0.80 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.90 2wri h PRO 114 CO -0.87 0.00 -0.46 -0.07 -0.21 0.00 0.00 178.00 176.39 2wri h LEU 115 N 0.00 0.00 -0.91 2.35 3.38 0.11 -3.28 115.31 116.97 2wri h LEU 115 Ca 0.17 -0.22 0.14 0.00 0.09 0.00 0.00 57.88 58.06 2wri h LEU 115 Cb 0.83 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.43 2wri h LEU 115 CO -0.00 0.86 -0.39 0.58 0.09 0.00 0.00 178.44 179.58 2wri h VAL 116 N -1.00 0.04 -0.88 1.22 2.07 -1.16 0.43 116.25 116.96 2wri h VAL 116 Ca -0.07 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.69 2wri h VAL 116 Cb 0.59 0.04 -0.14 0.00 -1.52 0.00 0.00 31.29 30.25 2wri h VAL 116 CO -0.04 0.00 0.24 0.00 0.02 0.00 0.00 177.57 177.79 2wri h ALA 117 N 1.26 1.29 -0.33 1.67 0.00 -1.37 0.15 119.26 121.92 2wri h ALA 117 Ca 0.31 0.23 -0.16 0.00 0.00 0.00 0.00 54.91 55.29 2wri h ALA 117 Cb 0.58 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 2wri h ALA 117 CO -0.92 -0.48 -0.43 1.96 0.00 0.00 0.00 179.25 179.39 2wri h GLN 118 N 0.20 0.88 -0.35 0.00 4.20 -0.24 -1.06 115.11 118.73 2wri h GLN 118 Ca 0.56 -0.50 0.07 0.00 0.06 0.00 0.00 58.65 58.84 2wri h GLN 118 Cb 1.14 0.03 -0.06 0.00 0.30 0.00 0.00 27.48 28.89 2wri h GLN 118 CO -0.66 1.14 -0.02 -0.09 -0.67 0.00 0.00 178.83 178.53 2wri h ARG 119 N 0.67 0.07 0.59 1.46 2.43 0.48 0.20 114.38 120.28 2wri h ARG 119 Ca 0.04 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.18 2wri h ARG 119 Cb 1.02 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.56 2wri h ARG 119 CO 0.10 0.05 -0.28 0.28 -1.51 0.00 0.00 179.97 178.61 2wri h VAL 120 N 0.07 0.00 -0.97 0.20 2.07 -1.19 -2.22 116.25 114.21 2wri h VAL 120 Ca 0.17 -0.10 0.35 0.00 0.82 0.00 0.00 66.70 67.94 2wri h VAL 120 Cb 0.24 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 29.84 2wri h VAL 120 CO -0.31 0.00 0.31 0.00 0.02 0.00 0.00 177.57 177.59 2wri n ALA 121 N -2.47 0.79 0.42 1.67 0.00 -0.41 0.51 120.51 121.02 2wri n ALA 121 Ca -0.10 1.01 -0.19 0.00 0.00 0.00 0.00 53.44 54.16 2wri n ALA 121 Cb 0.31 -0.89 -0.09 0.00 0.00 0.00 0.00 19.45 18.77 2wri n ALA 121 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2wri h GLU 122 N 0.00 -1.08 -0.34 0.00 5.08 -0.35 -2.01 114.58 115.87 2wri h GLU 122 Ca 0.73 0.07 0.10 0.00 -1.00 0.00 0.00 59.36 59.26 2wri h GLU 122 Cb 1.77 0.25 -0.01 0.00 0.50 0.00 0.00 28.75 31.25 2wri h GLU 122 CO -0.82 -0.72 0.40 1.96 -1.00 0.00 0.00 179.01 178.83 2wri h GLN 123 N -1.13 0.00 0.00 2.33 4.20 0.68 1.11 115.11 122.31 2wri h GLN 123 Ca -0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.61 2wri h GLN 123 Cb 0.89 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.67 2wri h GLN 123 CO 0.12 0.00 0.00 -0.89 -0.67 0.00 0.00 178.83 177.39 2wri n ILE 124 N -3.65 0.72 0.35 2.54 5.41 -0.18 -2.13 119.36 122.42 2wri n ILE 124 Ca 0.06 0.03 0.11 0.00 1.00 0.00 0.00 62.75 63.95 2wri n ILE 124 Cb 0.56 -0.92 -0.02 0.00 -0.71 0.00 0.00 39.64 38.55 2wri n ILE 124 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2wri n GLU 125 N -2.19 0.43 -0.12 0.38 1.02 0.38 -3.36 120.64 117.18 2wri n GLU 125 Ca 0.04 -0.01 0.11 0.00 -0.02 0.00 0.00 57.16 57.28 2wri n GLU 125 Cb 0.30 -1.64 0.30 0.00 -0.02 0.00 0.00 31.44 30.39 2wri n GLU 125 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2wri n ARG 126 N -2.18 2.04 -2.90 3.49 1.74 -0.90 -4.99 116.66 112.96 2wri n ARG 126 Ca 0.00 -1.57 -0.08 0.00 -0.77 0.00 0.00 57.85 55.43 2wri n ARG 126 Cb 0.49 -1.44 0.01 0.00 -1.02 0.00 0.00 32.46 30.50 2wri n ARG 126 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2wri n ARG 127 N 0.80 -2.57 -4.49 5.56 3.00 -0.93 -5.05 116.66 112.97 2wri n ARG 127 Ca 0.17 2.19 -0.24 0.00 -0.01 0.00 0.00 57.85 59.96 2wri n ARG 127 Cb 0.44 -4.93 -0.10 0.00 0.00 0.00 0.00 32.46 27.87 2wri n ARG 127 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2wri s PHE 128 N -2.09 2.18 -0.84 -1.55 0.08 -1.13 -5.01 117.98 109.62 2wri s PHE 128 Ca 0.17 -0.61 -0.21 0.00 0.12 0.00 0.00 56.93 56.39 2wri s PHE 128 Cb -0.04 -1.26 -0.19 0.00 -0.57 0.00 0.00 43.02 40.96 2wri s PHE 128 CO 0.74 0.42 2.23 0.00 -0.10 0.00 0.00 175.22 178.50 2wri n ALA 129 N -0.70 0.47 -0.50 5.36 0.00 -1.26 -4.65 120.51 119.24 2wri n ALA 129 Ca -0.05 -1.41 0.43 0.00 0.00 0.00 0.00 53.44 52.41 2wri n ALA 129 Cb 0.64 -2.95 0.68 0.00 0.00 0.00 0.00 19.45 17.81 2wri n ALA 129 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wri h VAL 130 N 7.34 0.02 0.00 0.00 2.07 -1.95 0.63 116.25 124.36 2wri h VAL 130 Ca 0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.53 2wri h VAL 130 Cb 1.03 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2wri h VAL 130 CO 1.12 0.00 0.00 -1.14 0.02 0.00 0.00 177.57 177.57 2wri n ARG 131 N -3.68 0.00 -0.22 1.57 3.00 -1.26 -2.82 116.66 113.25 2wri n ARG 131 Ca 0.35 0.00 0.18 0.00 -0.00 0.00 0.00 57.85 58.39 2wri n ARG 131 Cb 1.79 -0.24 0.34 0.00 0.00 0.00 0.00 32.46 34.36 2wri n ARG 131 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 2wri n ARG 132 N 0.00 -0.04 -0.07 -0.14 0.63 -0.59 0.61 116.66 117.05 2wri n ARG 132 Ca 0.00 0.96 -0.08 0.00 -0.92 0.00 0.00 57.85 57.81 2wri n ARG 132 Cb 0.00 -1.67 -0.06 0.00 0.45 0.00 0.00 32.46 31.19 2wri n ARG 132 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wri h ALA 133 N 1.36 -0.59 0.23 5.13 0.00 0.11 -2.94 119.26 122.56 2wri h ALA 133 Ca 0.53 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.42 2wri h ALA 133 Cb 1.33 0.93 0.00 0.00 0.00 0.00 0.00 17.79 20.05 2wri h ALA 133 CO -0.56 -0.74 -0.13 0.82 0.00 0.00 0.00 179.25 178.64 2wri h ILE 134 N -0.24 0.00 -0.07 0.00 2.04 0.33 0.04 117.51 119.61 2wri h ILE 134 Ca 0.04 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.91 2wri h ILE 134 Cb 0.35 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 2wri h ILE 134 CO -0.33 0.00 -0.01 1.17 0.00 0.00 0.00 178.15 178.98 2wri n LYS 135 N -2.98 -0.01 -0.10 2.37 3.00 -0.96 0.26 118.16 119.74 2wri n LYS 135 Ca -0.04 0.10 -0.10 0.00 -0.00 0.00 0.00 58.31 58.27 2wri n LYS 135 Cb 0.14 -0.16 -0.15 0.00 0.00 0.00 0.00 35.03 34.85 2wri n LYS 135 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 2wri n GLN 136 N -4.05 0.77 -0.19 1.64 7.27 -1.12 -3.54 117.38 118.17 2wri n GLN 136 Ca 0.01 -0.00 0.29 0.00 0.07 0.00 0.00 57.00 57.37 2wri n GLN 136 Cb 0.04 -1.51 0.62 0.00 2.41 0.00 0.00 30.24 31.80 2wri n GLN 136 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2wri h ALA 137 N 0.92 2.83 0.00 1.69 0.00 0.56 0.38 119.26 125.65 2wri h ALA 137 Ca -0.54 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2wri h ALA 137 Cb 2.20 0.07 0.00 0.00 0.00 0.00 0.00 17.79 20.06 2wri h ALA 137 CO 0.02 -1.45 -0.00 0.28 0.00 0.00 0.00 179.25 178.10 2wri h VAL 138 N 0.00 0.00 0.00 0.00 2.07 -0.95 -3.38 116.25 113.99 2wri h VAL 138 Ca 0.46 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.89 2wri h VAL 138 Cb 2.37 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 2wri h VAL 138 CO -0.00 0.00 0.00 1.67 0.02 0.00 0.00 177.57 179.26 2wri n GLN 139 N -2.27 0.00 -0.19 1.57 -0.06 0.13 0.02 117.38 116.58 2wri n GLN 139 Ca -0.00 0.00 -0.05 0.00 -2.00 0.00 0.00 57.00 54.95 2wri n GLN 139 Cb 0.00 0.00 -0.05 0.00 -4.06 0.00 0.00 30.24 26.14 2wri n GLN 139 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2wri n ARG 140 N -2.97 -0.20 -0.04 3.69 1.74 -0.91 -0.66 116.66 117.31 2wri n ARG 140 Ca 0.00 0.94 -0.06 0.00 -0.77 0.00 0.00 57.85 57.96 2wri n ARG 140 Cb 0.00 -1.39 -0.04 0.00 -1.02 0.00 0.00 32.46 30.01 2wri n ARG 140 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2wri h VAL 141 N 0.00 0.00 -0.19 1.55 2.07 -0.62 1.08 116.25 120.14 2wri h VAL 141 Ca 0.07 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.65 2wri h VAL 141 Cb 0.19 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.95 2wri h VAL 141 CO -0.43 0.00 0.49 0.24 0.02 0.00 0.00 177.57 177.88 2wri h MET 142 N -0.19 0.00 0.06 1.57 2.86 -1.38 1.28 114.93 119.13 2wri h MET 142 Ca 0.02 0.00 -0.29 0.00 -2.06 0.00 0.00 59.70 57.37 2wri h MET 142 Cb 0.25 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.88 2wri h MET 142 CO -0.22 0.00 -1.54 1.49 1.06 0.00 0.00 176.91 177.70 2wri h GLU 143 N 0.00 0.12 0.00 1.72 4.81 0.19 -3.40 114.58 118.02 2wri h GLU 143 Ca 0.09 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2wri h GLU 143 Cb 1.06 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.52 2wri h GLU 143 CO -0.00 0.89 0.00 0.43 -0.73 0.00 0.00 179.01 179.60 2wri n SER 144 N -3.30 0.00 0.00 1.04 7.64 0.42 -5.01 113.62 114.41 2wri n SER 144 Ca -0.15 0.30 0.00 0.00 1.01 0.00 0.00 58.87 60.03 2wri n SER 144 Cb 1.03 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 64.13 2wri n SER 144 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wri n GLY 145 N 1.18 -0.17 3.22 0.23 0.00 0.17 -5.07 105.19 104.74 2wri n GLY 145 Ca 0.00 0.74 0.04 0.00 0.00 0.00 0.00 46.02 46.80 2wri n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wri s ALA 146 N 0.00 -3.29 0.00 4.61 0.00 -1.26 -4.95 121.76 116.87 2wri s ALA 146 Ca 0.00 1.72 -0.02 0.00 0.00 0.00 0.00 51.96 53.66 2wri s ALA 146 Cb 0.00 -2.32 -0.10 0.00 0.00 0.00 0.00 23.12 20.70 2wri s ALA 146 CO 0.00 -1.11 1.78 1.63 0.00 0.00 0.00 175.76 178.06 2wri n LYS 147 N 4.89 0.87 0.00 0.00 5.02 -0.86 -4.48 118.16 123.60 2wri n LYS 147 Ca -0.07 -0.36 0.00 0.00 -2.02 0.00 0.00 58.31 55.85 2wri n LYS 147 Cb 0.55 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 2wri n LYS 147 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wri n GLY 148 N 2.45 4.73 3.61 0.72 0.00 -1.25 -2.61 105.19 112.84 2wri n GLY 148 Ca 0.16 -1.09 -0.11 0.00 0.00 0.00 0.00 46.02 44.98 2wri n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wri s ALA 149 N -1.23 -1.93 0.04 4.61 0.00 -0.35 -0.71 121.76 122.19 2wri s ALA 149 Ca 0.00 1.74 -0.06 0.00 0.00 0.00 0.00 51.96 53.64 2wri s ALA 149 Cb 0.00 -1.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.07 2wri s ALA 149 CO 0.00 -0.28 0.11 0.21 0.00 0.00 0.00 175.76 175.80 2wri s LYS 150 N -0.36 0.62 0.01 0.00 2.20 -0.15 -1.59 119.74 120.46 2wri s LYS 150 Ca 0.00 -0.77 -0.10 0.00 -0.36 0.00 0.00 55.97 54.74 2wri s LYS 150 Cb -0.03 0.24 0.01 0.00 -1.51 0.00 0.00 37.83 36.54 2wri s LYS 150 CO -0.02 -0.16 0.21 0.08 -0.36 0.00 0.00 175.35 175.10 2wri s VAL 151 N -2.73 0.08 -0.10 4.02 1.01 -1.03 -0.07 120.40 121.59 2wri s VAL 151 Ca -0.04 -0.66 -0.14 0.00 0.00 0.00 0.00 61.98 61.15 2wri s VAL 151 Cb -0.00 -0.60 0.03 0.00 0.00 0.00 0.00 36.38 35.81 2wri s VAL 151 CO -0.05 -0.36 0.36 0.27 0.00 0.00 0.00 175.10 175.31 2wri s ILE 152 N -1.62 0.02 0.05 2.22 -4.36 -1.00 -3.84 121.20 112.66 2wri s ILE 152 Ca -0.12 -0.13 0.08 0.00 -0.26 0.00 0.00 60.65 60.22 2wri s ILE 152 Cb -0.05 -0.55 -0.03 0.00 1.25 0.00 0.00 42.46 43.08 2wri s ILE 152 CO 0.01 -0.07 -0.21 -0.69 0.24 0.00 0.00 174.94 174.22 2wri s VAL 153 N -0.24 2.55 0.00 8.37 1.01 0.02 -1.52 120.40 130.59 2wri s VAL 153 Ca -0.04 -1.29 0.00 0.00 0.00 0.00 0.00 61.98 60.65 2wri s VAL 153 Cb -0.03 -2.05 0.00 0.00 0.00 0.00 0.00 36.38 34.30 2wri s VAL 153 CO 0.02 0.33 0.00 -1.54 0.00 0.00 0.00 175.10 173.91 2wri n SER 154 N 1.58 0.00 -3.96 3.32 3.41 0.63 -0.57 113.62 118.03 2wri n SER 154 Ca -0.16 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.36 2wri n SER 154 Cb 0.52 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.38 2wri n SER 154 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2wri s GLY 155 N 0.00 0.24 0.00 5.00 0.00 -1.25 -2.49 107.32 108.82 2wri s GLY 155 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 44.00 2wri s GLY 155 CO 0.00 -0.85 0.00 0.54 0.00 0.00 0.00 173.10 172.79 2wri n ARG 156 N 0.55 0.00 -1.57 2.90 5.12 -1.26 -4.71 116.66 117.69 2wri n ARG 156 Ca -0.18 0.00 -0.49 0.00 -1.93 0.00 0.00 57.85 55.25 2wri n ARG 156 Cb 0.59 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.85 2wri n ARG 156 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2wri n ILE 157 N -0.73 0.89 -1.08 0.55 5.41 -1.26 0.15 119.36 123.29 2wri n ILE 157 Ca 0.00 -0.22 -0.06 0.00 1.00 0.00 0.00 62.75 63.47 2wri n ILE 157 Cb 0.00 -0.81 -0.03 0.00 -0.71 0.00 0.00 39.64 38.09 2wri n ILE 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wri n GLY 158 N 2.00 0.56 2.04 7.39 0.00 -1.26 -1.31 105.19 114.61 2wri n GLY 158 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.17 2wri n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wri n GLY 159 N 0.48 0.47 3.28 -0.02 0.00 0.39 -5.02 105.19 104.75 2wri n GLY 159 Ca -0.06 -0.47 -0.31 0.00 0.00 0.00 0.00 46.02 45.18 2wri n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wri n ALA 160 N 1.01 -3.98 -0.05 4.61 0.00 -0.43 -4.92 120.51 116.75 2wri n ALA 160 Ca -0.00 -1.31 -0.05 0.00 0.00 0.00 0.00 53.44 52.08 2wri n ALA 160 Cb 0.03 -1.53 -0.15 0.00 0.00 0.00 0.00 19.45 17.80 2wri n ALA 160 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2wri n GLU 161 N -2.44 0.67 -3.56 0.00 2.13 -1.26 -4.70 120.64 111.48 2wri n GLU 161 Ca 0.01 0.05 -0.40 0.00 0.66 0.00 0.00 57.16 57.48 2wri n GLU 161 Cb 0.61 -1.61 -0.11 0.00 0.27 0.00 0.00 31.44 30.60 2wri n GLU 161 CO 0.00 0.00 0.00 -1.14 -0.41 0.00 0.00 177.13 175.58 2wri s GLN 162 N -2.73 3.46 0.07 5.31 2.00 -1.26 -5.01 119.66 121.50 2wri s GLN 162 Ca -0.08 -0.66 -0.31 0.00 -2.00 0.00 0.00 55.36 52.31 2wri s GLN 162 Cb 0.08 -3.76 -0.08 0.00 0.80 0.00 0.00 33.01 30.05 2wri s GLN 162 CO 0.84 -0.44 1.65 0.00 -0.50 0.00 0.00 175.29 176.84 2wri s ALA 163 N 1.70 3.68 0.00 1.58 0.00 -1.26 -4.57 121.76 122.90 2wri s ALA 163 Ca 0.06 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.22 2wri s ALA 163 Cb -0.17 -3.70 0.00 0.00 0.00 0.00 0.00 23.12 19.25 2wri s ALA 163 CO 0.10 -1.11 0.00 0.54 0.00 0.00 0.00 175.76 175.29 2wri n ARG 164 N 5.61 2.46 -3.15 0.00 1.74 -1.26 -4.83 116.66 117.23 2wri n ARG 164 Ca 0.16 0.00 0.06 0.00 -0.77 0.00 0.00 57.85 57.29 2wri n ARG 164 Cb 0.40 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.82 2wri n ARG 164 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2wri s THR 165 N 4.79 -0.01 -0.15 0.55 -1.32 -1.04 -3.79 115.64 114.67 2wri s THR 165 Ca 0.00 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.38 2wri s THR 165 Cb 0.00 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 69.94 2wri s THR 165 CO 0.00 0.00 0.19 -0.70 -2.21 0.00 0.00 174.62 171.90 2wri s GLU 166 N 2.81 3.97 0.00 7.08 2.56 0.27 -4.93 118.70 130.45 2wri s GLU 166 Ca -0.09 -0.08 0.00 0.00 0.00 0.00 0.00 54.97 54.80 2wri s GLU 166 Cb -0.07 -3.34 0.00 0.00 2.00 0.00 0.00 34.13 32.72 2wri s GLU 166 CO -0.08 0.45 0.00 1.87 -0.56 0.00 0.00 175.26 176.94 2wri n TRP 167 N 2.96 0.00 -0.63 5.30 -0.00 -1.26 -0.80 117.44 123.01 2wri n TRP 167 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.34 2wri n TRP 167 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.84 2wri n TRP 167 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2wri n ALA 168 N -3.00 -1.36 -3.36 5.87 0.00 -1.25 -4.39 120.51 113.03 2wri n ALA 168 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2wri n ALA 168 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2wri n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wri n ALA 169 N 0.80 0.00 -3.63 0.00 0.00 -1.26 -2.45 120.51 113.96 2wri n ALA 169 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2wri n ALA 169 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2wri n ALA 169 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2wri s GLN 170 N -1.45 0.12 5.20 0.00 0.74 -0.62 -4.97 119.66 118.68 2wri s GLN 170 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 55.36 55.43 2wri s GLN 170 Cb 0.00 0.06 0.00 0.00 1.10 0.00 0.00 33.01 34.17 2wri s GLN 170 CO 0.00 -0.04 0.00 0.41 -0.55 0.00 0.00 175.29 175.11 2wri n GLY 171 N 0.50 0.98 3.28 2.59 0.00 -1.26 -1.21 105.19 110.07 2wri n GLY 171 Ca -0.01 -0.72 -0.26 0.00 0.00 0.00 0.00 46.02 45.04 2wri n GLY 171 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wri s ARG 172 N 0.00 1.35 -0.44 1.61 0.52 -1.07 -4.87 118.95 116.05 2wri s ARG 172 Ca 0.00 -1.06 0.06 0.00 -0.52 0.00 0.00 55.73 54.22 2wri s ARG 172 Cb 0.00 -1.55 0.22 0.00 0.52 0.00 0.00 34.95 34.14 2wri s ARG 172 CO 0.00 0.38 0.61 0.28 0.02 0.00 0.00 175.30 176.59 2wri n VAL 173 N 1.54 -0.53 -0.62 3.52 0.31 -1.26 -3.74 118.33 117.55 2wri n VAL 173 Ca -0.18 -2.71 -0.20 0.00 -0.01 0.00 0.00 64.34 61.24 2wri n VAL 173 Cb 0.53 -0.50 -0.02 0.00 -0.91 0.00 0.00 33.84 32.94 2wri n VAL 173 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2wri n PRO 174 N 2.09 1.52 0.17 5.55 -0.02 -1.26 -4.76 135.00 138.30 2wri n PRO 174 Ca 0.20 -1.28 0.19 0.00 -2.02 0.00 0.00 63.50 60.58 2wri n PRO 174 Cb 0.55 -2.41 0.79 0.00 -0.02 0.00 0.00 33.50 32.42 2wri n PRO 174 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2wri h LEU 175 N 9.53 0.00 -0.11 2.45 4.07 -2.01 0.33 115.31 129.57 2wri h LEU 175 Ca 0.38 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.34 2wri h LEU 175 Cb 0.19 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.93 2wri h LEU 175 CO 1.42 0.00 0.00 0.45 -1.08 0.00 0.00 178.44 179.23 2wri h HIS 176 N 0.00 0.00 -3.23 1.13 3.86 -2.03 -3.44 115.15 111.44 2wri h HIS 176 Ca 0.12 0.00 -0.59 0.00 -1.16 0.00 0.00 60.37 58.75 2wri h HIS 176 Cb 0.81 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 29.21 2wri h HIS 176 CO 0.00 0.00 -0.17 0.99 0.86 0.00 0.00 177.93 179.61 2wri s THR 177 N -3.14 5.13 -0.01 2.45 2.01 0.10 -5.04 115.64 117.14 2wri s THR 177 Ca 0.09 0.89 -0.01 0.00 0.31 0.00 0.00 61.69 62.98 2wri s THR 177 Cb 0.11 -3.77 -0.00 0.00 0.01 0.00 0.00 72.50 68.85 2wri s THR 177 CO 0.57 0.42 0.21 -0.07 -0.69 0.00 0.00 174.62 175.07 2wri h LEU 178 N 5.99 -0.02 -7.11 4.42 -0.00 -1.86 -3.35 115.31 113.38 2wri h LEU 178 Ca -0.45 0.00 -0.49 0.00 -0.00 0.00 0.00 57.88 56.94 2wri h LEU 178 Cb 1.19 0.01 0.07 0.00 -0.00 0.00 0.00 40.66 41.93 2wri h LEU 178 CO 0.71 0.02 1.44 -2.11 -0.00 0.00 0.00 178.44 178.50 2wri n ARG 179 N -2.29 0.72 0.00 1.13 1.85 -1.26 -3.52 116.66 113.29 2wri n ARG 179 Ca -0.00 -1.57 0.00 0.00 -1.00 0.00 0.00 57.85 55.27 2wri n ARG 179 Cb 0.01 -3.01 0.00 0.00 -1.05 0.00 0.00 32.46 28.41 2wri n ARG 179 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2wri n ALA 180 N 10.80 1.77 -2.74 2.89 0.00 -1.26 -4.17 120.51 127.80 2wri n ALA 180 Ca 0.47 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.86 2wri n ALA 180 Cb 0.43 0.22 0.01 0.00 0.00 0.00 0.00 19.45 20.10 2wri n ALA 180 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2wri n ASN 181 N -1.70 -7.21 -4.00 0.00 5.15 -1.23 -4.32 115.26 101.96 2wri n ASN 181 Ca 0.00 0.32 -0.31 0.00 -0.60 0.00 0.00 54.58 53.99 2wri n ASN 181 Cb 0.33 -4.85 -0.16 0.00 -0.53 0.00 0.00 39.78 34.57 2wri n ASN 181 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2wri s ILE 182 N -2.59 1.71 0.45 -1.44 1.01 -1.26 -2.55 121.20 116.54 2wri s ILE 182 Ca 0.16 -1.14 -0.23 0.00 0.00 0.00 0.00 60.65 59.44 2wri s ILE 182 Cb -0.04 -1.82 -0.08 0.00 0.01 0.00 0.00 42.46 40.53 2wri s ILE 182 CO 0.67 0.10 1.12 -0.62 0.00 0.00 0.00 174.94 176.21 2wri s ASP 183 N 1.35 6.29 -0.01 3.58 3.68 -0.18 -4.80 116.67 126.58 2wri s ASP 183 Ca -0.03 2.19 0.00 0.00 2.13 0.00 0.00 52.55 56.84 2wri s ASP 183 Cb -0.17 -2.59 0.01 0.00 -1.45 0.00 0.00 42.92 38.72 2wri s ASP 183 CO -0.07 -0.82 -0.00 -0.47 0.13 0.00 0.00 175.17 173.93 2wri s TYR 184 N -1.64 0.14 0.08 -5.34 5.04 -1.26 -1.08 117.35 113.29 2wri s TYR 184 Ca 0.63 0.01 0.04 0.00 -2.44 0.00 0.00 57.07 55.32 2wri s TYR 184 Cb -0.25 -0.17 -0.03 0.00 0.35 0.00 0.00 41.96 41.86 2wri s TYR 184 CO 0.31 -0.04 -0.12 0.20 -1.34 0.00 0.00 175.55 174.55 2wri s GLY 185 N 0.38 0.83 -0.01 8.97 0.00 -0.88 -4.35 107.32 112.25 2wri s GLY 185 Ca -0.03 -1.03 0.01 0.00 0.00 0.00 0.00 44.72 43.66 2wri s GLY 185 CO -0.01 -1.08 -0.02 -0.12 0.00 0.00 0.00 173.10 171.87 2wri s PHE 186 N -1.61 0.32 0.26 1.90 5.36 -1.26 -1.00 117.98 121.95 2wri s PHE 186 Ca -0.01 -0.04 0.02 0.00 -0.96 0.00 0.00 56.93 55.95 2wri s PHE 186 Cb -0.08 -0.29 -0.05 0.00 -0.34 0.00 0.00 43.02 42.26 2wri s PHE 186 CO 0.02 -0.06 0.05 0.00 -1.46 0.00 0.00 175.22 173.77 2wri s ALA 187 N 0.35 1.85 -0.49 11.12 0.00 -0.36 -4.89 121.76 129.34 2wri s ALA 187 Ca -0.03 -1.86 0.03 0.00 0.00 0.00 0.00 51.96 50.10 2wri s ALA 187 Cb -0.06 0.77 0.13 0.00 0.00 0.00 0.00 23.12 23.96 2wri s ALA 187 CO -0.01 -0.36 0.24 -0.51 0.00 0.00 0.00 175.76 175.13 2wri s LEU 188 N -3.33 3.89 -0.61 0.00 2.01 -1.26 -2.00 118.68 117.37 2wri s LEU 188 Ca 0.34 -2.86 -0.27 0.00 0.01 0.00 0.00 54.13 51.34 2wri s LEU 188 Cb 0.07 -1.48 -0.00 0.00 0.01 0.00 0.00 46.19 44.80 2wri s LEU 188 CO 0.12 -0.25 1.61 0.00 1.01 0.00 0.00 176.35 178.84 2wri s ALA 189 N -0.06 2.51 -0.50 4.21 0.00 0.06 -4.87 121.76 123.11 2wri s ALA 189 Ca 0.17 -0.76 -0.18 0.00 0.00 0.00 0.00 51.96 51.18 2wri s ALA 189 Cb -0.25 -4.22 0.06 0.00 0.00 0.00 0.00 23.12 18.71 2wri s ALA 189 CO -0.00 -3.43 0.58 -0.98 0.00 0.00 0.00 175.76 171.92 2wri s ARG 190 N 6.26 3.09 0.62 0.00 1.70 -1.26 -0.83 118.95 128.53 2wri s ARG 190 Ca 0.57 -1.01 0.05 0.00 -0.47 0.00 0.00 55.73 54.87 2wri s ARG 190 Cb -0.12 -4.11 0.10 0.00 -0.57 0.00 0.00 34.95 30.25 2wri s ARG 190 CO 0.21 -1.19 0.86 0.95 -1.08 0.00 0.00 175.30 175.06 2wri s THR 191 N 2.41 2.20 0.23 4.99 -4.23 -0.42 -4.98 115.64 115.83 2wri s THR 191 Ca 0.12 -0.83 -0.03 0.00 -1.18 0.00 0.00 61.69 59.78 2wri s THR 191 Cb -0.21 -2.37 0.04 0.00 1.34 0.00 0.00 72.50 71.31 2wri s THR 191 CO 0.10 0.00 1.65 0.74 -0.54 0.00 0.00 174.62 176.58 2wri h THR 192 N -0.09 1.27 -2.07 3.99 2.02 -1.98 -3.20 112.91 112.86 2wri h THR 192 Ca -0.33 -1.31 -0.79 0.00 0.77 0.00 0.00 66.41 64.75 2wri h THR 192 Cb 1.28 1.23 -0.25 0.00 -1.74 0.00 0.00 68.15 68.67 2wri h THR 192 CO 0.41 0.43 1.18 0.00 0.37 0.00 0.00 175.52 177.91 2wri n TYR 193 N -4.12 2.75 -1.01 3.16 0.18 -1.26 -5.02 117.16 111.85 2wri n TYR 193 Ca 0.00 -2.54 0.00 0.00 1.88 0.00 0.00 57.90 57.24 2wri n TYR 193 Cb 0.42 -1.27 0.00 0.00 -0.38 0.00 0.00 39.34 38.11 2wri n TYR 193 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2wri n GLY 194 N 0.09 -1.79 3.53 -7.48 0.00 -1.21 -5.00 105.19 93.34 2wri n GLY 194 Ca 0.50 -1.88 -0.31 0.00 0.00 0.00 0.00 46.02 44.33 2wri n GLY 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wri s VAL 195 N 0.00 3.21 -0.08 1.61 1.01 -1.26 -1.30 120.40 123.59 2wri s VAL 195 Ca 0.00 -1.12 0.01 0.00 0.00 0.00 0.00 61.98 60.88 2wri s VAL 195 Cb 0.00 -2.42 0.02 0.00 0.00 0.00 0.00 36.38 33.98 2wri s VAL 195 CO 0.00 0.27 -0.11 -0.76 0.00 0.00 0.00 175.10 174.50 2wri s LEU 196 N -1.72 1.51 0.02 3.92 2.01 -0.01 -4.78 118.68 119.63 2wri s LEU 196 Ca 0.18 -0.29 -0.17 0.00 0.01 0.00 0.00 54.13 53.86 2wri s LEU 196 Cb -0.11 -0.81 -0.06 0.00 0.01 0.00 0.00 46.19 45.23 2wri s LEU 196 CO 0.09 -0.01 0.49 -0.83 1.01 0.00 0.00 176.35 177.09 2wri s GLY 197 N 0.96 2.56 -0.03 -3.19 0.00 -1.26 -0.76 107.32 105.59 2wri s GLY 197 Ca -0.09 -0.10 0.04 0.00 0.00 0.00 0.00 44.72 44.57 2wri s GLY 197 CO 0.00 0.36 -0.15 0.14 0.00 0.00 0.00 173.10 173.45 2wri s VAL 198 N -0.89 1.25 0.05 1.40 1.01 -0.85 -0.27 120.40 122.11 2wri s VAL 198 Ca 0.26 -0.64 0.03 0.00 0.00 0.00 0.00 61.98 61.63 2wri s VAL 198 Cb -0.18 -1.07 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 2wri s VAL 198 CO 0.15 0.36 -0.09 -0.54 0.00 0.00 0.00 175.10 174.99 2wri s LYS 199 N -0.09 0.62 0.02 2.72 1.02 -0.57 -1.22 119.74 122.24 2wri s LYS 199 Ca 0.00 -0.85 0.03 0.00 0.02 0.00 0.00 55.97 55.17 2wri s LYS 199 Cb -0.09 -0.41 -0.02 0.00 -0.52 0.00 0.00 37.83 36.79 2wri s LYS 199 CO 0.01 0.08 -0.09 0.00 -0.92 0.00 0.00 175.35 174.42 2wri s ALA 200 N -1.55 0.71 -0.09 5.17 0.00 -0.17 -2.37 121.76 123.47 2wri s ALA 200 Ca -0.06 -0.58 -0.01 0.00 0.00 0.00 0.00 51.96 51.31 2wri s ALA 200 Cb -0.09 -0.09 0.03 0.00 0.00 0.00 0.00 23.12 22.97 2wri s ALA 200 CO 0.00 0.10 -0.05 0.71 0.00 0.00 0.00 175.76 176.53 2wri s TYR 201 N -0.74 1.11 -0.12 0.00 1.51 0.91 -2.08 117.35 117.93 2wri s TYR 201 Ca -0.02 -0.46 0.02 0.00 -1.01 0.00 0.00 57.07 55.60 2wri s TYR 201 Cb -0.06 -1.01 0.01 0.00 -0.11 0.00 0.00 41.96 40.79 2wri s TYR 201 CO 0.00 -0.40 -0.19 0.42 -1.11 0.00 0.00 175.55 174.27 2wri s ILE 202 N 1.69 1.78 -0.39 2.71 -1.09 -0.24 -0.98 121.20 124.67 2wri s ILE 202 Ca 0.03 -0.81 -0.12 0.00 -2.23 0.00 0.00 60.65 57.51 2wri s ILE 202 Cb -0.13 -1.59 0.03 0.00 -1.58 0.00 0.00 42.46 39.19 2wri s ILE 202 CO -0.06 0.50 0.25 0.12 -1.23 0.00 0.00 174.94 174.52 2wri s PHE 203 N 0.85 3.25 0.00 3.97 5.36 0.11 -1.01 117.98 130.51 2wri s PHE 203 Ca -0.08 -0.86 0.00 0.00 -0.96 0.00 0.00 56.93 55.03 2wri s PHE 203 Cb -0.15 -2.54 0.00 0.00 -0.34 0.00 0.00 43.02 39.98 2wri s PHE 203 CO -0.01 -0.65 0.00 1.28 -1.46 0.00 0.00 175.22 174.39 2wri n LEU 204 N 5.06 0.00 0.00 6.12 4.77 -1.06 -2.02 117.00 129.87 2wri n LEU 204 Ca -0.11 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.66 2wri n LEU 204 Cb 0.46 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.72 2wri n LEU 204 CO 0.39 0.00 0.42 0.61 -1.33 0.00 0.00 177.39 177.47 2wri n GLY 205 N 4.55 -2.63 0.00 -0.72 0.00 -1.26 -4.56 105.19 100.58 2wri n GLY 205 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.53 2wri n GLY 205 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2wri n GLU 206 N -3.72 0.00 -1.41 1.61 2.13 -1.26 -4.25 120.64 113.73 2wri n GLU 206 Ca 0.10 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.92 2wri n GLU 206 Cb 0.40 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.11 2wri n GLU 206 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2wri n VAL 207 N 0.00 0.00 0.00 6.31 0.31 -1.26 -4.89 118.33 118.80 2wri n VAL 207 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2wri n VAL 207 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2wri n VAL 207 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81