#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1war h ALA -5 N 0.00 1.73 -0.00 0.62 0.00 -2.10 -2.82 119.26 116.69 1war h ALA -5 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1war h ALA -5 Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1war h ALA -5 CO 0.00 0.25 -0.27 -0.85 0.00 0.00 0.00 179.25 178.38 1war n GLU -4 N -4.48 0.41 -2.52 0.00 0.00 -1.26 -4.81 120.64 107.99 1war n GLU -4 Ca 0.03 -0.20 -0.43 0.00 0.00 0.00 0.00 57.16 56.57 1war n GLU -4 Cb 0.07 -1.50 -0.02 0.00 0.00 0.00 0.00 31.44 30.00 1war n GLU -4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1war s ALA -3 N -2.72 3.64 -0.28 -1.84 0.00 -1.07 -5.00 121.76 114.49 1war s ALA -3 Ca 0.20 0.38 -0.06 0.00 0.00 0.00 0.00 51.96 52.48 1war s ALA -3 Cb 0.19 -3.57 0.01 0.00 0.00 0.00 0.00 23.12 19.74 1war s ALA -3 CO 0.57 -1.05 0.06 -2.00 0.00 0.00 0.00 175.76 173.34 1war s GLU -2 N 3.16 3.10 -0.16 0.00 2.12 -1.26 -4.96 118.70 120.71 1war s GLU -2 Ca 0.51 -0.84 0.00 0.00 0.36 0.00 0.00 54.97 55.00 1war s GLU -2 Cb -0.20 -3.31 0.03 0.00 0.26 0.00 0.00 34.13 30.91 1war s GLU -2 CO 0.13 -0.41 -0.13 -0.06 -0.54 0.00 0.00 175.26 174.25 1war s PHE -1 N 1.48 2.15 0.42 5.30 0.40 -1.26 -5.13 117.98 121.34 1war s PHE -1 Ca 0.03 -1.26 -0.23 0.00 -0.60 0.00 0.00 56.93 54.87 1war s PHE -1 Cb -0.17 -1.57 -0.09 0.00 0.51 0.00 0.00 43.02 41.70 1war s PHE -1 CO 0.01 -0.67 1.04 0.00 0.70 0.00 0.00 175.22 176.30 1war s ALA 1 N 1.49 3.03 -0.23 5.36 0.00 -1.26 -5.02 121.76 125.14 1war s ALA 1 Ca 0.04 0.66 -0.29 0.00 0.00 0.00 0.00 51.96 52.37 1war s ALA 1 Cb -0.14 -3.26 0.01 0.00 0.00 0.00 0.00 23.12 19.73 1war s ALA 1 CO -0.10 -0.22 1.04 0.99 0.00 0.00 0.00 175.76 177.47 1war s THR 2 N -1.76 4.68 0.37 0.00 2.01 -1.26 -5.03 115.64 114.66 1war s THR 2 Ca 0.60 2.03 -0.27 0.00 0.31 0.00 0.00 61.69 64.36 1war s THR 2 Cb -0.20 -4.31 -0.09 0.00 0.01 0.00 0.00 72.50 67.91 1war s THR 2 CO 0.25 -0.18 1.30 -2.84 -0.69 0.00 0.00 174.62 172.46 1war s PRO 3 N 3.19 4.15 -0.07 4.92 0.02 -1.26 -5.03 135.00 140.91 1war s PRO 3 Ca 0.44 2.18 -0.15 0.00 0.02 0.00 0.00 61.00 63.49 1war s PRO 3 Cb -0.15 -2.90 0.03 0.00 0.02 0.00 0.00 34.50 31.50 1war s PRO 3 CO 0.06 -0.34 0.35 0.00 -0.33 0.00 0.00 177.00 176.74 1war s ALA 4 N -1.21 -0.89 0.06 -1.55 0.00 -1.26 -4.46 121.76 112.45 1war s ALA 4 Ca 0.53 0.71 -0.27 0.00 0.00 0.00 0.00 51.96 52.93 1war s ALA 4 Cb -0.39 -0.25 -0.05 0.00 0.00 0.00 0.00 23.12 22.43 1war s ALA 4 CO 0.50 -0.22 0.84 -1.17 0.00 0.00 0.00 175.76 175.71 1war s LEU 5 N -0.60 4.45 -0.05 0.00 2.96 -0.08 -4.71 118.68 120.66 1war s LEU 5 Ca -0.07 1.56 0.03 0.00 -0.22 0.00 0.00 54.13 55.42 1war s LEU 5 Cb -0.04 -3.36 0.01 0.00 0.50 0.00 0.00 46.19 43.30 1war s LEU 5 CO 0.03 -0.03 -0.12 -0.13 -1.32 0.00 0.00 176.35 174.78 1war s ARG 6 N 0.07 1.42 0.09 1.98 0.52 -1.26 0.01 118.95 121.77 1war s ARG 6 Ca 0.42 -0.39 -0.13 0.00 -0.52 0.00 0.00 55.73 55.10 1war s ARG 6 Cb -0.21 -1.24 0.02 0.00 0.52 0.00 0.00 34.95 34.04 1war s ARG 6 CO 0.25 0.08 0.31 -0.59 0.02 0.00 0.00 175.30 175.38 1war s PHE 7 N 0.43 -0.08 -0.14 -0.53 -0.12 -0.28 -0.23 117.98 117.04 1war s PHE 7 Ca -0.09 -0.20 -0.08 0.00 -0.05 0.00 0.00 56.93 56.50 1war s PHE 7 Cb -0.13 0.12 -0.04 0.00 -0.63 0.00 0.00 43.02 42.34 1war s PHE 7 CO 0.02 -0.59 0.15 0.08 -0.05 0.00 0.00 175.22 174.83 1war s VAL 8 N -3.37 5.46 -0.21 -2.49 1.01 -1.06 -0.72 120.40 119.02 1war s VAL 8 Ca 0.01 0.24 0.01 0.00 0.00 0.00 0.00 61.98 62.24 1war s VAL 8 Cb 0.02 -3.44 0.04 0.00 0.00 0.00 0.00 36.38 33.00 1war s VAL 8 CO -0.09 0.57 -0.13 0.00 0.00 0.00 0.00 175.10 175.45 1war s ALA 9 N -0.64 2.24 -0.03 5.51 0.00 0.33 -0.52 121.76 128.64 1war s ALA 9 Ca 0.14 -1.35 0.02 0.00 0.00 0.00 0.00 51.96 50.76 1war s ALA 9 Cb -0.12 -1.33 0.01 0.00 0.00 0.00 0.00 23.12 21.68 1war s ALA 9 CO 0.03 -0.78 -0.06 0.54 0.00 0.00 0.00 175.76 175.49 1war s VAL 10 N 1.29 0.55 0.18 0.00 0.11 -0.80 -2.46 120.40 119.27 1war s VAL 10 Ca -0.01 -0.21 0.08 0.00 -2.93 0.00 0.00 61.98 58.91 1war s VAL 10 Cb -0.16 -0.52 -0.04 0.00 -1.53 0.00 0.00 36.38 34.13 1war s VAL 10 CO -0.09 0.19 -0.15 -0.83 -3.33 0.00 0.00 175.10 170.89 1war s GLY 11 N 0.41 1.37 -1.31 6.54 0.00 -0.40 -1.46 107.32 112.46 1war s GLY 11 Ca -0.05 -1.56 -0.02 0.00 0.00 0.00 0.00 44.72 43.08 1war s GLY 11 CO 0.00 -1.64 0.85 1.22 0.00 0.00 0.00 173.10 173.53 1war n ASP 12 N -0.07 -2.20 -1.03 1.64 8.00 -0.23 -1.94 116.55 120.72 1war n ASP 12 Ca -0.10 -0.74 0.12 0.00 0.71 0.00 0.00 54.79 54.77 1war n ASP 12 Cb 0.59 -4.39 0.17 0.00 -0.02 0.00 0.00 41.12 37.46 1war n ASP 12 CO 0.00 0.00 0.00 -2.67 -0.39 0.00 0.00 177.20 174.14 1war n TRP 13 N -4.34 0.23 0.37 1.24 4.27 -1.19 -2.80 117.44 115.22 1war n TRP 13 Ca -0.24 -0.11 0.00 0.00 -3.89 0.00 0.00 57.50 53.26 1war n TRP 13 Cb 0.65 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.60 1war n TRP 13 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1war n GLY 14 N 1.41 1.35 7.00 -1.67 0.00 -1.06 -4.72 105.19 107.50 1war n GLY 14 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1war n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1war n GLY 15 N 0.95 2.64 3.04 -0.02 0.00 -1.26 -0.87 105.19 109.67 1war n GLY 15 Ca 0.00 -0.42 -0.08 0.00 0.00 0.00 0.00 46.02 45.52 1war n GLY 15 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1war s VAL 16 N 0.00 0.16 -0.95 1.61 -7.23 -1.24 -4.55 120.40 108.21 1war s VAL 16 Ca 0.00 -1.35 0.23 0.00 -1.81 0.00 0.00 61.98 59.05 1war s VAL 16 Cb 0.00 -0.90 0.20 0.00 0.56 0.00 0.00 36.38 36.24 1war s VAL 16 CO 0.00 -0.75 1.74 -0.81 -0.31 0.00 0.00 175.10 174.98 1war n PRO 17 N 0.84 0.03 -4.16 4.82 -0.04 -1.09 -4.22 135.00 131.18 1war n PRO 17 Ca -0.19 0.13 -0.29 0.00 -0.04 0.00 0.00 63.50 63.11 1war n PRO 17 Cb 0.58 -1.54 -0.08 0.00 -0.04 0.00 0.00 33.50 32.41 1war n PRO 17 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1war s ASN 18 N -3.19 4.82 0.30 3.54 -0.87 -1.26 -4.94 114.94 113.35 1war s ASN 18 Ca 0.11 -0.27 -0.27 0.00 -1.57 0.00 0.00 52.86 50.85 1war s ASN 18 Cb 0.15 -1.07 -0.14 0.00 -0.02 0.00 0.00 41.25 40.16 1war s ASN 18 CO 0.43 0.16 0.93 0.00 -2.57 0.00 0.00 177.10 176.05 1war n ALA 19 N 0.47 -0.56 0.04 0.60 0.00 -1.26 -1.40 120.51 118.40 1war n ALA 19 Ca -0.11 0.37 0.01 0.00 0.00 0.00 0.00 53.44 53.70 1war n ALA 19 Cb 0.53 -1.96 0.18 0.00 0.00 0.00 0.00 19.45 18.19 1war n ALA 19 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1war n PRO 20 N 0.70 2.69 -1.08 0.00 -0.04 -1.26 -4.94 135.00 131.07 1war n PRO 20 Ca 0.11 -1.53 -0.03 0.00 -0.04 0.00 0.00 63.50 62.01 1war n PRO 20 Cb 0.32 -1.83 -0.01 0.00 -0.04 0.00 0.00 33.50 31.95 1war n PRO 20 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1war n PHE 21 N 0.20 0.00 -3.84 0.54 3.72 -0.50 -4.87 117.46 112.71 1war n PHE 21 Ca 0.16 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.48 1war n PHE 21 Cb 0.78 -0.84 -0.03 0.00 -0.94 0.00 0.00 39.48 38.45 1war n PHE 21 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 176.76 173.33 1war s HIS 22 N -2.04 -0.05 0.34 1.38 -3.43 -1.26 -3.61 115.29 106.62 1war s HIS 22 Ca 0.00 -0.34 0.07 0.00 -0.80 0.00 0.00 55.06 53.99 1war s HIS 22 Cb 0.00 0.49 -0.07 0.00 -1.43 0.00 0.00 32.58 31.57 1war s HIS 22 CO 0.00 -1.08 -0.04 0.95 -2.00 0.00 0.00 174.74 172.57 1war s THR 23 N -3.92 1.86 0.29 -5.38 -4.23 -1.26 -4.68 115.64 98.32 1war s THR 23 Ca 0.13 -2.11 -0.01 0.00 -1.18 0.00 0.00 61.69 58.53 1war s THR 23 Cb -0.03 -2.68 0.28 0.00 1.34 0.00 0.00 72.50 71.40 1war s THR 23 CO 0.04 -0.16 1.91 0.00 -0.54 0.00 0.00 174.62 175.87 1war h ALA 24 N 2.06 1.47 -0.36 3.99 0.00 -1.99 -2.04 119.26 122.37 1war h ALA 24 Ca -0.42 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 1war h ALA 24 Cb 1.24 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1war h ALA 24 CO 0.72 0.40 -0.04 0.00 0.00 0.00 0.00 179.25 180.33 1war h ARG 25 N 1.09 0.67 -0.72 0.00 3.08 -1.83 -1.34 114.38 115.33 1war h ARG 25 Ca 0.39 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 1war h ARG 25 Cb 0.15 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1war h ARG 25 CO -0.14 0.80 0.41 1.49 -1.07 0.00 0.00 179.97 181.46 1war h GLU 26 N 0.48 0.99 -0.19 0.04 4.81 -1.48 -1.63 114.58 117.60 1war h GLU 26 Ca 0.10 -0.10 -0.13 0.00 -0.13 0.00 0.00 59.36 59.09 1war h GLU 26 Cb 0.52 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1war h GLU 26 CO 0.03 0.72 -0.39 0.52 -0.73 0.00 0.00 179.01 179.15 1war h MET 27 N 0.99 0.60 -0.70 1.92 2.86 -1.36 -1.09 114.93 118.14 1war h MET 27 Ca 0.26 -0.40 0.06 0.00 -2.06 0.00 0.00 59.70 57.56 1war h MET 27 Cb 0.00 0.05 -0.06 0.00 0.06 0.00 0.00 31.60 31.66 1war h MET 27 CO -0.04 1.01 0.40 0.00 1.06 0.00 0.00 176.91 179.34 1war h ALA 28 N 0.59 0.94 -0.26 6.32 0.00 -1.11 -2.07 119.26 123.68 1war h ALA 28 Ca 0.00 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1war h ALA 28 Cb 1.00 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1war h ALA 28 CO 0.09 0.09 -0.36 -0.91 0.00 0.00 0.00 179.25 178.16 1war h ASN 29 N 0.74 0.60 -0.92 0.00 2.35 -1.17 -1.41 115.58 115.77 1war h ASN 29 Ca 0.31 -0.25 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1war h ASN 29 Cb 0.18 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.34 1war h ASN 29 CO -0.18 0.91 0.53 0.00 -1.65 0.00 0.00 177.43 177.04 1war h ALA 30 N 1.13 1.17 -0.09 -0.83 0.00 -0.82 0.13 119.26 119.95 1war h ALA 30 Ca 0.05 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1war h ALA 30 Cb 0.85 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1war h ALA 30 CO 0.07 0.66 -0.03 -0.22 0.00 0.00 0.00 179.25 179.73 1war h LYS 31 N 1.28 0.19 -0.08 0.00 1.63 -1.01 -1.85 116.57 116.72 1war h LYS 31 Ca 0.33 -0.07 -0.10 0.00 -0.85 0.00 0.00 60.65 59.95 1war h LYS 31 Cb -0.01 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.60 1war h LYS 31 CO -0.06 0.52 -0.40 1.49 -3.45 0.00 0.00 179.45 177.55 1war h GLU 32 N -0.16 0.17 -0.49 1.90 4.57 -1.02 -0.59 114.58 118.96 1war h GLU 32 Ca 0.02 -0.08 -0.04 0.00 -1.18 0.00 0.00 59.36 58.09 1war h GLU 32 Cb 0.45 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.02 1war h GLU 32 CO 0.01 0.55 0.15 0.82 -1.18 0.00 0.00 179.01 179.36 1war h ILE 33 N 0.14 1.23 -0.44 2.32 2.04 -0.74 -0.78 117.51 121.29 1war h ILE 33 Ca 0.01 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.10 1war h ILE 33 Cb 0.78 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 1war h ILE 33 CO 0.06 0.28 0.28 0.00 0.00 0.00 0.00 178.15 178.78 1war h ALA 34 N 1.01 0.55 -0.93 1.87 0.00 -0.89 -1.28 119.26 119.60 1war h ALA 34 Ca 0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1war h ALA 34 Cb 0.28 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1war h ALA 34 CO -0.00 0.02 0.53 0.00 0.00 0.00 0.00 179.25 179.80 1war h ARG 35 N 0.59 1.27 -0.50 0.00 3.08 -0.93 -1.69 114.38 116.20 1war h ARG 35 Ca 0.16 -0.13 -0.07 0.00 0.07 0.00 0.00 59.98 60.01 1war h ARG 35 Cb -0.05 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 29.72 1war h ARG 35 CO -0.03 0.91 0.03 1.15 -1.07 0.00 0.00 179.97 180.95 1war h THR 36 N 1.29 1.24 -0.25 2.04 2.02 -0.84 -1.14 112.91 117.27 1war h THR 36 Ca 0.33 -0.98 -0.14 0.00 0.77 0.00 0.00 66.41 66.40 1war h THR 36 Cb -0.02 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 1war h THR 36 CO -0.06 0.35 -0.41 0.58 0.37 0.00 0.00 175.52 176.36 1war h VAL 37 N 0.77 1.30 0.00 3.16 2.07 -0.87 -0.38 116.25 122.30 1war h VAL 37 Ca 0.15 -1.57 -0.07 0.00 0.82 0.00 0.00 66.70 66.03 1war h VAL 37 Cb 0.43 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1war h VAL 37 CO 0.02 0.50 -0.31 0.06 0.02 0.00 0.00 177.57 177.85 1war h GLN 38 N 0.50 0.00 0.00 1.57 3.07 -0.80 -1.88 115.11 117.57 1war h GLN 38 Ca 0.04 0.00 -0.44 0.00 0.09 0.00 0.00 58.65 58.35 1war h GLN 38 Cb 0.92 0.00 -0.07 0.00 0.08 0.00 0.00 27.48 28.41 1war h GLN 38 CO 0.08 0.31 -2.48 -0.89 0.09 0.00 0.00 178.83 175.95 1war n ILE 39 N -3.21 1.46 -0.03 1.86 5.41 -0.48 -4.72 119.36 119.65 1war n ILE 39 Ca 0.02 -0.40 -0.02 0.00 1.00 0.00 0.00 62.75 63.35 1war n ILE 39 Cb 0.63 -1.78 -0.13 0.00 -0.71 0.00 0.00 39.64 37.65 1war n ILE 39 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1war n LEU 40 N -4.02 0.37 0.00 1.39 4.77 -0.17 -5.10 117.00 114.24 1war n LEU 40 Ca -0.51 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 1war n LEU 40 Cb 0.89 0.23 0.00 0.00 -2.33 0.00 0.00 43.42 42.21 1war n LEU 40 CO 0.07 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1war n GLY 41 N 1.51 0.73 3.63 -0.72 0.00 -0.70 -5.02 105.19 104.62 1war n GLY 41 Ca -0.18 -1.72 -0.10 0.00 0.00 0.00 0.00 46.02 44.02 1war n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1war s ALA 42 N -2.91 -1.82 0.04 4.61 0.00 -1.26 -4.67 121.76 115.75 1war s ALA 42 Ca 0.00 2.24 0.09 0.00 0.00 0.00 0.00 51.96 54.29 1war s ALA 42 Cb 0.00 -1.31 -0.22 0.00 0.00 0.00 0.00 23.12 21.58 1war s ALA 42 CO 0.00 -0.36 0.98 -0.44 0.00 0.00 0.00 175.76 175.94 1war h ASP 43 N 6.16 0.03 -5.01 0.00 5.19 -1.01 -3.49 116.42 118.30 1war h ASP 43 Ca -0.30 -0.04 0.06 0.00 -0.62 0.00 0.00 57.03 56.13 1war h ASP 43 Cb 1.20 -0.01 -0.04 0.00 0.18 0.00 0.00 39.33 40.66 1war h ASP 43 CO 0.12 1.03 0.24 0.72 -3.12 0.00 0.00 179.24 178.23 1war s PHE 44 N -2.65 -0.15 -0.07 4.55 -0.12 -1.22 -4.41 117.98 113.91 1war s PHE 44 Ca -0.02 -0.34 0.05 0.00 -0.05 0.00 0.00 56.93 56.56 1war s PHE 44 Cb 0.09 0.73 -0.01 0.00 -0.63 0.00 0.00 43.02 43.19 1war s PHE 44 CO 0.82 -1.28 -0.21 0.42 -0.05 0.00 0.00 175.22 174.92 1war s ILE 45 N -3.68 2.39 -0.24 -4.49 1.01 -0.08 -2.57 121.20 113.54 1war s ILE 45 Ca 0.12 -0.94 -0.07 0.00 0.00 0.00 0.00 60.65 59.76 1war s ILE 45 Cb -0.06 -1.90 -0.03 0.00 0.01 0.00 0.00 42.46 40.48 1war s ILE 45 CO 0.08 0.57 0.05 -0.22 0.00 0.00 0.00 174.94 175.41 1war s LEU 46 N -0.21 3.36 -0.11 2.97 0.20 0.32 -0.73 118.68 124.48 1war s LEU 46 Ca -0.01 -0.22 -0.15 0.00 0.69 0.00 0.00 54.13 54.43 1war s LEU 46 Cb -0.13 -1.89 -0.05 0.00 -0.43 0.00 0.00 46.19 43.69 1war s LEU 46 CO 0.03 -0.02 0.38 -0.55 -0.29 0.00 0.00 176.35 175.91 1war s SER 47 N 1.49 6.61 -0.31 3.68 0.15 -0.44 -1.91 113.70 122.97 1war s SER 47 Ca 0.06 0.72 0.10 0.00 0.70 0.00 0.00 55.95 57.53 1war s SER 47 Cb -0.15 -2.23 0.68 0.00 -1.71 0.00 0.00 66.02 62.61 1war s SER 47 CO 0.02 0.13 1.71 0.18 1.20 0.00 0.00 173.24 176.48 1war n LEU 48 N 3.16 5.55 0.00 3.45 4.77 -0.54 -3.13 117.00 130.26 1war n LEU 48 Ca -0.11 -3.31 0.00 0.00 -0.03 0.00 0.00 56.01 52.56 1war n LEU 48 Cb 0.52 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 1war n LEU 48 CO 0.40 0.88 0.00 0.61 -1.33 0.00 0.00 177.39 177.95 1war n GLY 49 N -0.44 0.67 3.28 -0.72 0.00 -1.22 -4.12 105.19 102.64 1war n GLY 49 Ca 0.39 -1.93 -0.16 0.00 0.00 0.00 0.00 46.02 44.32 1war n GLY 49 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1war n ASP 50 N -0.38 -6.07 0.09 1.61 8.00 -1.26 -1.07 116.55 117.47 1war n ASP 50 Ca 0.00 -0.71 -0.03 0.00 0.71 0.00 0.00 54.79 54.76 1war n ASP 50 Cb 0.00 -5.16 -0.06 0.00 -0.02 0.00 0.00 41.12 35.88 1war n ASP 50 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1war h ASN 51 N -1.20 0.00 -3.06 -2.24 2.35 -1.93 -2.79 115.58 106.71 1war h ASN 51 Ca -0.61 0.00 -0.47 0.00 -0.55 0.00 0.00 56.30 54.67 1war h ASN 51 Cb 1.31 0.00 -0.41 0.00 0.05 0.00 0.00 38.32 39.28 1war h ASN 51 CO 0.45 0.78 -0.75 -0.36 -1.65 0.00 0.00 177.43 175.90 1war s PHE 52 N -2.82 0.25 0.14 1.19 0.08 -1.26 -3.59 117.98 111.98 1war s PHE 52 Ca 0.02 -0.37 -0.15 0.00 0.12 0.00 0.00 56.93 56.55 1war s PHE 52 Cb 0.09 -0.72 -0.07 0.00 -0.57 0.00 0.00 43.02 41.75 1war s PHE 52 CO 0.79 -0.53 0.57 0.71 -0.10 0.00 0.00 175.22 176.66 1war s TYR 53 N 2.12 3.64 -0.99 0.36 2.02 -0.05 -0.98 117.35 123.47 1war s TYR 53 Ca 0.02 1.12 0.14 0.00 -0.37 0.00 0.00 57.07 57.98 1war s TYR 53 Cb -0.16 -2.41 -0.08 0.00 -0.40 0.00 0.00 41.96 38.91 1war s TYR 53 CO -0.10 0.44 0.69 1.19 -1.57 0.00 0.00 175.55 176.20 1war n PHE 54 N 0.92 0.00 -2.16 2.71 3.72 -1.26 -2.67 117.46 118.71 1war n PHE 54 Ca -0.06 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.39 1war n PHE 54 Cb 0.52 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 39.13 1war n PHE 54 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1war n THR 55 N -0.74 0.65 -4.84 4.37 -2.24 -1.24 -4.77 114.28 105.48 1war n THR 55 Ca 0.04 -1.54 0.00 0.00 -2.27 0.00 0.00 64.05 60.28 1war n THR 55 Cb 0.26 0.58 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 1war n THR 55 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1war n GLY 56 N -0.05 2.06 3.48 3.38 0.00 -0.15 -2.48 105.19 111.43 1war n GLY 56 Ca 0.09 -0.52 -0.24 0.00 0.00 0.00 0.00 46.02 45.35 1war n GLY 56 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1war s VAL 57 N 0.00 2.07 -0.20 1.61 -7.23 -1.26 -4.83 120.40 110.56 1war s VAL 57 Ca 0.00 -2.22 0.06 0.00 -1.81 0.00 0.00 61.98 58.02 1war s VAL 57 Cb 0.00 -2.49 -0.21 0.00 0.56 0.00 0.00 36.38 34.24 1war s VAL 57 CO 0.00 -0.29 0.02 0.00 -0.31 0.00 0.00 175.10 174.52 1war n GLN 58 N -0.67 0.68 -3.22 4.82 6.02 -1.26 -0.85 117.38 122.88 1war n GLN 58 Ca -0.05 0.13 -0.04 0.00 -0.01 0.00 0.00 57.00 57.03 1war n GLN 58 Cb 0.63 -1.57 0.02 0.00 1.02 0.00 0.00 30.24 30.33 1war n GLN 58 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1war n ASP 59 N -3.12 -1.45 0.16 1.08 5.68 -1.26 -4.66 116.55 112.97 1war n ASP 59 Ca -0.38 -1.85 0.13 0.00 -0.50 0.00 0.00 54.79 52.19 1war n ASP 59 Cb 1.05 2.38 0.53 0.00 -1.14 0.00 0.00 41.12 43.94 1war n ASP 59 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 1war h ILE 60 N 1.75 0.00 -0.04 2.12 2.10 -1.96 -2.84 117.51 118.64 1war h ILE 60 Ca -0.22 -0.28 0.00 0.00 1.08 0.00 0.00 64.86 65.44 1war h ILE 60 Cb 0.92 1.05 0.00 0.00 -1.09 0.00 0.00 36.82 37.70 1war h ILE 60 CO 0.29 0.00 0.00 0.59 -1.08 0.00 0.00 178.15 177.95 1war n ASN 61 N -2.38 2.87 -4.68 2.19 3.02 -1.26 -4.96 115.26 110.05 1war n ASN 61 Ca 0.02 -1.95 -0.45 0.00 -0.03 0.00 0.00 54.58 52.17 1war n ASN 61 Cb 0.24 -0.01 -0.04 0.00 -0.61 0.00 0.00 39.78 39.36 1war n ASN 61 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1war n ASP 62 N 1.24 3.61 0.23 6.41 -0.08 -1.08 -4.85 116.55 122.03 1war n ASP 62 Ca 0.15 1.01 0.16 0.00 -1.51 0.00 0.00 54.79 54.60 1war n ASP 62 Cb 0.58 -1.46 0.81 0.00 2.34 0.00 0.00 41.12 43.38 1war n ASP 62 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 1war h LYS 63 N 7.97 0.00 -0.50 -0.67 2.10 -1.93 -2.47 116.57 121.07 1war h LYS 63 Ca -0.47 0.00 0.10 0.00 -2.00 0.00 0.00 60.65 58.29 1war h LYS 63 Cb 1.24 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.55 1war h LYS 63 CO 0.93 0.00 0.34 0.00 -2.00 0.00 0.00 179.45 178.72 1war h ARG 64 N 0.00 0.23 -0.72 0.07 2.47 -1.97 0.11 114.38 114.57 1war h ARG 64 Ca 0.00 -0.01 0.04 0.00 -1.26 0.00 0.00 59.98 58.75 1war h ARG 64 Cb 0.10 -0.05 -0.05 0.00 -1.65 0.00 0.00 29.97 28.32 1war h ARG 64 CO 0.00 0.16 0.44 0.74 0.56 0.00 0.00 179.97 181.87 1war h PHE 65 N 0.24 0.82 -0.02 3.04 0.04 -1.82 -0.78 116.94 118.46 1war h PHE 65 Ca 0.23 0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.94 1war h PHE 65 Cb 0.60 -0.27 0.01 0.00 2.20 0.00 0.00 35.95 38.49 1war h PHE 65 CO -0.00 0.44 -0.32 1.96 -0.60 0.00 0.00 178.31 179.79 1war h GLN 66 N 0.84 0.25 0.11 1.51 7.50 -1.14 -0.83 115.11 123.35 1war h GLN 66 Ca 0.30 -0.24 -0.27 0.00 0.50 0.00 0.00 58.65 58.94 1war h GLN 66 Cb 0.09 0.06 0.00 0.00 0.05 0.00 0.00 27.48 27.68 1war h GLN 66 CO -0.14 0.94 -1.19 0.93 -1.50 0.00 0.00 178.83 177.87 1war h GLU 67 N -0.34 0.29 0.00 1.46 4.39 -0.75 -0.67 114.58 118.96 1war h GLU 67 Ca -0.03 -0.46 -0.23 0.00 0.34 0.00 0.00 59.36 58.98 1war h GLU 67 Cb 1.03 0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 29.80 1war h GLU 67 CO 0.06 1.20 -2.03 2.41 -1.16 0.00 0.00 179.01 179.50 1war n THR 68 N -3.57 1.04 -0.00 1.13 -1.04 -0.31 -4.54 114.28 106.99 1war n THR 68 Ca -0.08 -0.73 -0.01 0.00 -2.04 0.00 0.00 64.05 61.19 1war n THR 68 Cb 0.99 -0.46 -0.00 0.00 -1.82 0.00 0.00 70.33 69.04 1war n THR 68 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 1war n PHE 69 N -2.69 0.00 0.06 -1.42 7.35 -1.07 -4.61 117.46 115.07 1war n PHE 69 Ca -0.20 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.37 1war n PHE 69 Cb 0.94 -0.03 -0.07 0.00 0.35 0.00 0.00 39.48 40.67 1war n PHE 69 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1war h GLU 70 N -0.06 -0.04 0.00 -4.13 4.39 -1.03 -2.03 114.58 111.67 1war h GLU 70 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1war h GLU 70 Cb 0.06 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1war h GLU 70 CO 0.00 -0.02 0.00 -0.44 -1.16 0.00 0.00 179.01 177.39 1war h ASP 71 N -0.05 0.00 0.08 1.42 3.32 -1.38 -3.20 116.42 116.61 1war h ASP 71 Ca -0.00 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.79 1war h ASP 71 Cb 0.04 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1war h ASP 71 CO 0.01 0.00 -1.35 0.58 -1.72 0.00 0.00 179.24 176.76 1war h VAL 72 N 0.00 1.01 -1.80 -1.35 2.07 -1.68 -3.38 116.25 111.12 1war h VAL 72 Ca 0.00 -2.34 -0.78 0.00 0.82 0.00 0.00 66.70 64.40 1war h VAL 72 Cb 0.51 2.63 -0.20 0.00 -1.52 0.00 0.00 31.29 32.70 1war h VAL 72 CO 0.00 0.63 1.65 0.49 0.02 0.00 0.00 177.57 180.36 1war n PHE 73 N -4.04 2.66 0.45 1.57 3.72 -0.80 -4.62 117.46 116.39 1war n PHE 73 Ca -0.26 -2.68 0.05 0.00 -0.05 0.00 0.00 57.45 54.50 1war n PHE 73 Cb 0.84 -1.52 -0.02 0.00 -0.94 0.00 0.00 39.48 37.84 1war n PHE 73 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1war n SER 74 N 1.12 0.92 -4.70 4.37 3.41 -1.24 -4.77 113.62 112.74 1war n SER 74 Ca 0.50 -0.96 -0.42 0.00 -0.26 0.00 0.00 58.87 57.73 1war n SER 74 Cb 0.27 0.67 -0.00 0.00 -0.26 0.00 0.00 64.21 64.89 1war n SER 74 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1war n ASP 75 N -0.62 2.71 0.28 4.04 8.00 -1.26 -4.83 116.55 124.87 1war n ASP 75 Ca 0.03 1.18 0.13 0.00 0.71 0.00 0.00 54.79 56.85 1war n ASP 75 Cb 0.19 -1.49 0.83 0.00 -0.02 0.00 0.00 41.12 40.63 1war n ASP 75 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 1war h ARG 76 N 2.44 0.00 0.00 -1.24 0.11 -2.00 -0.32 114.38 113.37 1war h ARG 76 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 1war h ARG 76 Cb 1.29 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.37 1war h ARG 76 CO 0.62 0.04 0.00 -1.13 0.10 0.00 0.00 179.97 179.60 1war n SER 77 N -3.90 0.00 -0.00 0.08 3.41 -1.26 -3.20 113.62 108.75 1war n SER 77 Ca -0.03 0.08 0.04 0.00 -0.26 0.00 0.00 58.87 58.71 1war n SER 77 Cb 0.12 -0.29 -0.06 0.00 -0.26 0.00 0.00 64.21 63.72 1war n SER 77 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1war n LEU 78 N -1.29 0.10 -0.13 1.04 4.77 -0.14 -4.80 117.00 116.56 1war n LEU 78 Ca 0.07 -0.12 0.17 0.00 -0.03 0.00 0.00 56.01 56.10 1war n LEU 78 Cb 0.12 0.00 0.56 0.00 -2.33 0.00 0.00 43.42 41.77 1war n LEU 78 CO 0.11 0.02 1.21 0.03 -1.33 0.00 0.00 177.39 177.43 1war h ARG 79 N 0.00 0.29 -0.01 3.23 3.08 -1.51 -2.19 114.38 117.27 1war h ARG 79 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1war h ARG 79 Cb 0.36 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1war h ARG 79 CO 0.00 0.19 -0.39 1.63 -1.07 0.00 0.00 179.97 180.33 1war n LYS 80 N -4.45 2.06 -2.19 0.04 5.02 -1.26 -4.85 118.16 112.54 1war n LYS 80 Ca 0.14 -0.52 -0.43 0.00 -2.02 0.00 0.00 58.31 55.48 1war n LYS 80 Cb 0.58 -1.18 -0.02 0.00 -0.02 0.00 0.00 35.03 34.38 1war n LYS 80 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1war s VAL 81 N -1.86 3.88 0.48 -0.18 1.01 -0.83 -4.94 120.40 117.97 1war s VAL 81 Ca 0.10 1.06 -0.22 0.00 0.00 0.00 0.00 61.98 62.91 1war s VAL 81 Cb 0.11 -3.71 -0.07 0.00 0.00 0.00 0.00 36.38 32.72 1war s VAL 81 CO 0.41 -0.12 1.20 -2.16 0.00 0.00 0.00 175.10 174.43 1war s PRO 82 N 3.87 3.60 -0.12 2.72 0.04 -1.26 -4.82 135.00 139.02 1war s PRO 82 Ca 0.65 1.86 -0.03 0.00 0.04 0.00 0.00 61.00 63.52 1war s PRO 82 Cb -0.28 -2.35 -0.03 0.00 0.04 0.00 0.00 34.50 31.88 1war s PRO 82 CO 0.23 -0.71 -0.00 -1.58 0.04 0.00 0.00 177.00 174.98 1war s TRP 83 N -1.51 3.12 -0.18 0.56 0.52 0.11 -0.90 118.94 120.67 1war s TRP 83 Ca 0.66 0.00 -0.02 0.00 0.02 0.00 0.00 56.10 56.76 1war s TRP 83 Cb -0.31 -1.89 -0.01 0.00 -1.15 0.00 0.00 33.47 30.11 1war s TRP 83 CO 0.37 0.24 -0.09 0.71 0.02 0.00 0.00 176.95 178.20 1war s TYR 84 N -0.25 2.89 0.12 -1.98 2.02 0.09 -1.08 117.35 119.16 1war s TYR 84 Ca 0.06 -0.86 0.10 0.00 -0.37 0.00 0.00 57.07 56.00 1war s TYR 84 Cb -0.12 -1.98 -0.04 0.00 -0.40 0.00 0.00 41.96 39.42 1war s TYR 84 CO 0.02 -0.42 -0.26 0.08 -1.57 0.00 0.00 175.55 173.40 1war s VAL 85 N 0.98 2.34 0.17 0.71 1.01 -0.60 -1.32 120.40 123.69 1war s VAL 85 Ca -0.01 -1.67 0.01 0.00 0.00 0.00 0.00 61.98 60.30 1war s VAL 85 Cb -0.15 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 1war s VAL 85 CO -0.01 0.13 0.04 -1.48 0.00 0.00 0.00 175.10 173.78 1war s LEU 86 N -1.97 1.86 0.14 3.92 0.05 -1.18 -4.74 118.68 116.76 1war s LEU 86 Ca 0.14 -1.23 -0.09 0.00 0.05 0.00 0.00 54.13 53.00 1war s LEU 86 Cb -0.10 0.10 -0.06 0.00 -2.05 0.00 0.00 46.19 44.08 1war s LEU 86 CO 0.06 -0.67 0.45 0.00 -0.55 0.00 0.00 176.35 175.64 1war s ALA 87 N -3.84 3.69 0.23 1.48 0.00 -1.26 -3.43 121.76 118.63 1war s ALA 87 Ca 0.27 -0.37 0.02 0.00 0.00 0.00 0.00 51.96 51.88 1war s ALA 87 Cb 0.07 -2.30 0.02 0.00 0.00 0.00 0.00 23.12 20.90 1war s ALA 87 CO 0.05 0.57 0.13 0.41 0.00 0.00 0.00 175.76 176.92 1war n GLY 88 N 0.40 3.16 0.23 0.00 0.00 -1.26 -4.48 105.19 103.24 1war n GLY 88 Ca -0.04 -2.24 -0.01 0.00 0.00 0.00 0.00 46.02 43.73 1war n GLY 88 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1war h ASN 89 N 0.33 0.33 0.39 1.61 -1.07 -1.96 -2.24 115.58 112.96 1war h ASN 89 Ca -0.15 0.05 -0.06 0.00 0.07 0.00 0.00 56.30 56.21 1war h ASN 89 Cb 0.54 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.78 1war h ASN 89 CO 0.25 0.21 -0.27 0.45 0.07 0.00 0.00 177.43 178.14 1war h HIS 90 N 0.48 0.00 -0.10 4.14 3.86 -1.92 -2.70 115.15 118.92 1war h HIS 90 Ca 0.28 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.37 1war h HIS 90 Cb 0.28 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 1war h HIS 90 CO -0.13 0.27 -0.49 -0.44 0.86 0.00 0.00 177.93 177.99 1war h ASP 91 N 0.00 0.28 0.90 2.45 3.32 -1.66 -2.67 116.42 119.04 1war h ASP 91 Ca -0.00 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.91 1war h ASP 91 Cb 0.53 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1war h ASP 91 CO 0.03 0.73 0.00 1.41 -1.72 0.00 0.00 179.24 179.69 1war n HIS 92 N -3.96 0.00 0.49 4.55 8.25 -1.03 -2.17 115.22 121.35 1war n HIS 92 Ca -0.02 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.57 1war n HIS 92 Cb 0.54 -0.50 0.43 0.00 1.12 0.00 0.00 29.99 31.58 1war n HIS 92 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1war h LEU 93 N 0.00 0.00 0.00 2.41 3.38 -1.40 -3.46 115.31 116.24 1war h LEU 93 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1war h LEU 93 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1war h LEU 93 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1war n GLY 94 N 0.78 5.70 3.53 0.83 0.00 -0.92 -4.90 105.19 110.20 1war n GLY 94 Ca 0.04 -1.94 -0.42 0.00 0.00 0.00 0.00 46.02 43.69 1war n GLY 94 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1war s ASN 95 N 0.60 6.58 0.35 1.61 3.84 -0.03 -4.87 114.94 123.02 1war s ASN 95 Ca 0.00 -1.74 0.06 0.00 0.21 0.00 0.00 52.86 51.39 1war s ASN 95 Cb 0.00 -2.51 0.66 0.00 -0.55 0.00 0.00 41.25 38.84 1war s ASN 95 CO 0.00 -1.33 1.89 0.58 -2.79 0.00 0.00 177.10 175.45 1war h VAL 96 N 6.37 1.19 0.00 -5.21 2.07 -1.85 -2.60 116.25 116.23 1war h VAL 96 Ca 0.21 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.92 1war h VAL 96 Cb 1.00 1.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.79 1war h VAL 96 CO 1.33 0.26 -0.11 0.28 0.02 0.00 0.00 177.57 179.35 1war h SER 97 N 0.42 0.00 -0.06 0.57 0.02 -1.94 -0.47 113.55 112.09 1war h SER 97 Ca 0.09 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.97 1war h SER 97 Cb 0.34 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 1war h SER 97 CO 0.01 0.11 -0.14 0.00 -1.14 0.00 0.00 176.83 175.68 1war h ALA 98 N 1.89 1.33 -0.02 3.77 0.00 -1.83 -1.17 119.26 123.23 1war h ALA 98 Ca -0.00 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 1war h ALA 98 Cb 0.22 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1war h ALA 98 CO 0.01 0.45 -0.59 1.96 0.00 0.00 0.00 179.25 181.08 1war h GLN 99 N 0.37 0.08 0.01 0.00 4.20 -1.15 -1.40 115.11 117.21 1war h GLN 99 Ca 0.07 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 1war h GLN 99 Cb 0.47 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.26 1war h GLN 99 CO 0.03 0.65 -0.00 0.82 -0.67 0.00 0.00 178.83 179.65 1war h ILE 100 N 0.06 1.36 -0.12 2.54 2.04 -1.21 -3.27 117.51 118.90 1war h ILE 100 Ca -0.01 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 64.75 1war h ILE 100 Cb 1.07 2.11 -0.01 0.00 -0.74 0.00 0.00 36.82 39.25 1war h ILE 100 CO 0.08 0.29 0.08 0.00 0.00 0.00 0.00 178.15 178.59 1war h ALA 101 N 0.50 1.91 -0.01 1.87 0.00 -1.16 -2.22 119.26 120.15 1war h ALA 101 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1war h ALA 101 Cb 0.48 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1war h ALA 101 CO 0.00 0.08 0.01 -0.92 0.00 0.00 0.00 179.25 178.43 1war h TYR 102 N 0.16 0.00 -1.05 0.00 3.20 -1.30 -0.92 116.97 117.06 1war h TYR 102 Ca 0.04 0.00 0.28 0.00 3.14 0.00 0.00 58.73 62.20 1war h TYR 102 Cb -0.01 0.00 -0.07 0.00 1.54 0.00 0.00 36.73 38.19 1war h TYR 102 CO 0.00 0.00 0.72 0.77 -1.64 0.00 0.00 178.16 178.01 1war h SER 103 N 0.00 0.23 1.75 -2.11 0.02 -1.54 -1.66 113.55 110.25 1war h SER 103 Ca 0.00 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1war h SER 103 Cb 0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.57 1war h SER 103 CO -0.00 0.05 0.00 0.11 -1.14 0.00 0.00 176.83 175.85 1war h LYS 104 N 0.21 0.00 0.01 3.45 1.57 -1.38 -3.36 116.57 117.07 1war h LYS 104 Ca 0.55 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.95 1war h LYS 104 Cb 1.75 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 34.00 1war h LYS 104 CO -0.15 0.00 -2.08 -0.89 -0.57 0.00 0.00 179.45 175.76 1war n ILE 105 N -3.06 1.55 -3.67 1.86 5.41 -0.68 -4.90 119.36 115.86 1war n ILE 105 Ca 0.03 -0.31 -0.37 0.00 1.00 0.00 0.00 62.75 63.10 1war n ILE 105 Cb 0.47 -1.87 -0.12 0.00 -0.71 0.00 0.00 39.64 37.42 1war n ILE 105 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1war s SER 106 N -7.14 5.56 0.25 4.38 0.15 -0.84 -5.00 113.70 111.06 1war s SER 106 Ca -0.34 -0.12 -0.04 0.00 0.70 0.00 0.00 55.95 56.15 1war s SER 106 Cb 0.11 -2.02 0.44 0.00 -1.71 0.00 0.00 66.02 62.83 1war s SER 106 CO 0.56 -0.05 1.78 0.11 1.20 0.00 0.00 173.24 176.84 1war h LYS 107 N 8.30 0.63 0.00 5.44 1.57 -1.89 -2.74 116.57 127.88 1war h LYS 107 Ca -0.37 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1war h LYS 107 Cb 1.18 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.35 1war h LYS 107 CO 0.57 0.41 0.00 2.89 -0.57 0.00 0.00 179.45 182.75 1war n ARG 108 N -4.85 0.23 -3.11 3.15 1.85 -1.26 -4.74 116.66 107.92 1war n ARG 108 Ca 0.14 0.21 -0.41 0.00 -1.00 0.00 0.00 57.85 56.79 1war n ARG 108 Cb 0.35 -1.78 -0.06 0.00 -1.05 0.00 0.00 32.46 29.92 1war n ARG 108 CO 0.00 0.00 0.00 -0.46 -0.01 0.00 0.00 177.63 177.16 1war s TRP 109 N -3.10 3.23 -0.21 2.89 -0.11 -1.03 0.09 118.94 120.69 1war s TRP 109 Ca 0.11 0.62 0.01 0.00 1.22 0.00 0.00 56.10 58.06 1war s TRP 109 Cb 0.13 -2.96 0.05 0.00 -1.50 0.00 0.00 33.47 29.18 1war s TRP 109 CO 0.57 -0.45 -0.10 -0.80 -4.62 0.00 0.00 176.95 171.55 1war s ASN 110 N 1.61 3.59 -0.46 5.86 0.01 -0.24 -4.21 114.94 121.10 1war s ASN 110 Ca 0.25 -0.98 0.06 0.00 -0.71 0.00 0.00 52.86 51.48 1war s ASN 110 Cb -0.15 -1.29 0.22 0.00 0.41 0.00 0.00 41.25 40.44 1war s ASN 110 CO 0.11 -0.15 0.69 0.33 -1.51 0.00 0.00 177.10 176.57 1war n PHE 111 N 4.64 -2.38 0.16 2.20 -0.00 -1.26 -1.56 117.46 119.26 1war n PHE 111 Ca -0.15 -2.34 0.03 0.00 -0.00 0.00 0.00 57.45 54.99 1war n PHE 111 Cb 0.46 0.89 0.22 0.00 -0.00 0.00 0.00 39.48 41.05 1war n PHE 111 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.76 175.76 1war h PRO 112 N 4.41 0.00 -2.85 -7.13 0.13 -1.90 -3.39 132.00 121.27 1war h PRO 112 Ca 0.00 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.22 1war h PRO 112 Cb 0.99 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.06 1war h PRO 112 CO 0.30 0.49 0.28 -1.54 -0.23 0.00 0.00 178.00 177.31 1war s SER 113 N -6.55 -0.27 0.32 1.44 1.04 -1.26 -5.01 113.70 103.40 1war s SER 113 Ca 0.00 -0.50 0.01 0.00 0.48 0.00 0.00 55.95 55.95 1war s SER 113 Cb 0.11 0.66 0.56 0.00 0.10 0.00 0.00 66.02 67.45 1war s SER 113 CO 0.72 -1.21 1.94 -0.65 0.98 0.00 0.00 173.24 175.02 1war h PRO 114 N 2.00 0.96 -4.57 4.02 0.11 -1.96 -3.42 132.00 129.15 1war h PRO 114 Ca -0.21 -0.06 -0.32 0.00 0.11 0.00 0.00 66.00 65.52 1war h PRO 114 Cb 1.25 -0.22 -0.24 0.00 0.11 0.00 0.00 31.00 31.90 1war h PRO 114 CO 0.25 0.63 -0.75 -0.59 -0.21 0.00 0.00 178.00 177.33 1war s PHE 115 N -5.85 0.67 0.13 0.65 -0.12 -1.26 -3.54 117.98 108.65 1war s PHE 115 Ca -0.11 -0.32 -0.25 0.00 -0.05 0.00 0.00 56.93 56.19 1war s PHE 115 Cb 0.19 -0.41 0.07 0.00 -0.63 0.00 0.00 43.02 42.24 1war s PHE 115 CO 0.79 -0.04 0.92 1.52 -0.05 0.00 0.00 175.22 178.36 1war s TYR 116 N -0.82 -0.19 -0.09 3.49 1.13 -0.52 -5.01 117.35 115.33 1war s TYR 116 Ca -0.04 -0.09 -0.00 0.00 -1.41 0.00 0.00 57.07 55.53 1war s TYR 116 Cb -0.07 0.62 -0.03 0.00 -1.10 0.00 0.00 41.96 41.39 1war s TYR 116 CO 0.00 -0.79 -0.08 0.50 -2.51 0.00 0.00 175.55 172.67 1war s ARG 117 N -3.30 3.02 0.06 -3.49 3.52 -1.26 -0.75 118.95 116.75 1war s ARG 117 Ca 0.10 -0.57 0.07 0.00 -0.13 0.00 0.00 55.73 55.20 1war s ARG 117 Cb -0.02 -2.65 -0.04 0.00 -1.56 0.00 0.00 34.95 30.69 1war s ARG 117 CO -0.00 0.51 -0.16 -0.51 -0.81 0.00 0.00 175.30 174.33 1war s LEU 118 N -0.39 2.74 -0.06 -0.88 1.43 0.32 -5.00 118.68 116.83 1war s LEU 118 Ca 0.05 -0.42 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 1war s LEU 118 Cb -0.12 -1.60 0.02 0.00 0.03 0.00 0.00 46.19 44.52 1war s LEU 118 CO 0.02 0.23 -0.07 -2.28 0.23 0.00 0.00 176.35 174.49 1war s HIS 119 N -1.02 1.06 0.07 0.29 5.65 -1.26 -1.26 115.29 118.82 1war s HIS 119 Ca 0.16 -0.38 0.05 0.00 0.25 0.00 0.00 55.06 55.14 1war s HIS 119 Cb -0.11 -0.89 -0.03 0.00 -1.18 0.00 0.00 32.58 30.37 1war s HIS 119 CO 0.08 -0.28 -0.14 -0.06 -0.65 0.00 0.00 174.74 173.68 1war s PHE 120 N 1.09 1.20 -0.01 3.88 0.40 -0.02 -5.00 117.98 119.53 1war s PHE 120 Ca -0.08 -0.45 -0.06 0.00 -0.60 0.00 0.00 56.93 55.74 1war s PHE 120 Cb -0.14 -0.68 -0.05 0.00 0.51 0.00 0.00 43.02 42.67 1war s PHE 120 CO -0.01 0.05 0.24 0.15 0.70 0.00 0.00 175.22 176.35 1war s LYS 121 N -1.70 3.54 -0.13 0.44 1.02 -1.26 -0.52 119.74 121.13 1war s LYS 121 Ca -0.02 -0.12 -0.29 0.00 0.02 0.00 0.00 55.97 55.55 1war s LYS 121 Cb -0.10 -3.10 -0.04 0.00 -0.52 0.00 0.00 37.83 34.07 1war s LYS 121 CO 0.02 0.67 1.55 0.42 -0.92 0.00 0.00 175.35 177.09 1war s ILE 122 N -1.26 3.78 0.52 2.17 1.01 -0.16 -4.88 121.20 122.38 1war s ILE 122 Ca 0.26 0.93 -0.23 0.00 0.00 0.00 0.00 60.65 61.61 1war s ILE 122 Cb -0.13 -3.66 -0.06 0.00 0.01 0.00 0.00 42.46 38.62 1war s ILE 122 CO 0.15 -0.15 1.36 -2.84 0.00 0.00 0.00 174.94 173.46 1war s PRO 123 N 4.11 3.28 -0.33 2.79 0.02 -1.26 -2.21 135.00 141.40 1war s PRO 123 Ca 0.68 2.25 0.00 0.00 0.02 0.00 0.00 61.00 63.95 1war s PRO 123 Cb -0.28 -2.35 0.00 0.00 0.02 0.00 0.00 34.50 31.89 1war s PRO 123 CO 0.26 -1.08 0.00 1.04 -0.33 0.00 0.00 177.00 176.89 1war n GLN 124 N -0.83 -0.89 -4.43 5.54 6.02 -1.26 -4.72 117.38 116.81 1war n GLN 124 Ca 0.09 0.43 -0.23 0.00 -0.01 0.00 0.00 57.00 57.28 1war n GLN 124 Cb 0.44 -4.21 -0.08 0.00 1.02 0.00 0.00 30.24 27.41 1war n GLN 124 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1war s THR 125 N -1.78 0.42 -2.69 5.09 -4.23 -0.94 -5.05 115.64 106.47 1war s THR 125 Ca 0.00 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.75 1war s THR 125 Cb 0.00 -2.41 0.35 0.00 1.34 0.00 0.00 72.50 71.78 1war s THR 125 CO 0.00 0.00 1.42 -3.20 -0.54 0.00 0.00 174.62 172.30 1war n ASN 126 N -1.29 2.71 -4.74 3.99 5.15 -1.26 -4.74 115.26 115.08 1war n ASN 126 Ca -0.02 -1.88 -0.40 0.00 -0.60 0.00 0.00 54.58 51.68 1war n ASN 126 Cb 0.64 -0.08 -0.05 0.00 -0.53 0.00 0.00 39.78 39.76 1war n ASN 126 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1war s VAL 127 N -1.84 4.52 0.14 3.44 1.01 -1.26 -4.97 120.40 121.44 1war s VAL 127 Ca 0.33 1.89 0.07 0.00 0.00 0.00 0.00 61.98 64.27 1war s VAL 127 Cb 0.21 -4.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1war s VAL 127 CO 0.31 0.37 -0.15 -0.94 0.00 0.00 0.00 175.10 174.69 1war s SER 128 N -0.27 2.25 -0.04 3.32 1.04 -1.26 -0.98 113.70 117.75 1war s SER 128 Ca 0.42 -0.86 0.02 0.00 0.48 0.00 0.00 55.95 56.01 1war s SER 128 Cb -0.23 -0.10 0.01 0.00 0.10 0.00 0.00 66.02 65.81 1war s SER 128 CO 0.27 -0.13 -0.07 -0.69 0.98 0.00 0.00 173.24 173.60 1war s VAL 129 N -2.28 0.70 -0.02 5.02 1.01 0.32 -1.85 120.40 123.29 1war s VAL 129 Ca 0.13 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 61.88 1war s VAL 129 Cb -0.04 -0.66 -0.03 0.00 0.00 0.00 0.00 36.38 35.64 1war s VAL 129 CO 0.04 0.24 -0.10 0.00 0.00 0.00 0.00 175.10 175.29 1war s ALA 130 N 0.58 2.89 -0.09 5.51 0.00 -0.05 -0.84 121.76 129.76 1war s ALA 130 Ca -0.09 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 50.89 1war s ALA 130 Cb -0.12 -1.08 0.02 0.00 0.00 0.00 0.00 23.12 21.94 1war s ALA 130 CO 0.01 0.59 -0.11 0.42 0.00 0.00 0.00 175.76 176.67 1war s ILE 131 N -0.89 1.12 -0.27 0.00 1.01 -0.39 -0.53 121.20 121.25 1war s ILE 131 Ca 0.14 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.29 1war s ILE 131 Cb -0.11 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.25 1war s ILE 131 CO 0.04 0.37 0.15 -0.36 0.00 0.00 0.00 174.94 175.13 1war s PHE 132 N 1.12 3.18 -0.31 3.97 0.40 -0.35 -0.52 117.98 125.46 1war s PHE 132 Ca -0.06 -0.07 -0.12 0.00 -0.60 0.00 0.00 56.93 56.09 1war s PHE 132 Cb -0.14 -2.32 -0.03 0.00 0.51 0.00 0.00 43.02 41.03 1war s PHE 132 CO -0.02 -0.22 0.22 -1.64 0.70 0.00 0.00 175.22 174.26 1war s MET 133 N 1.68 3.72 0.12 0.44 -1.94 0.07 -0.70 119.30 122.68 1war s MET 133 Ca 0.07 -0.48 0.04 0.00 -1.71 0.00 0.00 55.69 53.61 1war s MET 133 Cb -0.16 -3.74 -0.04 0.00 2.01 0.00 0.00 34.83 32.91 1war s MET 133 CO 0.08 -0.31 0.10 -0.51 -0.01 0.00 0.00 175.02 174.36 1war s LEU 134 N 1.74 3.77 -0.68 -0.03 1.43 -0.26 -1.44 118.68 123.21 1war s LEU 134 Ca 0.07 -0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 52.97 1war s LEU 134 Cb -0.17 -2.42 0.18 0.00 0.03 0.00 0.00 46.19 43.80 1war s LEU 134 CO 0.11 0.13 0.59 -0.62 0.23 0.00 0.00 176.35 176.79 1war s ASP 135 N -2.70 6.21 0.30 2.29 -1.08 -1.23 -4.52 116.67 115.95 1war s ASP 135 Ca 0.30 -2.44 0.26 0.00 -0.52 0.00 0.00 52.55 50.15 1war s ASP 135 Cb -0.11 -2.11 0.90 0.00 -1.46 0.00 0.00 42.92 40.14 1war s ASP 135 CO 0.22 -0.61 1.76 0.71 0.52 0.00 0.00 175.17 177.78 1war h THR 136 N 5.29 0.00 -0.25 1.71 1.35 -1.93 -3.00 112.91 116.08 1war h THR 136 Ca -0.04 -0.44 -0.08 0.00 -0.55 0.00 0.00 66.41 65.30 1war h THR 136 Cb 1.04 1.34 -0.01 0.00 -1.73 0.00 0.00 68.15 68.79 1war h THR 136 CO 0.81 0.00 -0.14 0.58 -0.25 0.00 0.00 175.52 176.52 1war h VAL 137 N 0.00 1.30 0.00 6.82 2.07 -1.87 -1.17 116.25 123.41 1war h VAL 137 Ca 0.00 -1.24 -0.01 0.00 0.82 0.00 0.00 66.70 66.28 1war h VAL 137 Cb 0.59 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 31.93 1war h VAL 137 CO 0.00 0.39 -0.03 0.71 0.02 0.00 0.00 177.57 178.66 1war h THR 138 N 0.26 0.06 0.06 2.57 1.35 -1.82 0.20 112.91 115.59 1war h THR 138 Ca 0.05 -0.80 -0.21 0.00 -0.55 0.00 0.00 66.41 64.90 1war h THR 138 Cb 0.66 1.75 0.02 0.00 -1.73 0.00 0.00 68.15 68.85 1war h THR 138 CO 0.04 0.03 -0.87 0.25 -0.25 0.00 0.00 175.52 174.72 1war h LEU 139 N 0.00 0.66 0.00 3.87 5.85 -1.45 -3.31 115.31 120.93 1war h LEU 139 Ca -0.00 -0.82 0.00 0.00 0.84 0.00 0.00 57.88 57.90 1war h LEU 139 Cb 0.75 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.57 1war h LEU 139 CO 0.00 1.40 -0.96 0.00 -0.34 0.00 0.00 178.44 178.54 1war n GLY 141 N 2.09 1.67 3.66 0.00 0.00 0.70 -2.72 105.19 110.60 1war n GLY 141 Ca -0.00 -2.00 -0.38 0.00 0.00 0.00 0.00 46.02 43.64 1war n GLY 141 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1war s ASN 142 N 0.00 6.34 0.51 1.61 3.84 -1.26 -4.42 114.94 121.56 1war s ASN 142 Ca 0.00 0.39 0.17 0.00 0.21 0.00 0.00 52.86 53.63 1war s ASN 142 Cb 0.00 -2.20 1.27 0.00 -0.55 0.00 0.00 41.25 39.77 1war s ASN 142 CO 0.00 -0.05 2.13 0.77 -2.79 0.00 0.00 177.10 177.16 1war h SER 143 N 7.46 0.00 0.82 -4.21 4.64 -1.89 -2.26 113.55 118.11 1war h SER 143 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1war h SER 143 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1war h SER 143 CO 0.70 0.04 0.00 0.47 -0.87 0.00 0.00 176.83 177.16 1war n ASP 144 N -4.43 0.57 0.07 4.97 8.00 -1.26 -2.78 116.55 121.69 1war n ASP 144 Ca -0.03 0.62 0.12 0.00 0.71 0.00 0.00 54.79 56.21 1war n ASP 144 Cb 0.12 -0.75 0.46 0.00 -0.02 0.00 0.00 41.12 40.93 1war n ASP 144 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1war n ASP 145 N -2.11 0.47 -4.27 -2.24 8.00 -0.85 -4.85 116.55 110.70 1war n ASP 145 Ca 0.03 0.57 -0.27 0.00 0.71 0.00 0.00 54.79 55.83 1war n ASP 145 Cb 0.25 -0.69 -0.15 0.00 -0.02 0.00 0.00 41.12 40.52 1war n ASP 145 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1war s PHE 146 N -3.13 1.96 0.21 1.24 0.40 -1.12 -5.04 117.98 112.51 1war s PHE 146 Ca 0.09 -0.38 -0.09 0.00 -0.60 0.00 0.00 56.93 55.95 1war s PHE 146 Cb 0.12 -1.20 0.16 0.00 0.51 0.00 0.00 43.02 42.62 1war s PHE 146 CO 0.47 0.06 1.82 -0.07 0.70 0.00 0.00 175.22 178.20 1war h LEU 147 N 5.07 1.01 -2.78 -0.37 3.38 -1.89 -1.52 115.31 118.22 1war h LEU 147 Ca -0.43 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1war h LEU 147 Cb 1.15 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1war h LEU 147 CO 0.45 0.83 0.06 0.77 0.09 0.00 0.00 178.44 180.64 1war h SER 148 N 1.11 0.00 -5.08 -0.43 4.64 -1.96 -3.46 113.55 108.37 1war h SER 148 Ca 0.28 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 61.19 1war h SER 148 Cb 0.06 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.22 1war h SER 148 CO -0.04 0.00 -0.64 0.00 -0.87 0.00 0.00 176.83 175.28 1war n GLN 149 N -3.02 -5.81 -4.41 4.77 6.02 -0.57 -4.99 117.38 109.37 1war n GLN 149 Ca -0.03 0.84 -0.27 0.00 -0.01 0.00 0.00 57.00 57.53 1war n GLN 149 Cb 0.12 -5.76 -0.17 0.00 1.02 0.00 0.00 30.24 25.46 1war n GLN 149 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 1war s GLN 150 N -5.97 2.01 -0.45 -1.09 2.00 -1.26 -4.86 119.66 110.04 1war s GLN 150 Ca 0.42 -0.49 -0.28 0.00 -2.00 0.00 0.00 55.36 53.01 1war s GLN 150 Cb -0.19 -1.74 -0.00 0.00 0.80 0.00 0.00 33.01 31.87 1war s GLN 150 CO 0.52 -0.07 1.61 -1.25 -0.50 0.00 0.00 175.29 175.60 1war s PRO 151 N 1.01 3.29 0.06 1.67 0.04 -1.26 -4.73 135.00 135.07 1war s PRO 151 Ca -0.07 0.94 0.19 0.00 0.04 0.00 0.00 61.00 62.10 1war s PRO 151 Cb -0.15 -4.16 -0.14 0.00 0.04 0.00 0.00 34.50 30.09 1war s PRO 151 CO -0.01 -1.93 0.76 0.39 0.04 0.00 0.00 177.00 176.25 1war n GLU 152 N 8.49 0.63 -3.61 4.56 1.02 -1.26 -4.71 120.64 125.76 1war n GLU 152 Ca 0.18 0.13 -0.16 0.00 -0.02 0.00 0.00 57.16 57.30 1war n GLU 152 Cb 0.48 -1.75 -0.07 0.00 -0.02 0.00 0.00 31.44 30.08 1war n GLU 152 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1war s ARG 153 N -3.05 0.88 0.64 3.49 1.70 -1.18 -5.03 118.95 116.40 1war s ARG 153 Ca -0.04 0.45 -0.15 0.00 -0.47 0.00 0.00 55.73 55.53 1war s ARG 153 Cb 0.09 0.42 -0.01 0.00 -0.57 0.00 0.00 34.95 34.88 1war s ARG 153 CO 0.82 -0.21 1.09 -1.25 -1.08 0.00 0.00 175.30 174.67 1war s PRO 154 N -0.59 2.96 0.19 3.89 0.04 -1.10 -3.68 135.00 136.71 1war s PRO 154 Ca -0.07 1.31 -0.03 0.00 0.04 0.00 0.00 61.00 62.25 1war s PRO 154 Cb -0.02 -1.98 0.11 0.00 0.04 0.00 0.00 34.50 32.65 1war s PRO 154 CO 0.06 -1.11 1.51 -0.09 0.04 0.00 0.00 177.00 177.40 1war h ARG 155 N 0.11 0.57 -3.55 4.56 2.43 -1.86 -3.41 114.38 113.23 1war h ARG 155 Ca -0.47 -0.35 -0.55 0.00 -0.81 0.00 0.00 59.98 57.80 1war h ARG 155 Cb 1.24 0.04 -0.40 0.00 -0.42 0.00 0.00 29.97 30.43 1war h ARG 155 CO 0.55 0.96 -0.76 0.34 -1.51 0.00 0.00 179.97 179.55 1war s ASP 156 N -6.91 3.50 0.26 -3.80 3.68 -1.26 -5.02 116.67 107.11 1war s ASP 156 Ca -0.07 -1.23 -0.05 0.00 2.13 0.00 0.00 52.55 53.32 1war s ASP 156 Cb 0.11 -0.73 0.30 0.00 -1.45 0.00 0.00 42.92 41.15 1war s ASP 156 CO 0.84 -0.36 1.93 0.58 0.13 0.00 0.00 175.17 178.29 1war h VAL 157 N 6.51 1.24 -0.18 1.11 2.07 -1.93 -2.30 116.25 122.77 1war h VAL 157 Ca -0.15 -0.45 -0.10 0.00 0.82 0.00 0.00 66.70 66.81 1war h VAL 157 Cb 1.06 -0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1war h VAL 157 CO 0.41 0.24 -0.32 0.50 0.02 0.00 0.00 177.57 178.42 1war h LYS 158 N 1.32 0.36 -0.36 1.57 3.64 -1.97 -1.51 116.57 119.62 1war h LYS 158 Ca 0.37 -0.15 -0.12 0.00 -1.27 0.00 0.00 60.65 59.48 1war h LYS 158 Cb -0.13 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 1war h LYS 158 CO -0.09 0.64 -0.25 1.25 -2.27 0.00 0.00 179.45 178.74 1war h LEU 159 N 0.32 0.85 -0.42 5.20 5.85 -1.83 -1.37 115.31 123.90 1war h LEU 159 Ca 0.04 -0.43 0.04 0.00 0.84 0.00 0.00 57.88 58.36 1war h LEU 159 Cb 0.72 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.47 1war h LEU 159 CO 0.05 1.10 0.20 0.00 -0.34 0.00 0.00 178.44 179.46 1war h ALA 160 N 0.78 0.52 -0.07 1.25 0.00 -1.26 -2.43 119.26 118.05 1war h ALA 160 Ca 0.07 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 1war h ALA 160 Cb 0.82 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1war h ALA 160 CO 0.07 -0.16 -0.41 0.00 0.00 0.00 0.00 179.25 178.75 1war h ARG 161 N 0.41 0.16 -0.39 0.00 3.08 -1.15 -2.22 114.38 114.27 1war h ARG 161 Ca 0.18 -0.07 -0.12 0.00 0.07 0.00 0.00 59.98 60.04 1war h ARG 161 Cb 0.10 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1war h ARG 161 CO -0.14 0.55 -0.24 1.15 -1.07 0.00 0.00 179.97 180.22 1war h THR 162 N 0.14 1.28 -0.68 2.04 2.02 -0.99 -0.71 112.91 116.01 1war h THR 162 Ca 0.01 -1.39 -0.07 0.00 0.77 0.00 0.00 66.41 65.73 1war h THR 162 Cb 0.78 1.34 -0.03 0.00 -1.74 0.00 0.00 68.15 68.50 1war h THR 162 CO 0.06 0.46 0.15 -0.61 0.37 0.00 0.00 175.52 175.95 1war h GLN 163 N 0.65 1.10 -0.40 6.66 4.15 -1.11 -1.11 115.11 125.05 1war h GLN 163 Ca 0.08 -0.27 -0.10 0.00 0.77 0.00 0.00 58.65 59.13 1war h GLN 163 Cb 0.81 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.35 1war h GLN 163 CO 0.07 0.98 -0.14 1.25 -1.93 0.00 0.00 178.83 179.06 1war h LEU 164 N 1.02 0.80 -0.53 -2.39 5.85 -1.22 -0.36 115.31 118.49 1war h LEU 164 Ca 0.21 -0.38 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 1war h LEU 164 Cb 0.39 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 1war h LEU 164 CO 0.01 1.00 0.20 0.28 -0.34 0.00 0.00 178.44 179.59 1war h SER 165 N 0.60 0.74 -0.50 1.25 0.02 -1.04 -1.17 113.55 113.45 1war h SER 165 Ca 0.10 -0.18 0.07 0.00 -0.84 0.00 0.00 61.79 60.94 1war h SER 165 Cb 0.67 -0.19 -0.06 0.00 0.14 0.00 0.00 62.40 62.96 1war h SER 165 CO 0.05 0.72 0.17 -0.25 -1.14 0.00 0.00 176.83 176.38 1war h TRP 166 N 0.72 0.29 -0.57 3.45 7.01 -1.11 -1.23 115.95 124.52 1war h TRP 166 Ca 0.18 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.14 1war h TRP 166 Cb 0.22 -0.06 -0.03 0.00 -2.10 0.00 0.00 29.16 27.20 1war h TRP 166 CO 0.01 0.08 0.11 1.25 -2.79 0.00 0.00 178.44 177.10 1war h LEU 167 N 0.34 0.84 -0.20 0.65 5.85 -0.58 -1.78 115.31 120.42 1war h LEU 167 Ca 0.24 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1war h LEU 167 Cb 0.27 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1war h LEU 167 CO -0.26 0.84 0.01 0.11 -0.34 0.00 0.00 178.44 178.80 1war h LYS 168 N 0.85 0.34 -0.89 1.25 1.57 -0.78 -0.44 116.57 118.47 1war h LYS 168 Ca 0.18 -0.10 0.02 0.00 -1.87 0.00 0.00 60.65 58.88 1war h LYS 168 Cb 0.35 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.57 1war h LYS 168 CO 0.00 0.52 0.58 0.87 -0.57 0.00 0.00 179.45 180.85 1war h LYS 169 N 0.11 1.12 -0.13 3.15 1.57 -1.15 -2.08 116.57 119.16 1war h LYS 169 Ca 0.06 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 1war h LYS 169 Cb 0.36 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 1war h LYS 169 CO 0.01 0.74 -0.05 1.96 -0.57 0.00 0.00 179.45 181.54 1war h GLN 170 N 1.16 0.27 -0.85 3.15 1.08 -1.18 -2.80 115.11 115.93 1war h GLN 170 Ca 0.34 -0.11 -0.02 0.00 -1.45 0.00 0.00 58.65 57.40 1war h GLN 170 Cb -0.07 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.31 1war h GLN 170 CO -0.09 0.59 0.44 -0.07 -0.95 0.00 0.00 178.83 178.74 1war h LEU 171 N -0.07 1.09 -1.33 1.46 3.38 -0.99 -1.20 115.31 117.67 1war h LEU 171 Ca 0.03 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 1war h LEU 171 Cb 0.50 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1war h LEU 171 CO 0.02 0.90 -0.10 0.00 0.09 0.00 0.00 178.44 179.34 1war h ALA 172 N 1.27 1.45 -0.02 1.53 0.00 -1.40 -3.03 119.26 119.06 1war h ALA 172 Ca 0.30 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1war h ALA 172 Cb 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1war h ALA 172 CO -0.04 0.39 -0.25 0.00 0.00 0.00 0.00 179.25 179.34 1war n ALA 173 N -2.49 3.04 -2.23 0.00 0.00 -1.03 -4.96 120.51 112.85 1war n ALA 173 Ca -0.00 -0.66 -0.42 0.00 0.00 0.00 0.00 53.44 52.36 1war n ALA 173 Cb 0.27 -0.78 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 1war n ALA 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1war s ALA 174 N -2.20 3.57 -1.69 0.00 0.00 -0.48 -4.90 121.76 116.06 1war s ALA 174 Ca 0.22 0.92 0.14 0.00 0.00 0.00 0.00 51.96 53.24 1war s ALA 174 Cb 0.18 -3.58 0.16 0.00 0.00 0.00 0.00 23.12 19.89 1war s ALA 174 CO 0.44 -0.83 1.01 0.54 0.00 0.00 0.00 175.76 176.92 1war n ARG 175 N 5.04 1.29 -2.09 0.00 5.12 -1.26 -5.01 116.66 119.74 1war n ARG 175 Ca 0.13 -1.49 -0.36 0.00 -1.93 0.00 0.00 57.85 54.19 1war n ARG 175 Cb 0.44 -1.29 0.02 0.00 -1.16 0.00 0.00 32.46 30.47 1war n ARG 175 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1war s GLU 176 N -1.16 3.14 0.41 5.56 8.01 -1.26 -4.93 118.70 128.47 1war s GLU 176 Ca 0.19 1.77 0.16 0.00 0.01 0.00 0.00 54.97 57.10 1war s GLU 176 Cb 0.13 -1.99 0.90 0.00 -4.31 0.00 0.00 34.13 28.85 1war s GLU 176 CO 0.18 -1.06 1.90 -0.44 0.01 0.00 0.00 175.26 175.85 1war h ASP 177 N 1.06 0.00 -3.80 -0.19 3.32 -1.76 -3.42 116.42 111.63 1war h ASP 177 Ca -0.50 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 56.13 1war h ASP 177 Cb 1.28 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 40.53 1war h ASP 177 CO 0.56 0.29 -0.78 -0.31 -1.72 0.00 0.00 179.24 177.28 1war s TYR 178 N -4.25 0.89 -0.10 4.55 1.51 -0.98 -4.71 117.35 114.26 1war s TYR 178 Ca -0.03 -0.22 0.02 0.00 -1.01 0.00 0.00 57.07 55.83 1war s TYR 178 Cb 0.14 -0.64 0.01 0.00 -0.11 0.00 0.00 41.96 41.37 1war s TYR 178 CO 0.69 -0.10 -0.16 0.08 -1.11 0.00 0.00 175.55 174.96 1war s VAL 179 N 0.22 1.52 0.09 0.71 1.01 -1.26 -0.87 120.40 121.83 1war s VAL 179 Ca -0.03 -0.67 0.10 0.00 0.00 0.00 0.00 61.98 61.38 1war s VAL 179 Cb -0.08 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 1war s VAL 179 CO 0.00 0.44 -0.26 -0.76 0.00 0.00 0.00 175.10 174.52 1war s LEU 180 N 0.89 2.26 0.03 3.92 1.43 0.31 -0.71 118.68 126.80 1war s LEU 180 Ca -0.09 -0.68 0.07 0.00 -1.03 0.00 0.00 54.13 52.40 1war s LEU 180 Cb -0.15 -1.23 -0.02 0.00 0.03 0.00 0.00 46.19 44.82 1war s LEU 180 CO -0.00 0.21 -0.21 -0.69 0.23 0.00 0.00 176.35 175.88 1war s VAL 181 N -0.96 1.70 0.02 -1.59 1.01 -0.72 -1.21 120.40 118.66 1war s VAL 181 Ca 0.13 -1.12 0.03 0.00 0.00 0.00 0.00 61.98 61.01 1war s VAL 181 Cb -0.10 -1.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.81 1war s VAL 181 CO 0.04 0.30 -0.10 0.00 0.00 0.00 0.00 175.10 175.35 1war s ALA 182 N -0.71 0.78 0.25 5.51 0.00 0.12 -0.52 121.76 127.18 1war s ALA 182 Ca 0.08 -0.57 -0.22 0.00 0.00 0.00 0.00 51.96 51.25 1war s ALA 182 Cb -0.09 -0.12 0.03 0.00 0.00 0.00 0.00 23.12 22.95 1war s ALA 182 CO 0.01 0.13 0.70 0.20 0.00 0.00 0.00 175.76 176.81 1war s GLY 183 N -0.78 -0.21 -0.05 0.00 0.00 -0.65 -1.10 107.32 104.54 1war s GLY 183 Ca -0.00 -0.11 -0.23 0.00 0.00 0.00 0.00 44.72 44.37 1war s GLY 183 CO 0.00 -0.03 1.01 0.84 0.00 0.00 0.00 173.10 174.92 1war h HIS 184 N 2.00 -0.14 -3.94 1.90 2.76 -1.78 -3.34 115.15 112.60 1war h HIS 184 Ca -0.22 -0.00 -0.49 0.00 -2.20 0.00 0.00 60.37 57.45 1war h HIS 184 Cb 1.26 0.05 0.02 0.00 1.55 0.00 0.00 27.41 30.29 1war h HIS 184 CO 0.38 0.34 0.43 0.71 -1.30 0.00 0.00 177.93 178.50 1war s TYR 185 N -3.66 3.26 0.57 5.26 2.02 -1.26 -2.05 117.35 121.50 1war s TYR 185 Ca -0.14 1.64 -0.17 0.00 -0.37 0.00 0.00 57.07 58.03 1war s TYR 185 Cb 0.01 -3.18 -0.05 0.00 -0.40 0.00 0.00 41.96 38.34 1war s TYR 185 CO 0.55 -0.73 1.06 -1.25 -1.57 0.00 0.00 175.55 173.61 1war s PRO 186 N -2.37 3.40 -0.05 -1.71 0.04 -1.26 -4.82 135.00 128.22 1war s PRO 186 Ca 0.57 1.25 -0.00 0.00 0.04 0.00 0.00 61.00 62.85 1war s PRO 186 Cb -0.24 -2.04 -0.00 0.00 0.04 0.00 0.00 34.50 32.25 1war s PRO 186 CO 0.30 -0.75 -0.01 0.28 0.04 0.00 0.00 177.00 176.87 1war h VAL 187 N 0.66 0.00 -3.54 -0.36 2.07 -1.91 -2.92 116.25 110.25 1war h VAL 187 Ca -0.47 -0.52 -0.67 0.00 0.82 0.00 0.00 66.70 65.85 1war h VAL 187 Cb 1.22 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.83 1war h VAL 187 CO 0.58 0.00 -0.69 0.26 0.02 0.00 0.00 177.57 177.73 1war s TRP 188 N -1.32 2.91 -0.26 1.57 0.52 -1.26 -2.83 118.94 118.27 1war s TRP 188 Ca -0.01 -0.03 -0.26 0.00 0.02 0.00 0.00 56.10 55.82 1war s TRP 188 Cb 0.00 -1.60 0.14 0.00 -1.15 0.00 0.00 33.47 30.87 1war s TRP 188 CO 0.01 0.40 1.13 0.45 0.02 0.00 0.00 176.95 178.96 1war s SER 189 N -1.59 -0.33 0.00 2.95 0.15 -1.26 -4.85 113.70 108.77 1war s SER 189 Ca 0.19 0.58 0.25 0.00 0.70 0.00 0.00 55.95 57.67 1war s SER 189 Cb -0.11 0.57 0.62 0.00 -1.71 0.00 0.00 66.02 65.39 1war s SER 189 CO 0.09 -0.15 1.50 2.30 1.20 0.00 0.00 173.24 178.18 1war n ILE 190 N 1.72 0.07 -0.59 6.45 -5.35 -1.26 -3.03 119.36 117.37 1war n ILE 190 Ca -0.11 -0.40 0.00 0.00 -0.27 0.00 0.00 62.75 61.97 1war n ILE 190 Cb 0.57 0.92 0.00 0.00 -1.74 0.00 0.00 39.64 39.39 1war n ILE 190 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1war n ALA 191 N 0.78 0.00 -0.08 -1.28 0.00 -1.26 -1.19 120.51 117.47 1war n ALA 191 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.48 1war n ALA 191 Cb 0.47 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.92 1war n ALA 191 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1war h GLU 192 N 0.00 0.84 0.14 0.00 9.09 -1.94 -3.00 114.58 119.71 1war h GLU 192 Ca 0.00 -0.47 -0.35 0.00 0.05 0.00 0.00 59.36 58.58 1war h GLU 192 Cb 0.00 0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.12 1war h GLU 192 CO 0.00 1.11 -1.87 0.45 0.05 0.00 0.00 179.01 178.75 1war h HIS 193 N 0.67 0.55 -0.27 2.06 3.86 -1.92 -3.47 115.15 116.64 1war h HIS 193 Ca 0.04 -0.40 0.00 0.00 -1.16 0.00 0.00 60.37 58.85 1war h HIS 193 Cb 1.03 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.48 1war h HIS 193 CO 0.06 1.69 0.00 0.41 0.86 0.00 0.00 177.93 180.95 1war n GLY 194 N 1.91 -1.46 3.70 2.45 0.00 -1.14 -4.85 105.19 105.79 1war n GLY 194 Ca -0.28 -1.28 -0.41 0.00 0.00 0.00 0.00 46.02 44.05 1war n GLY 194 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1war n PRO 195 N -0.17 1.97 -3.23 1.61 -0.02 -1.17 -4.52 135.00 129.46 1war n PRO 195 Ca 0.00 0.70 -0.43 0.00 -2.02 0.00 0.00 63.50 61.75 1war n PRO 195 Cb 0.00 -2.36 -0.08 0.00 -0.02 0.00 0.00 33.50 31.04 1war n PRO 195 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1war s THR 196 N -1.17 4.98 0.28 3.45 2.01 -1.10 -4.96 115.64 119.12 1war s THR 196 Ca 0.59 -0.26 -0.01 0.00 0.31 0.00 0.00 61.69 62.32 1war s THR 196 Cb -0.52 -4.13 0.27 0.00 0.01 0.00 0.00 72.50 68.13 1war s THR 196 CO 0.59 -0.54 1.89 -0.74 -0.69 0.00 0.00 174.62 175.14 1war h HIS 197 N 8.81 1.15 -0.85 4.92 2.76 -1.89 0.20 115.15 130.27 1war h HIS 197 Ca -0.26 0.03 0.08 0.00 -2.20 0.00 0.00 60.37 58.02 1war h HIS 197 Cb 1.10 -0.38 -0.06 0.00 1.55 0.00 0.00 27.41 29.63 1war h HIS 197 CO 0.67 0.60 0.55 0.00 -1.30 0.00 0.00 177.93 178.46 1war h LEU 199 N 0.87 0.16 -0.80 0.00 3.38 -1.34 -1.98 115.31 115.59 1war h LEU 199 Ca 0.38 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 58.09 1war h LEU 199 Cb 0.34 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1war h LEU 199 CO -0.15 1.16 0.20 0.58 0.09 0.00 0.00 178.44 180.32 1war h VAL 200 N 0.03 1.26 -0.02 1.22 2.07 -0.80 -0.49 116.25 119.51 1war h VAL 200 Ca -0.13 -0.91 -0.05 0.00 0.82 0.00 0.00 66.70 66.43 1war h VAL 200 Cb 1.90 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1war h VAL 200 CO 0.14 0.35 -0.17 0.50 0.02 0.00 0.00 177.57 178.41 1war h LYS 201 N 1.05 0.15 0.00 1.57 3.64 -1.27 -3.36 116.57 118.35 1war h LYS 201 Ca 0.22 -0.14 -0.38 0.00 -1.27 0.00 0.00 60.65 59.09 1war h LYS 201 Cb 0.32 0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.11 1war h LYS 201 CO -0.00 0.83 -2.43 1.04 -2.27 0.00 0.00 179.45 176.61 1war n GLN 202 N -4.58 0.68 -0.08 1.90 6.02 -0.74 -4.59 117.38 115.98 1war n GLN 202 Ca -0.09 0.07 -0.21 0.00 -0.01 0.00 0.00 57.00 56.75 1war n GLN 202 Cb 0.44 -1.52 -0.12 0.00 1.02 0.00 0.00 30.24 30.06 1war n GLN 202 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1war n LEU 203 N -2.99 2.61 -0.24 1.08 7.94 -0.32 -4.55 117.00 120.52 1war n LEU 203 Ca -0.39 0.11 0.02 0.00 -1.11 0.00 0.00 56.01 54.64 1war n LEU 203 Cb 1.08 -0.98 0.14 0.00 0.53 0.00 0.00 43.42 44.19 1war n LEU 203 CO 0.35 0.79 1.03 -0.09 -1.11 0.00 0.00 177.39 178.36 1war h ARG 204 N -0.21 0.49 -0.97 1.96 2.43 -1.34 -1.98 114.38 114.77 1war h ARG 204 Ca -0.51 -0.03 0.07 0.00 -0.81 0.00 0.00 59.98 58.69 1war h ARG 204 Cb 1.85 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 31.23 1war h ARG 204 CO -0.08 0.32 0.63 -1.35 -1.51 0.00 0.00 179.97 177.98 1war h PRO 205 N 0.50 1.09 0.00 0.20 0.11 -1.80 -2.03 132.00 130.07 1war h PRO 205 Ca 0.36 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.33 1war h PRO 205 Cb 0.44 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.30 1war h PRO 205 CO -0.32 0.72 -0.34 -0.07 -0.21 0.00 0.00 178.00 177.79 1war h LEU 206 N 1.12 0.00 -0.41 2.35 3.38 -1.60 -2.47 115.31 117.68 1war h LEU 206 Ca 0.42 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.37 1war h LEU 206 Cb 0.18 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1war h LEU 206 CO -0.16 0.34 0.19 -0.07 0.09 0.00 0.00 178.44 178.82 1war h LEU 207 N 0.00 0.55 -0.03 1.67 3.38 -1.21 -2.19 115.31 117.49 1war h LEU 207 Ca -0.00 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1war h LEU 207 Cb 0.60 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1war h LEU 207 CO 0.04 0.54 -0.03 0.00 0.09 0.00 0.00 178.44 179.09 1war h ALA 208 N 1.03 0.04 -0.92 1.53 0.00 -1.57 -2.12 119.26 117.25 1war h ALA 208 Ca 0.14 -0.27 0.18 0.00 0.00 0.00 0.00 54.91 54.97 1war h ALA 208 Cb 0.15 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 17.82 1war h ALA 208 CO -0.02 -0.18 0.49 1.15 0.00 0.00 0.00 179.25 180.69 1war h THR 209 N -0.42 0.65 -0.34 0.00 2.02 -1.37 -2.95 112.91 110.51 1war h THR 209 Ca 0.00 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1war h THR 209 Cb 0.54 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 1war h THR 209 CO 0.01 0.11 0.00 -1.22 0.37 0.00 0.00 175.52 174.79 1war n TYR 210 N -4.88 0.55 -3.06 3.16 4.01 -0.83 -4.95 117.16 111.15 1war n TYR 210 Ca 0.21 -0.56 -0.13 0.00 -0.16 0.00 0.00 57.90 57.26 1war n TYR 210 Cb 0.55 -0.07 0.06 0.00 -0.31 0.00 0.00 39.34 39.56 1war n TYR 210 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1war n GLY 211 N 0.37 -0.05 3.73 2.72 0.00 -1.06 -4.89 105.19 106.01 1war n GLY 211 Ca 0.13 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1war n GLY 211 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1war s VAL 212 N -3.22 4.07 0.01 1.61 1.01 -0.82 -4.58 120.40 118.48 1war s VAL 212 Ca 0.18 1.65 -0.24 0.00 0.00 0.00 0.00 61.98 63.58 1war s VAL 212 Cb -0.08 -4.06 -0.18 0.00 0.00 0.00 0.00 36.38 32.07 1war s VAL 212 CO 0.47 0.22 1.34 0.74 0.00 0.00 0.00 175.10 177.87 1war h THR 213 N 4.10 1.34 -3.01 3.92 2.02 -1.26 -3.44 112.91 116.58 1war h THR 213 Ca -0.43 -1.10 -0.07 0.00 0.77 0.00 0.00 66.41 65.58 1war h THR 213 Cb 1.21 1.96 -0.16 0.00 -1.74 0.00 0.00 68.15 69.42 1war h THR 213 CO 0.75 0.30 -0.08 0.00 0.37 0.00 0.00 175.52 176.87 1war s ALA 214 N -4.44 -1.06 -0.17 6.16 0.00 -1.25 -2.00 121.76 119.00 1war s ALA 214 Ca -0.15 0.34 -0.03 0.00 0.00 0.00 0.00 51.96 52.11 1war s ALA 214 Cb 0.03 0.38 -0.02 0.00 0.00 0.00 0.00 23.12 23.51 1war s ALA 214 CO 0.70 -0.48 -0.05 -0.47 0.00 0.00 0.00 175.76 175.46 1war s TYR 215 N -2.57 2.96 -0.06 0.00 5.04 -0.14 -1.75 117.35 120.83 1war s TYR 215 Ca -0.05 -0.53 0.01 0.00 -2.44 0.00 0.00 57.07 54.06 1war s TYR 215 Cb -0.01 -1.98 -0.03 0.00 0.35 0.00 0.00 41.96 40.29 1war s TYR 215 CO -0.03 -0.21 -0.04 -0.51 -1.34 0.00 0.00 175.55 173.42 1war s LEU 216 N 0.68 3.31 0.28 6.97 1.02 0.32 -1.75 118.68 129.50 1war s LEU 216 Ca -0.03 0.01 -0.18 0.00 0.02 0.00 0.00 54.13 53.95 1war s LEU 216 Cb -0.15 -1.77 0.01 0.00 0.02 0.00 0.00 46.19 44.30 1war s LEU 216 CO 0.02 0.35 0.64 0.00 0.02 0.00 0.00 176.35 177.38 1war n GLY 218 N -0.44 2.27 4.88 0.00 0.00 -0.87 -0.42 105.19 110.61 1war n GLY 218 Ca -0.03 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1war n GLY 218 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1war n HIS 219 N 0.00 0.00 -2.82 1.61 -0.00 -1.23 -4.34 115.22 108.45 1war n HIS 219 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.31 1war n HIS 219 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 29.95 1war n HIS 219 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1war s ASP 220 N 0.00 7.23 -1.32 0.26 1.01 -1.26 -4.94 116.67 117.64 1war s ASP 220 Ca 0.00 1.49 -0.10 0.00 0.71 0.00 0.00 52.55 54.65 1war s ASP 220 Cb 0.00 -2.52 0.14 0.00 1.01 0.00 0.00 42.92 41.55 1war s ASP 220 CO 0.00 -0.23 1.99 1.41 0.21 0.00 0.00 175.17 178.55 1war n HIS 221 N 3.97 3.00 -3.51 4.23 8.25 -1.25 -3.85 115.22 126.05 1war n HIS 221 Ca 0.04 -2.83 -0.01 0.00 -0.26 0.00 0.00 57.72 54.66 1war n HIS 221 Cb 0.51 -2.06 0.01 0.00 1.12 0.00 0.00 29.99 29.57 1war n HIS 221 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1war n ASN 222 N 4.14 -0.62 -4.26 0.41 0.23 -1.24 -0.68 115.26 113.24 1war n ASN 222 Ca 0.44 -1.36 -0.32 0.00 -0.53 0.00 0.00 54.58 52.81 1war n ASN 222 Cb 0.36 1.02 -0.16 0.00 -2.08 0.00 0.00 39.78 38.92 1war n ASN 222 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1war s LEU 223 N 0.00 2.18 -0.00 -4.53 1.43 -0.92 -2.21 118.68 114.63 1war s LEU 223 Ca 0.07 -0.51 -0.04 0.00 -1.03 0.00 0.00 54.13 52.63 1war s LEU 223 Cb -0.01 -1.43 -0.00 0.00 0.03 0.00 0.00 46.19 44.78 1war s LEU 223 CO 0.02 0.19 0.07 -1.10 0.23 0.00 0.00 176.35 175.76 1war s GLN 224 N 0.15 0.31 -0.11 1.70 -0.21 -0.88 -1.32 119.66 119.30 1war s GLN 224 Ca -0.12 -0.32 0.03 0.00 0.02 0.00 0.00 55.36 54.97 1war s GLN 224 Cb -0.16 0.13 0.01 0.00 1.00 0.00 0.00 33.01 33.98 1war s GLN 224 CO 0.07 -0.06 -0.20 -0.47 -2.12 0.00 0.00 175.29 172.50 1war s TYR 225 N -0.99 2.33 0.11 0.91 5.04 0.17 -1.56 117.35 123.35 1war s TYR 225 Ca -0.11 -1.03 0.05 0.00 -2.44 0.00 0.00 57.07 53.53 1war s TYR 225 Cb -0.06 -1.60 -0.04 0.00 0.35 0.00 0.00 41.96 40.61 1war s TYR 225 CO 0.00 -0.46 -0.12 -0.51 -1.34 0.00 0.00 175.55 173.12 1war s LEU 226 N 0.63 2.41 -0.06 6.97 1.02 -0.39 -1.25 118.68 128.01 1war s LEU 226 Ca -0.13 -0.82 -0.03 0.00 0.02 0.00 0.00 54.13 53.18 1war s LEU 226 Cb -0.16 -0.42 0.04 0.00 0.02 0.00 0.00 46.19 45.66 1war s LEU 226 CO 0.03 -0.21 0.14 -1.58 0.02 0.00 0.00 176.35 174.76 1war s GLN 227 N -2.75 0.09 0.59 1.70 0.74 -0.75 0.45 119.66 119.73 1war s GLN 227 Ca 0.07 0.35 0.01 0.00 0.05 0.00 0.00 55.36 55.84 1war s GLN 227 Cb -0.04 -0.17 0.12 0.00 1.10 0.00 0.00 33.01 34.02 1war s GLN 227 CO 0.01 -0.16 0.82 -0.40 -0.55 0.00 0.00 175.29 175.01 1war n ASP 228 N 4.13 1.20 0.23 6.67 5.68 -0.89 -4.30 116.55 129.26 1war n ASP 228 Ca -0.26 -1.99 0.09 0.00 -0.50 0.00 0.00 54.79 52.14 1war n ASP 228 Cb 0.52 -0.52 0.54 0.00 -1.14 0.00 0.00 41.12 40.52 1war n ASP 228 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1war h GLU 229 N 0.00 0.00 -0.01 0.11 9.09 -1.98 -2.33 114.58 119.46 1war h GLU 229 Ca -0.27 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.14 1war h GLU 229 Cb 1.02 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.12 1war h GLU 229 CO 0.30 0.23 0.00 0.09 0.05 0.00 0.00 179.01 179.68 1war n ASN 230 N -3.66 0.21 0.00 3.06 3.02 -1.26 -4.92 115.26 111.71 1war n ASN 230 Ca -0.01 -1.26 0.00 0.00 -0.03 0.00 0.00 54.58 53.28 1war n ASN 230 Cb 0.35 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 1war n ASN 230 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1war n GLY 231 N 0.93 0.45 3.71 7.41 0.00 -0.88 -5.04 105.19 111.77 1war n GLY 231 Ca 0.19 -0.57 -0.40 0.00 0.00 0.00 0.00 46.02 45.23 1war n GLY 231 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1war s VAL 232 N -2.00 5.00 0.27 1.61 1.01 -1.26 -4.88 120.40 120.14 1war s VAL 232 Ca 0.00 1.56 -0.13 0.00 0.00 0.00 0.00 61.98 63.40 1war s VAL 232 Cb 0.00 -4.09 -0.08 0.00 0.00 0.00 0.00 36.38 32.20 1war s VAL 232 CO 0.00 0.20 0.66 -0.83 0.00 0.00 0.00 175.10 175.13 1war s GLY 233 N 0.89 2.34 -0.26 4.51 0.00 -0.85 -2.10 107.32 111.85 1war s GLY 233 Ca 0.40 -0.07 0.01 0.00 0.00 0.00 0.00 44.72 45.05 1war s GLY 233 CO 0.19 0.13 -0.00 -0.19 0.00 0.00 0.00 173.10 173.22 1war s TYR 234 N -1.86 2.41 -0.37 1.90 1.51 0.17 -0.97 117.35 120.14 1war s TYR 234 Ca 0.50 -1.90 -0.13 0.00 -1.01 0.00 0.00 57.07 54.52 1war s TYR 234 Cb -0.11 -1.79 0.00 0.00 -0.11 0.00 0.00 41.96 39.95 1war s TYR 234 CO 0.19 -0.81 0.26 0.08 -1.11 0.00 0.00 175.55 174.16 1war s VAL 235 N 1.38 5.17 -0.24 0.71 1.01 -0.72 -1.26 120.40 126.46 1war s VAL 235 Ca -0.00 -0.48 -0.06 0.00 0.00 0.00 0.00 61.98 61.43 1war s VAL 235 Cb -0.18 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.40 1war s VAL 235 CO -0.10 -0.16 0.03 -0.22 0.00 0.00 0.00 175.10 174.65 1war s LEU 236 N 1.68 3.26 -0.37 3.92 0.20 -0.60 -1.26 118.68 125.51 1war s LEU 236 Ca 0.05 -0.26 0.01 0.00 0.69 0.00 0.00 54.13 54.61 1war s LEU 236 Cb -0.18 -1.86 0.14 0.00 -0.43 0.00 0.00 46.19 43.86 1war s LEU 236 CO 0.10 -0.02 0.23 -0.55 -0.29 0.00 0.00 176.35 175.81 1war s SER 237 N 1.54 2.90 -0.23 3.68 0.15 0.44 -2.07 113.70 120.10 1war s SER 237 Ca 0.06 -2.35 0.16 0.00 0.70 0.00 0.00 55.95 54.52 1war s SER 237 Cb -0.15 -0.49 0.47 0.00 -1.71 0.00 0.00 66.02 64.14 1war s SER 237 CO 0.01 -0.29 1.16 0.61 1.20 0.00 0.00 173.24 175.94 1war n GLY 238 N 3.84 3.92 0.92 9.45 0.00 -0.94 -1.28 105.19 121.11 1war n GLY 238 Ca 0.14 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1war n GLY 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1war n ALA 239 N -0.57 3.99 0.79 4.61 0.00 -1.23 -3.69 120.51 124.41 1war n ALA 239 Ca 0.23 -3.16 0.11 0.00 0.00 0.00 0.00 53.44 50.61 1war n ALA 239 Cb 0.89 -0.59 0.49 0.00 0.00 0.00 0.00 19.45 20.24 1war n ALA 239 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1war n GLY 240 N -1.12 -1.28 0.00 0.00 0.00 -0.82 -2.21 105.19 99.76 1war n GLY 240 Ca 0.27 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1war n GLY 240 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1war n ASN 241 N -1.50 0.00 -4.36 1.61 5.15 -1.12 -3.41 115.26 111.63 1war n ASN 241 Ca 0.06 0.00 -0.20 0.00 -0.60 0.00 0.00 54.58 53.83 1war n ASN 241 Cb 0.27 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.41 1war n ASN 241 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1war s PHE 242 N -1.00 1.83 -0.09 1.20 0.08 -1.26 -4.61 117.98 114.13 1war s PHE 242 Ca 0.00 -0.50 0.01 0.00 0.12 0.00 0.00 56.93 56.55 1war s PHE 242 Cb 0.00 -0.86 0.02 0.00 -0.57 0.00 0.00 43.02 41.61 1war s PHE 242 CO 0.00 0.40 -0.10 -1.64 -0.10 0.00 0.00 175.22 173.78 1war s MET 243 N -3.36 1.61 -0.17 0.44 -1.94 -1.26 -4.45 119.30 110.18 1war s MET 243 Ca 0.21 -0.33 0.01 0.00 -1.71 0.00 0.00 55.69 53.87 1war s MET 243 Cb -0.03 -1.49 0.02 0.00 2.01 0.00 0.00 34.83 35.34 1war s MET 243 CO 0.08 -0.12 -0.19 0.34 -0.01 0.00 0.00 175.02 175.12 1war s ASP 244 N 1.16 3.03 0.00 3.03 -1.08 0.15 -4.72 116.67 118.24 1war s ASP 244 Ca -0.05 -0.61 0.30 0.00 -0.52 0.00 0.00 52.55 51.67 1war s ASP 244 Cb -0.14 -1.41 1.66 0.00 -1.46 0.00 0.00 42.92 41.57 1war s ASP 244 CO -0.02 0.01 2.09 -0.81 0.52 0.00 0.00 175.17 176.95 1war n PRO 245 N 4.53 1.17 -1.57 4.34 -0.04 -1.19 -4.63 135.00 137.60 1war n PRO 245 Ca -0.20 -0.24 -0.49 0.00 -0.04 0.00 0.00 63.50 62.52 1war n PRO 245 Cb 0.50 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 32.43 1war n PRO 245 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1war n SER 246 N -0.70 1.29 -1.92 3.54 2.88 -1.26 -4.88 113.62 112.57 1war n SER 246 Ca 0.22 1.14 -0.17 0.00 -1.33 0.00 0.00 58.87 58.73 1war n SER 246 Cb 0.17 -1.20 0.05 0.00 -0.75 0.00 0.00 64.21 62.48 1war n SER 246 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1war n LYS 247 N 1.81 3.07 -0.19 -1.46 5.02 -1.26 -4.32 118.16 120.85 1war n LYS 247 Ca 0.16 -3.94 -0.03 0.00 -2.02 0.00 0.00 58.31 52.48 1war n LYS 247 Cb 0.23 -2.07 0.18 0.00 -0.02 0.00 0.00 35.03 33.35 1war n LYS 247 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 1war h ARG 248 N 2.05 0.95 -0.55 1.97 2.43 -1.67 -2.68 114.38 116.89 1war h ARG 248 Ca 0.25 -0.16 -0.07 0.00 -0.81 0.00 0.00 59.98 59.20 1war h ARG 248 Cb 1.45 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 30.79 1war h ARG 248 CO 0.58 0.78 0.08 0.72 -1.51 0.00 0.00 179.97 180.61 1war n HIS 249 N -4.31 1.91 -0.32 2.20 8.25 -0.33 -4.61 115.22 118.00 1war n HIS 249 Ca 0.06 -0.93 0.12 0.00 -0.26 0.00 0.00 57.72 56.70 1war n HIS 249 Cb 0.17 -0.52 0.30 0.00 1.12 0.00 0.00 29.99 31.06 1war n HIS 249 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 1war h GLN 250 N 3.02 0.57 0.00 -0.41 4.15 -1.08 -1.13 115.11 120.24 1war h GLN 250 Ca 0.09 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1war h GLN 250 Cb 1.96 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 29.52 1war h GLN 250 CO 0.50 0.38 -0.13 -2.13 -1.93 0.00 0.00 178.83 175.52 1war n ARG 251 N -4.89 0.22 0.00 1.69 3.00 -1.26 -3.16 116.66 112.25 1war n ARG 251 Ca 0.22 0.15 0.16 0.00 -0.00 0.00 0.00 57.85 58.37 1war n ARG 251 Cb 0.59 -1.72 0.86 0.00 0.00 0.00 0.00 32.46 32.18 1war n ARG 251 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1war n LYS 252 N -2.08 0.97 -4.16 -0.14 4.76 -0.43 -4.78 118.16 112.30 1war n LYS 252 Ca 0.05 -0.11 -0.34 0.00 -2.87 0.00 0.00 58.31 55.04 1war n LYS 252 Cb 0.41 -1.50 -0.11 0.00 -1.84 0.00 0.00 35.03 32.00 1war n LYS 252 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1war s VAL 253 N -2.10 4.45 0.49 -0.18 1.01 -1.19 -4.93 120.40 117.95 1war s VAL 253 Ca 0.43 -0.16 -0.22 0.00 0.00 0.00 0.00 61.98 62.04 1war s VAL 253 Cb 0.22 -2.98 -0.09 0.00 0.00 0.00 0.00 36.38 33.53 1war s VAL 253 CO 0.38 0.48 0.93 -2.65 0.00 0.00 0.00 175.10 174.24 1war n PRO 254 N 3.49 1.10 -1.90 2.72 -0.02 -1.26 -4.90 135.00 134.23 1war n PRO 254 Ca -0.17 0.40 -0.39 0.00 -2.02 0.00 0.00 63.50 61.32 1war n PRO 254 Cb 0.52 -2.03 0.02 0.00 -0.02 0.00 0.00 33.50 31.99 1war n PRO 254 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1war s ASN 255 N -0.95 5.81 0.00 2.55 2.47 -1.26 -2.89 114.94 120.67 1war s ASN 255 Ca 0.68 2.75 0.00 0.00 0.42 0.00 0.00 52.86 56.70 1war s ASN 255 Cb -0.50 -2.64 0.00 0.00 -1.45 0.00 0.00 41.25 36.66 1war s ASN 255 CO 0.54 -1.20 0.00 0.61 -3.72 0.00 0.00 177.10 173.33 1war n GLY 256 N 0.63 3.19 0.15 1.21 0.00 -1.26 -4.94 105.19 104.17 1war n GLY 256 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 1war n GLY 256 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1war h TYR 257 N 0.00 0.53 -2.83 1.61 -1.99 -1.71 -3.43 116.97 109.14 1war h TYR 257 Ca 0.00 -0.16 -0.57 0.00 2.00 0.00 0.00 58.73 60.00 1war h TYR 257 Cb 0.00 -0.11 -0.03 0.00 2.00 0.00 0.00 36.73 38.59 1war h TYR 257 CO 0.00 0.81 1.12 -1.17 -0.00 0.00 0.00 178.16 178.92 1war s LEU 258 N -9.06 3.84 -0.13 3.88 2.96 -1.26 -1.81 118.68 117.11 1war s LEU 258 Ca -0.14 1.50 0.19 0.00 -0.22 0.00 0.00 54.13 55.46 1war s LEU 258 Cb 0.06 -3.53 -0.27 0.00 0.50 0.00 0.00 46.19 42.95 1war s LEU 258 CO 0.77 -1.28 0.22 0.54 -1.32 0.00 0.00 176.35 175.28 1war n ARG 259 N 7.70 0.77 -3.65 1.98 5.12 -0.38 -5.01 116.66 123.19 1war n ARG 259 Ca 0.18 -0.08 -0.14 0.00 -1.93 0.00 0.00 57.85 55.89 1war n ARG 259 Cb 0.46 -1.49 -0.08 0.00 -1.16 0.00 0.00 32.46 30.19 1war n ARG 259 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1war s PHE 260 N -2.84 -0.73 -0.14 -1.55 5.36 -0.90 -4.95 117.98 112.23 1war s PHE 260 Ca -0.09 1.77 -0.12 0.00 -0.96 0.00 0.00 56.93 57.53 1war s PHE 260 Cb 0.09 0.25 0.04 0.00 -0.34 0.00 0.00 43.02 43.06 1war s PHE 260 CO 0.82 -0.35 0.36 -1.58 -1.46 0.00 0.00 175.22 173.01 1war s HIS 261 N 0.37 -0.42 -0.13 10.12 5.65 -1.26 -0.66 115.29 128.96 1war s HIS 261 Ca -0.00 1.00 -0.04 0.00 0.25 0.00 0.00 55.06 56.27 1war s HIS 261 Cb -0.05 0.15 0.06 0.00 -1.18 0.00 0.00 32.58 31.57 1war s HIS 261 CO 0.00 -0.21 0.20 -0.47 -0.65 0.00 0.00 174.74 173.61 1war s TYR 262 N 0.44 -0.26 0.00 3.88 5.04 -0.44 -5.00 117.35 121.00 1war s TYR 262 Ca -0.02 0.58 0.00 0.00 -2.44 0.00 0.00 57.07 55.19 1war s TYR 262 Cb -0.04 -0.24 0.00 0.00 0.35 0.00 0.00 41.96 42.03 1war s TYR 262 CO -0.02 -0.39 0.00 0.41 -1.34 0.00 0.00 175.55 174.21 1war n GLY 263 N 5.33 1.00 2.89 8.97 0.00 -1.26 -2.16 105.19 119.96 1war n GLY 263 Ca -0.05 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.48 1war n GLY 263 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1war n THR 264 N 0.00 0.02 1.62 2.61 5.66 -1.26 -3.14 114.28 119.78 1war n THR 264 Ca 0.00 -0.01 0.14 0.00 -3.05 0.00 0.00 64.05 61.14 1war n THR 264 Cb 0.05 0.00 0.81 0.00 -1.55 0.00 0.00 70.33 69.64 1war n THR 264 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1war n GLU 265 N 1.23 0.68 0.02 1.09 0.28 -1.26 -2.79 120.64 119.89 1war n GLU 265 Ca 0.16 0.01 -0.13 0.00 -0.16 0.00 0.00 57.16 57.04 1war n GLU 265 Cb 0.07 -1.50 -0.02 0.00 1.43 0.00 0.00 31.44 31.42 1war n GLU 265 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1war h ASP 266 N 0.00 0.68 -3.56 -1.84 3.32 -1.94 -3.47 116.42 109.61 1war h ASP 266 Ca 0.00 -0.45 -0.56 0.00 0.02 0.00 0.00 57.03 56.04 1war h ASP 266 Cb 0.13 -0.20 0.18 0.00 0.22 0.00 0.00 39.33 39.66 1war h ASP 266 CO 0.00 1.22 -0.04 -0.24 -1.72 0.00 0.00 179.24 178.47 1war n SER 267 N -3.87 0.07 -0.52 6.45 2.88 -1.12 -4.91 113.62 112.60 1war n SER 267 Ca -0.06 0.68 0.09 0.00 -1.33 0.00 0.00 58.87 58.26 1war n SER 267 Cb 0.73 -1.35 0.32 0.00 -0.75 0.00 0.00 64.21 63.17 1war n SER 267 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1war n LEU 268 N -1.03 1.54 0.00 2.46 4.77 -1.26 -4.85 117.00 118.62 1war n LEU 268 Ca 0.12 -0.68 0.00 0.00 -0.03 0.00 0.00 56.01 55.42 1war n LEU 268 Cb 0.49 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 1war n LEU 268 CO 0.49 0.34 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 1war n GLY 269 N 1.07 -1.72 0.00 -0.72 0.00 -1.26 -4.64 105.19 97.92 1war n GLY 269 Ca 0.14 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 44.17 1war n GLY 269 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1war n GLY 270 N 0.00 -1.50 3.75 -0.02 0.00 -0.94 -1.21 105.19 105.27 1war n GLY 270 Ca 0.00 -1.03 -0.10 0.00 0.00 0.00 0.00 46.02 44.89 1war n GLY 270 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1war s PHE 271 N -2.48 0.33 -0.02 1.61 -0.71 -0.60 -3.91 117.98 112.19 1war s PHE 271 Ca 0.00 -0.94 0.08 0.00 -1.04 0.00 0.00 56.93 55.03 1war s PHE 271 Cb 0.00 0.69 -0.02 0.00 -1.21 0.00 0.00 43.02 42.48 1war s PHE 271 CO 0.00 -1.53 -0.26 0.00 -1.34 0.00 0.00 175.22 172.09 1war s ALA 272 N -2.28 2.17 -0.14 1.99 0.00 -1.03 -1.02 121.76 121.46 1war s ALA 272 Ca 0.19 -1.12 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 1war s ALA 272 Cb -0.04 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.51 1war s ALA 272 CO 0.14 0.53 -0.12 -0.47 0.00 0.00 0.00 175.76 175.84 1war s TYR 273 N -0.62 2.84 -0.08 0.00 5.04 0.46 -0.52 117.35 124.47 1war s TYR 273 Ca 0.10 -0.66 0.04 0.00 -2.44 0.00 0.00 57.07 54.11 1war s TYR 273 Cb -0.10 -1.87 -0.01 0.00 0.35 0.00 0.00 41.96 40.33 1war s TYR 273 CO -0.01 -0.23 -0.22 0.08 -1.34 0.00 0.00 175.55 173.83 1war s VAL 274 N 0.45 2.30 -0.12 3.14 1.01 0.10 -1.01 120.40 126.27 1war s VAL 274 Ca -0.09 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 60.96 1war s VAL 274 Cb -0.16 -1.87 0.01 0.00 0.00 0.00 0.00 36.38 34.36 1war s VAL 274 CO 0.05 0.56 -0.22 -1.61 0.00 0.00 0.00 175.10 173.88 1war s GLU 275 N 0.03 2.91 -0.23 2.72 2.02 -0.22 -1.13 118.70 124.81 1war s GLU 275 Ca -0.08 -0.82 0.01 0.00 0.02 0.00 0.00 54.97 54.09 1war s GLU 275 Cb -0.15 -2.28 0.03 0.00 0.10 0.00 0.00 34.13 31.83 1war s GLU 275 CO 0.05 0.07 -0.13 0.42 0.02 0.00 0.00 175.26 175.70 1war s ILE 276 N 0.60 2.34 0.52 -1.63 1.01 0.10 -0.29 121.20 123.86 1war s ILE 276 Ca -0.13 -1.20 0.05 0.00 0.00 0.00 0.00 60.65 59.38 1war s ILE 276 Cb -0.17 -2.18 0.02 0.00 0.01 0.00 0.00 42.46 40.15 1war s ILE 276 CO 0.03 0.25 0.35 -0.94 0.00 0.00 0.00 174.94 174.64 1war s SER 277 N 1.24 4.60 0.59 3.58 1.04 -0.50 -0.90 113.70 123.35 1war s SER 277 Ca -0.01 -1.24 0.34 0.00 0.48 0.00 0.00 55.95 55.52 1war s SER 277 Cb -0.16 0.30 1.87 0.00 0.10 0.00 0.00 66.02 68.12 1war s SER 277 CO -0.08 -1.02 2.22 0.77 0.98 0.00 0.00 173.24 176.12 1war h SER 278 N 0.87 0.00 0.07 7.02 4.64 -2.00 -3.15 113.55 121.00 1war h SER 278 Ca -0.38 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.56 1war h SER 278 Cb 1.30 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.35 1war h SER 278 CO 0.60 0.03 -2.21 0.29 -0.87 0.00 0.00 176.83 174.67 1war n LYS 279 N -3.52 0.71 -3.57 4.77 4.76 -1.26 -4.87 118.16 115.19 1war n LYS 279 Ca -0.02 0.21 -0.08 0.00 -2.87 0.00 0.00 58.31 55.55 1war n LYS 279 Cb 0.14 -1.63 -0.02 0.00 -1.84 0.00 0.00 35.03 31.68 1war n LYS 279 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 1war s GLU 280 N -2.54 1.04 -0.19 1.97 -1.05 -1.19 -1.99 118.70 114.75 1war s GLU 280 Ca -0.28 -0.46 -0.06 0.00 -0.15 0.00 0.00 54.97 54.02 1war s GLU 280 Cb 0.08 0.43 -0.03 0.00 -0.44 0.00 0.00 34.13 34.17 1war s GLU 280 CO 0.70 -0.46 0.03 1.41 0.95 0.00 0.00 175.26 177.88 1war s MET 281 N -3.31 3.78 -0.04 -4.83 -2.45 -0.32 -1.41 119.30 110.72 1war s MET 281 Ca 0.07 -0.44 0.01 0.00 -1.25 0.00 0.00 55.69 54.07 1war s MET 281 Cb -0.01 -3.15 -0.03 0.00 1.25 0.00 0.00 34.83 32.88 1war s MET 281 CO -0.06 0.12 -0.03 0.99 1.05 0.00 0.00 175.02 177.10 1war s THR 282 N 0.74 3.98 -0.10 10.11 2.01 0.60 -0.09 115.64 132.89 1war s THR 282 Ca 0.02 -0.52 -0.00 0.00 0.31 0.00 0.00 61.69 61.50 1war s THR 282 Cb -0.14 -2.70 0.02 0.00 0.01 0.00 0.00 72.50 69.70 1war s THR 282 CO 0.02 0.49 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.69 1war s VAL 283 N -0.95 0.86 -0.15 3.82 1.01 -0.38 -1.05 120.40 123.57 1war s VAL 283 Ca 0.16 -0.20 -0.00 0.00 0.00 0.00 0.00 61.98 61.93 1war s VAL 283 Cb -0.11 -0.90 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 1war s VAL 283 CO 0.05 0.33 -0.13 -0.89 0.00 0.00 0.00 175.10 174.47 1war s THR 284 N 1.63 3.00 -0.19 3.92 2.01 -0.18 -1.65 115.64 124.17 1war s THR 284 Ca 0.02 -0.67 -0.12 0.00 0.31 0.00 0.00 61.69 61.24 1war s THR 284 Cb -0.13 -2.27 -0.05 0.00 0.01 0.00 0.00 72.50 70.06 1war s THR 284 CO -0.06 0.51 0.21 -0.31 -0.69 0.00 0.00 174.62 174.28 1war s TYR 285 N 0.58 3.41 -0.08 4.92 1.51 -0.04 -0.40 117.35 127.24 1war s TYR 285 Ca -0.08 0.42 0.03 0.00 -1.01 0.00 0.00 57.07 56.43 1war s TYR 285 Cb -0.16 -2.26 0.01 0.00 -0.11 0.00 0.00 41.96 39.44 1war s TYR 285 CO 0.03 0.21 -0.18 0.42 -1.11 0.00 0.00 175.55 174.92 1war s ILE 286 N 0.58 1.59 0.62 2.71 1.01 -0.19 -0.86 121.20 126.67 1war s ILE 286 Ca 0.11 -0.75 -0.12 0.00 0.00 0.00 0.00 60.65 59.90 1war s ILE 286 Cb -0.12 -1.40 -0.03 0.00 0.01 0.00 0.00 42.46 40.92 1war s ILE 286 CO 0.02 0.45 1.03 -0.70 0.00 0.00 0.00 174.94 175.74 1war s GLU 287 N 0.46 3.50 0.37 2.79 2.12 -0.44 -1.56 118.70 125.93 1war s GLU 287 Ca -0.16 0.83 0.27 0.00 0.36 0.00 0.00 54.97 56.28 1war s GLU 287 Cb -0.16 -2.07 1.11 0.00 0.26 0.00 0.00 34.13 33.27 1war s GLU 287 CO 0.06 -0.65 1.81 0.00 -0.54 0.00 0.00 175.26 175.94 1war h ALA 288 N -0.24 1.00 0.00 6.30 0.00 -1.46 -1.20 119.26 123.66 1war h ALA 288 Ca -0.44 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.41 1war h ALA 288 Cb 1.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1war h ALA 288 CO 0.61 0.00 -0.27 0.66 0.00 0.00 0.00 179.25 180.25 1war h SER 289 N 0.00 0.00 0.00 0.00 4.64 -1.93 -3.43 113.55 112.83 1war h SER 289 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1war h SER 289 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1war h SER 289 CO 0.00 0.27 0.00 0.61 -0.87 0.00 0.00 176.83 176.84 1war n GLY 290 N -0.69 1.39 3.77 -0.77 0.00 -0.45 -5.11 105.19 103.33 1war n GLY 290 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1war n GLY 290 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1war s LYS 291 N -0.21 4.11 -0.33 1.61 2.20 -1.26 -4.78 119.74 121.07 1war s LYS 291 Ca 0.00 2.35 -0.27 0.00 -0.36 0.00 0.00 55.97 57.69 1war s LYS 291 Cb 0.00 -2.92 0.01 0.00 -1.51 0.00 0.00 37.83 33.42 1war s LYS 291 CO 0.00 -0.45 0.96 -1.12 -0.36 0.00 0.00 175.35 174.38 1war s SER 292 N -0.43 6.78 -0.05 1.43 0.01 -1.26 -1.32 113.70 118.85 1war s SER 292 Ca 0.53 0.79 -0.06 0.00 1.31 0.00 0.00 55.95 58.52 1war s SER 292 Cb -0.42 -2.48 -0.28 0.00 0.21 0.00 0.00 66.02 63.04 1war s SER 292 CO 0.56 -0.81 0.64 -0.07 0.41 0.00 0.00 173.24 173.97 1war h LEU 293 N 9.95 0.47 -7.00 2.44 3.38 -1.37 -3.49 115.31 119.68 1war h LEU 293 Ca -0.22 -0.78 0.05 0.00 0.09 0.00 0.00 57.88 57.02 1war h LEU 293 Cb 1.07 -0.15 -0.22 0.00 0.09 0.00 0.00 40.66 41.46 1war h LEU 293 CO 0.98 1.67 0.46 0.12 0.09 0.00 0.00 178.44 181.75 1war s PHE 294 N -2.58 -0.44 -0.09 1.13 5.36 -1.22 -5.00 117.98 115.14 1war s PHE 294 Ca -0.15 0.74 -0.05 0.00 -0.96 0.00 0.00 56.93 56.50 1war s PHE 294 Cb 0.06 0.44 0.04 0.00 -0.34 0.00 0.00 43.02 43.22 1war s PHE 294 CO 0.83 -0.42 0.21 0.21 -1.46 0.00 0.00 175.22 174.60 1war s LYS 295 N -1.21 0.19 0.07 10.12 2.20 -1.26 -0.86 119.74 128.99 1war s LYS 295 Ca -0.04 0.41 -0.05 0.00 -0.36 0.00 0.00 55.97 55.94 1war s LYS 295 Cb -0.00 -0.05 -0.02 0.00 -1.51 0.00 0.00 37.83 36.24 1war s LYS 295 CO 0.03 -0.12 0.09 -0.08 -0.36 0.00 0.00 175.35 174.91 1war s THR 296 N 0.85 0.18 0.09 3.43 -1.32 -0.66 -5.02 115.64 113.19 1war s THR 296 Ca -0.06 -1.48 0.09 0.00 -1.21 0.00 0.00 61.69 59.02 1war s THR 296 Cb -0.08 -1.43 -0.03 0.00 -1.51 0.00 0.00 72.50 69.45 1war s THR 296 CO -0.05 -0.81 -0.24 -0.13 -2.21 0.00 0.00 174.62 171.18 1war s ARG 297 N -3.89 1.38 -0.25 7.08 0.52 -1.26 -1.24 118.95 121.29 1war s ARG 297 Ca 0.06 -1.16 0.02 0.00 -0.52 0.00 0.00 55.73 54.13 1war s ARG 297 Cb 0.06 -1.67 0.06 0.00 0.52 0.00 0.00 34.95 33.92 1war s ARG 297 CO -0.10 0.41 -0.09 -0.51 0.02 0.00 0.00 175.30 175.03 1war s LEU 298 N -1.68 3.01 0.65 2.53 1.02 0.86 -4.98 118.68 120.10 1war s LEU 298 Ca 0.10 -1.27 -0.18 0.00 0.02 0.00 0.00 54.13 52.80 1war s LEU 298 Cb -0.10 -1.38 -0.03 0.00 0.02 0.00 0.00 46.19 44.71 1war s LEU 298 CO 0.04 -0.20 1.03 -2.65 0.02 0.00 0.00 176.35 174.59 1war n PRO 299 N 4.54 0.83 -2.12 1.29 -0.02 -1.26 -1.18 135.00 137.09 1war n PRO 299 Ca -0.13 0.33 -0.41 0.00 -2.02 0.00 0.00 63.50 61.27 1war n PRO 299 Cb 0.43 -2.26 -0.02 0.00 -0.02 0.00 0.00 33.50 31.63 1war n PRO 299 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1war s ARG 300 N -3.05 4.34 0.10 -0.52 3.52 -0.84 -4.78 118.95 117.71 1war s ARG 300 Ca 0.77 2.19 0.09 0.00 -0.13 0.00 0.00 55.73 58.66 1war s ARG 300 Cb -0.39 -3.12 -0.03 0.00 -1.56 0.00 0.00 34.95 29.85 1war s ARG 300 CO 0.46 -0.27 -0.24 1.03 -0.81 0.00 0.00 175.30 175.47 1war s ARG 301 N -0.90 1.39 0.57 5.12 0.52 -1.26 -5.01 118.95 119.39 1war s ARG 301 Ca 0.54 -1.20 -0.19 0.00 -0.52 0.00 0.00 55.73 54.36 1war s ARG 301 Cb -0.39 -1.72 -0.04 0.00 0.52 0.00 0.00 34.95 33.31 1war s ARG 301 CO 0.46 0.42 1.16 0.00 0.02 0.00 0.00 175.30 177.35 1war s ALA 302 N -1.01 2.61 0.09 2.13 0.00 -1.26 -4.94 121.76 119.38 1war s ALA 302 Ca 0.11 0.88 0.07 0.00 0.00 0.00 0.00 51.96 53.01 1war s ALA 302 Cb -0.10 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.59 1war s ALA 302 CO 0.04 -0.98 -0.18 1.03 0.00 0.00 0.00 175.76 175.68 1war s ARG 303 N -3.37 0.99 0.00 0.00 0.52 -1.26 -5.05 118.95 110.78 1war s ARG 303 Ca 0.74 -1.08 0.20 0.00 -0.52 0.00 0.00 55.73 55.07 1war s ARG 303 Cb -0.26 -1.13 1.18 0.00 0.52 0.00 0.00 34.95 35.26 1war s ARG 303 CO 0.31 0.26 1.57 -0.35 0.02 0.00 0.00 175.30 177.10