#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sxv s MET 1 N 0.00 4.26 0.11 1.57 0.00 -1.26 -5.01 119.30 118.97 1sxv s MET 1 Ca 0.00 2.25 -0.06 0.00 0.00 0.00 0.00 55.69 57.88 1sxv s MET 1 Cb 0.00 -3.18 -0.02 0.00 0.00 0.00 0.00 34.83 31.63 1sxv s MET 1 CO 0.00 -0.51 0.15 1.14 0.00 0.00 0.00 175.02 175.80 1sxv s GLN 2 N 0.83 0.91 0.19 4.11 -2.07 -1.26 -4.41 119.66 117.97 1sxv s GLN 2 Ca 0.66 -1.17 -0.23 0.00 -1.82 0.00 0.00 55.36 52.80 1sxv s GLN 2 Cb -0.41 0.31 0.05 0.00 -1.09 0.00 0.00 33.01 31.87 1sxv s GLN 2 CO 0.33 -0.29 0.69 -0.59 -1.32 0.00 0.00 175.29 174.12 1sxv s PHE 3 N -3.94 -0.37 -0.11 9.60 -0.12 -0.46 -4.98 117.98 117.61 1sxv s PHE 3 Ca 0.13 0.07 -0.21 0.00 -0.05 0.00 0.00 56.93 56.86 1sxv s PHE 3 Cb 0.05 0.62 -0.04 0.00 -0.63 0.00 0.00 43.02 43.03 1sxv s PHE 3 CO -0.05 -0.96 0.61 -0.51 -0.05 0.00 0.00 175.22 174.26 1sxv s ASP 4 N -2.80 6.83 -0.18 1.98 1.01 -1.26 -0.50 116.67 121.75 1sxv s ASP 4 Ca 0.06 1.00 -0.07 0.00 0.71 0.00 0.00 52.55 54.25 1sxv s ASP 4 Cb -0.03 -2.36 -0.04 0.00 1.01 0.00 0.00 42.92 41.50 1sxv s ASP 4 CO -0.04 -0.10 0.06 -0.69 0.21 0.00 0.00 175.17 174.61 1sxv s VAL 5 N 0.91 4.81 -0.30 -1.27 1.01 -0.21 -1.11 120.40 124.25 1sxv s VAL 5 Ca 0.32 -0.03 -0.20 0.00 0.00 0.00 0.00 61.98 62.07 1sxv s VAL 5 Cb -0.16 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 33.04 1sxv s VAL 5 CO 0.14 0.47 0.62 -0.89 0.00 0.00 0.00 175.10 175.45 1sxv s THR 6 N 0.26 4.95 -0.14 3.92 2.01 -0.04 -0.55 115.64 126.06 1sxv s THR 6 Ca 0.04 0.90 -0.29 0.00 0.31 0.00 0.00 61.69 62.65 1sxv s THR 6 Cb -0.12 -3.98 -0.01 0.00 0.01 0.00 0.00 72.50 68.40 1sxv s THR 6 CO 0.00 -0.10 1.08 -0.63 -0.69 0.00 0.00 174.62 174.27 1sxv s ILE 7 N 2.58 4.61 -0.14 1.82 -1.09 -0.05 -1.57 121.20 127.36 1sxv s ILE 7 Ca 0.25 1.91 -0.04 0.00 -2.23 0.00 0.00 60.65 60.54 1sxv s ILE 7 Cb -0.15 -4.23 -0.25 0.00 -1.58 0.00 0.00 42.46 36.26 1sxv s ILE 7 CO 0.11 -0.06 0.29 -0.62 -1.23 0.00 0.00 174.94 173.43 1sxv n GLU 8 N 5.57 0.73 -3.82 2.79 1.02 0.38 0.06 120.64 127.38 1sxv n GLU 8 Ca 0.11 0.24 -0.29 0.00 -0.02 0.00 0.00 57.16 57.20 1sxv n GLU 8 Cb 0.47 -1.68 -0.16 0.00 -0.02 0.00 0.00 31.44 30.05 1sxv n GLU 8 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1sxv s ILE 9 N -2.55 0.95 0.56 -3.67 1.01 -0.26 -4.37 121.20 112.87 1sxv s ILE 9 Ca -0.23 -0.86 -0.20 0.00 0.00 0.00 0.00 60.65 59.36 1sxv s ILE 9 Cb 0.07 -1.37 -0.04 0.00 0.01 0.00 0.00 42.46 41.13 1sxv s ILE 9 CO 0.75 -0.18 1.25 -2.84 0.00 0.00 0.00 174.94 173.92 1sxv s PRO 10 N 1.66 3.14 0.19 2.79 0.02 -1.26 -0.95 135.00 140.58 1sxv s PRO 10 Ca -0.03 1.95 -0.32 0.00 0.02 0.00 0.00 61.00 62.62 1sxv s PRO 10 Cb -0.18 -2.11 -0.16 0.00 0.02 0.00 0.00 34.50 32.08 1sxv s PRO 10 CO -0.08 -1.10 1.11 1.17 -0.33 0.00 0.00 177.00 177.77 1sxv n LYS 11 N -1.24 1.11 -0.25 5.54 4.81 -1.25 -2.40 118.16 124.50 1sxv n LYS 11 Ca 0.12 0.40 0.00 0.00 -0.87 0.00 0.00 58.31 57.95 1sxv n LYS 11 Cb 0.48 -1.85 0.00 0.00 0.02 0.00 0.00 35.03 33.68 1sxv n LYS 11 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1sxv n GLY 12 N 1.89 0.65 3.80 3.14 0.00 0.08 -4.94 105.19 109.81 1sxv n GLY 12 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1sxv n GLY 12 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1sxv s GLN 13 N -0.75 4.31 -0.00 1.61 -1.52 -1.01 -4.67 119.66 117.62 1sxv s GLN 13 Ca 0.00 0.85 0.18 0.00 -1.95 0.00 0.00 55.36 54.44 1sxv s GLN 13 Cb 0.00 -3.25 -0.20 0.00 -0.22 0.00 0.00 33.01 29.34 1sxv s GLN 13 CO 0.00 0.62 0.72 -2.13 -0.25 0.00 0.00 175.29 174.25 1sxv n ARG 14 N 1.71 1.11 -2.80 2.91 0.63 -1.26 -1.46 116.66 117.49 1sxv n ARG 14 Ca -0.09 -0.01 -0.42 0.00 -0.92 0.00 0.00 57.85 56.40 1sxv n ARG 14 Cb 0.50 -1.34 -0.03 0.00 0.45 0.00 0.00 32.46 32.04 1sxv n ARG 14 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 1sxv s ASN 15 N -2.79 6.99 -0.86 6.15 0.01 -1.26 -1.18 114.94 121.99 1sxv s ASN 15 Ca 0.06 1.23 -0.19 0.00 -0.71 0.00 0.00 52.86 53.25 1sxv s ASN 15 Cb 0.13 -2.48 0.13 0.00 0.41 0.00 0.00 41.25 39.44 1sxv s ASN 15 CO 0.73 -0.53 1.03 -0.75 -1.51 0.00 0.00 177.10 176.07 1sxv s LYS 16 N 2.70 3.50 0.41 -0.60 2.20 -0.02 -4.96 119.74 122.97 1sxv s LYS 16 Ca 0.40 -1.72 -0.18 0.00 -0.36 0.00 0.00 55.97 54.11 1sxv s LYS 16 Cb -0.16 -4.73 -0.10 0.00 -1.51 0.00 0.00 37.83 31.33 1sxv s LYS 16 CO 0.09 -1.70 0.89 0.71 -0.36 0.00 0.00 175.35 174.98 1sxv s TYR 17 N 2.52 3.35 -0.21 4.03 2.02 -1.26 -0.51 117.35 127.29 1sxv s TYR 17 Ca 0.28 1.46 -0.18 0.00 -0.37 0.00 0.00 57.07 58.27 1sxv s TYR 17 Cb -0.08 -2.74 0.06 0.00 -0.40 0.00 0.00 41.96 38.79 1sxv s TYR 17 CO -0.06 -0.09 0.54 -1.21 -1.57 0.00 0.00 175.55 173.16 1sxv s GLU 18 N -3.26 0.61 0.11 -0.62 2.02 0.41 -4.62 118.70 113.35 1sxv s GLU 18 Ca 0.59 0.80 -0.30 0.00 0.02 0.00 0.00 54.97 56.08 1sxv s GLU 18 Cb -0.09 0.26 -0.06 0.00 0.10 0.00 0.00 34.13 34.33 1sxv s GLU 18 CO 0.17 -0.09 1.00 0.08 0.02 0.00 0.00 175.26 176.44 1sxv s VAL 19 N 0.52 4.38 -0.53 2.63 1.01 -1.26 -1.57 120.40 125.57 1sxv s VAL 19 Ca -0.02 1.95 -0.28 0.00 0.00 0.00 0.00 61.98 63.63 1sxv s VAL 19 Cb -0.04 -4.24 0.01 0.00 0.00 0.00 0.00 36.38 32.10 1sxv s VAL 19 CO -0.02 0.29 1.49 -1.81 0.00 0.00 0.00 175.10 175.04 1sxv s ASP 20 N 0.11 6.04 0.52 3.32 1.01 -0.06 -4.91 116.67 122.71 1sxv s ASP 20 Ca 0.48 0.42 0.34 0.00 0.71 0.00 0.00 52.55 54.51 1sxv s ASP 20 Cb -0.25 -2.54 1.55 0.00 1.01 0.00 0.00 42.92 42.69 1sxv s ASP 20 CO 0.31 -1.75 2.01 0.45 0.21 0.00 0.00 175.17 176.40 1sxv h HIS 21 N 11.56 0.00 0.00 4.23 3.86 -1.94 0.77 115.15 133.63 1sxv h HIS 21 Ca -0.27 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 58.82 1sxv h HIS 21 Cb 1.11 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.56 1sxv h HIS 21 CO 1.02 0.00 -0.55 0.93 0.86 0.00 0.00 177.93 180.20 1sxv h GLU 22 N 0.00 0.00 0.00 2.45 3.07 -1.98 -3.37 114.58 114.75 1sxv h GLU 22 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1sxv h GLU 22 Cb 0.34 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.25 1sxv h GLU 22 CO 0.00 0.55 -1.03 0.25 -1.40 0.00 0.00 179.01 177.37 1sxv n THR 23 N -3.87 0.00 -0.84 1.13 -2.24 -0.90 -5.02 114.28 102.55 1sxv n THR 23 Ca -0.01 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1sxv n THR 23 Cb 0.56 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 1sxv n THR 23 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sxv n GLY 24 N 2.47 0.90 3.77 3.38 0.00 0.21 -5.04 105.19 110.90 1sxv n GLY 24 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1sxv n GLY 24 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sxv s ARG 25 N -0.16 3.83 -0.05 1.61 1.81 -1.24 -4.79 118.95 119.95 1sxv s ARG 25 Ca 0.00 1.72 -0.19 0.00 -1.72 0.00 0.00 55.73 55.53 1sxv s ARG 25 Cb 0.00 -2.42 -0.05 0.00 -0.45 0.00 0.00 34.95 32.04 1sxv s ARG 25 CO 0.00 -0.48 0.54 0.08 -0.68 0.00 0.00 175.30 174.76 1sxv s VAL 26 N -1.58 5.04 0.02 3.52 1.01 -1.26 -0.88 120.40 126.27 1sxv s VAL 26 Ca 0.63 1.12 0.06 0.00 0.00 0.00 0.00 61.98 63.79 1sxv s VAL 26 Cb -0.27 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.21 1sxv s VAL 26 CO 0.33 0.38 -0.19 -0.60 0.00 0.00 0.00 175.10 175.02 1sxv s ARG 27 N 0.12 1.36 -0.46 2.72 3.52 -0.61 -4.96 118.95 120.64 1sxv s ARG 27 Ca 0.29 -0.82 -0.28 0.00 -0.13 0.00 0.00 55.73 54.79 1sxv s ARG 27 Cb -0.17 -1.41 0.03 0.00 -1.56 0.00 0.00 34.95 31.84 1sxv s ARG 27 CO 0.14 0.37 1.08 -1.17 -0.81 0.00 0.00 175.30 174.91 1sxv s LEU 28 N -0.92 3.75 -0.01 -0.88 2.96 -1.26 -0.44 118.68 121.88 1sxv s LEU 28 Ca 0.07 0.42 -0.24 0.00 -0.22 0.00 0.00 54.13 54.15 1sxv s LEU 28 Cb -0.08 -3.45 -0.16 0.00 0.50 0.00 0.00 46.19 42.99 1sxv s LEU 28 CO 0.01 -1.17 1.15 -0.78 -1.32 0.00 0.00 176.35 174.24 1sxv h ASP 29 N 9.10 -0.30 -4.48 3.68 1.82 -1.12 -3.48 116.42 121.64 1sxv h ASP 29 Ca -0.23 -0.22 0.16 0.00 -0.39 0.00 0.00 57.03 56.35 1sxv h ASP 29 Cb 1.06 0.08 -0.17 0.00 0.68 0.00 0.00 39.33 40.98 1sxv h ASP 29 CO 1.09 0.11 0.61 0.00 -1.61 0.00 0.00 179.24 179.44 1sxv s ARG 30 N -4.37 0.63 0.05 0.28 1.70 -1.20 -5.04 118.95 111.00 1sxv s ARG 30 Ca -0.14 -0.22 -0.29 0.00 -0.47 0.00 0.00 55.73 54.61 1sxv s ARG 30 Cb 0.02 0.29 -0.04 0.00 -0.57 0.00 0.00 34.95 34.65 1sxv s ARG 30 CO 0.53 -0.27 0.95 -0.47 -1.08 0.00 0.00 175.30 174.95 1sxv s TYR 31 N -2.79 3.73 0.67 5.89 5.04 -1.26 -0.84 117.35 127.79 1sxv s TYR 31 Ca 0.06 1.71 -0.17 0.00 -2.44 0.00 0.00 57.07 56.24 1sxv s TYR 31 Cb -0.01 -3.06 0.00 0.00 0.35 0.00 0.00 41.96 39.24 1sxv s TYR 31 CO -0.07 0.11 1.24 -0.51 -1.34 0.00 0.00 175.55 174.98 1sxv s LEU 32 N 0.48 3.50 0.00 6.97 1.43 -0.33 -4.91 118.68 125.82 1sxv s LEU 32 Ca 0.48 2.46 0.25 0.00 -1.03 0.00 0.00 54.13 56.30 1sxv s LEU 32 Cb -0.22 -4.60 0.55 0.00 0.03 0.00 0.00 46.19 41.95 1sxv s LEU 32 CO 0.28 -2.01 1.44 -1.22 0.23 0.00 0.00 176.35 175.08 1sxv n TYR 33 N -2.14 0.00 -4.22 0.29 4.01 -1.26 -4.87 117.16 108.96 1sxv n TYR 33 Ca 0.14 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.63 1sxv n TYR 33 Cb 0.49 -0.24 -0.07 0.00 -0.31 0.00 0.00 39.34 39.21 1sxv n TYR 33 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1sxv s THR 34 N -2.95 3.71 -1.55 -0.72 -4.23 -1.26 -4.83 115.64 103.81 1sxv s THR 34 Ca 0.12 -1.57 -0.09 0.00 -1.18 0.00 0.00 61.69 58.98 1sxv s THR 34 Cb 0.18 -2.91 -0.03 0.00 1.34 0.00 0.00 72.50 71.07 1sxv s THR 34 CO 0.68 -0.21 2.80 -0.81 -0.54 0.00 0.00 174.62 176.54 1sxv n PRO 35 N -0.46 3.92 -4.40 3.99 -0.04 -1.26 -4.86 135.00 131.90 1sxv n PRO 35 Ca -0.09 -2.54 -0.20 0.00 -0.04 0.00 0.00 63.50 60.63 1sxv n PRO 35 Cb 0.57 -2.77 -0.10 0.00 -0.04 0.00 0.00 33.50 31.16 1sxv n PRO 35 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1sxv s MET 36 N 1.32 1.49 -0.07 0.54 -1.94 -1.26 -5.16 119.30 114.22 1sxv s MET 36 Ca 0.65 -1.73 -0.09 0.00 -1.71 0.00 0.00 55.69 52.82 1sxv s MET 36 Cb 0.18 -1.14 0.02 0.00 2.01 0.00 0.00 34.83 35.90 1sxv s MET 36 CO -0.07 0.08 0.24 0.00 -0.01 0.00 0.00 175.02 175.25 1sxv s ALA 37 N -3.01 -0.58 0.17 3.03 0.00 -1.26 -4.38 121.76 115.73 1sxv s ALA 37 Ca 0.28 0.55 -0.34 0.00 0.00 0.00 0.00 51.96 52.46 1sxv s ALA 37 Cb 0.02 -0.30 -0.14 0.00 0.00 0.00 0.00 23.12 22.71 1sxv s ALA 37 CO 0.11 -0.14 1.57 0.66 0.00 0.00 0.00 175.76 177.96 1sxv n TYR 38 N 2.63 2.30 0.27 0.00 4.02 -0.53 -4.69 117.16 121.15 1sxv n TYR 38 Ca -0.15 0.27 0.13 0.00 -0.01 0.00 0.00 57.90 58.15 1sxv n TYR 38 Cb 0.58 -2.54 0.30 0.00 -0.02 0.00 0.00 39.34 37.66 1sxv n TYR 38 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1sxv h PRO 39 N 5.81 0.00 -4.23 -0.72 0.13 -1.92 0.26 132.00 131.33 1sxv h PRO 39 Ca -0.45 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.52 1sxv h PRO 39 Cb 1.25 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.25 1sxv h PRO 39 CO 0.88 0.00 -0.48 0.95 -0.23 0.00 0.00 178.00 179.12 1sxv s THR 40 N -3.30 0.04 0.35 1.56 -4.23 -1.26 -4.87 115.64 103.94 1sxv s THR 40 Ca 0.06 -1.74 -0.29 0.00 -1.18 0.00 0.00 61.69 58.55 1sxv s THR 40 Cb 0.06 -2.17 -0.11 0.00 1.34 0.00 0.00 72.50 71.62 1sxv s THR 40 CO 0.63 -0.20 1.50 -1.81 -0.54 0.00 0.00 174.62 174.20 1sxv s ASP 41 N -3.06 6.39 -0.01 3.99 1.11 -1.22 -3.77 116.67 120.10 1sxv s ASP 41 Ca 0.27 2.99 0.02 0.00 0.18 0.00 0.00 52.55 56.01 1sxv s ASP 41 Cb 0.05 -2.66 -0.00 0.00 1.07 0.00 0.00 42.92 41.38 1sxv s ASP 41 CO 0.06 -0.85 -0.07 -0.47 1.18 0.00 0.00 175.17 175.02 1sxv s TYR 42 N -0.83 0.64 0.00 4.23 5.04 -0.13 -1.20 117.35 125.10 1sxv s TYR 42 Ca 0.55 -0.13 0.00 0.00 -2.44 0.00 0.00 57.07 55.05 1sxv s TYR 42 Cb -0.46 -0.43 0.00 0.00 0.35 0.00 0.00 41.96 41.42 1sxv s TYR 42 CO 0.58 -0.02 0.00 0.41 -1.34 0.00 0.00 175.55 175.18 1sxv n GLY 43 N 2.99 1.62 3.19 8.97 0.00 0.07 -0.47 105.19 121.56 1sxv n GLY 43 Ca -0.14 0.09 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 1sxv n GLY 43 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1sxv s PHE 44 N 1.00 0.10 -0.13 1.61 -0.12 -0.61 -0.85 117.98 118.98 1sxv s PHE 44 Ca 0.00 -0.44 -0.25 0.00 -0.05 0.00 0.00 56.93 56.19 1sxv s PHE 44 Cb 0.00 -0.04 -0.02 0.00 -0.63 0.00 0.00 43.02 42.33 1sxv s PHE 44 CO 0.00 -0.49 0.82 0.42 -0.05 0.00 0.00 175.22 175.91 1sxv s ILE 45 N -3.27 4.92 0.54 -4.49 1.01 0.37 -0.86 121.20 119.42 1sxv s ILE 45 Ca 0.00 1.63 -0.22 0.00 0.00 0.00 0.00 60.65 62.06 1sxv s ILE 45 Cb 0.02 -4.13 -0.05 0.00 0.01 0.00 0.00 42.46 38.31 1sxv s ILE 45 CO -0.08 0.09 1.34 -1.61 0.00 0.00 0.00 174.94 174.68 1sxv s GLU 46 N 1.76 3.16 -1.28 2.79 0.41 -0.27 -3.38 118.70 121.88 1sxv s GLU 46 Ca 0.39 2.20 -0.08 0.00 -0.41 0.00 0.00 54.97 57.07 1sxv s GLU 46 Cb -0.17 -2.25 0.01 0.00 -1.78 0.00 0.00 34.13 29.94 1sxv s GLU 46 CO 0.15 -1.16 1.12 -0.25 -0.49 0.00 0.00 175.26 174.62 1sxv n ASP 47 N -1.03 -5.96 -4.28 -0.19 8.00 -1.26 -4.84 116.55 106.99 1sxv n ASP 47 Ca 0.10 -0.52 -0.25 0.00 0.71 0.00 0.00 54.79 54.84 1sxv n ASP 47 Cb 0.45 -4.80 -0.13 0.00 -0.02 0.00 0.00 41.12 36.62 1sxv n ASP 47 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1sxv s THR 48 N -3.30 1.74 -0.29 -3.53 -4.23 -1.22 -4.41 115.64 100.40 1sxv s THR 48 Ca 0.53 -1.39 0.01 0.00 -1.18 0.00 0.00 61.69 59.66 1sxv s THR 48 Cb -0.23 -1.55 0.09 0.00 1.34 0.00 0.00 72.50 72.15 1sxv s THR 48 CO 0.69 0.09 0.04 -0.22 -0.54 0.00 0.00 174.62 174.68 1sxv s LEU 49 N -1.55 3.12 0.00 4.79 2.96 -0.28 -4.06 118.68 123.66 1sxv s LEU 49 Ca 0.08 -1.65 -0.00 0.00 -0.22 0.00 0.00 54.13 52.33 1sxv s LEU 49 Cb -0.09 -1.20 0.01 0.00 0.50 0.00 0.00 46.19 45.41 1sxv s LEU 49 CO 0.03 -0.35 0.04 0.61 -1.32 0.00 0.00 176.35 175.37 1sxv n GLY 50 N 4.61 -0.64 0.24 7.98 0.00 0.63 -4.27 105.19 113.74 1sxv n GLY 50 Ca -0.03 -1.75 0.11 0.00 0.00 0.00 0.00 46.02 44.35 1sxv n GLY 50 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1sxv h ASP 51 N -0.05 0.00 -0.34 1.61 3.32 -1.93 -2.19 116.42 116.84 1sxv h ASP 51 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1sxv h ASP 51 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1sxv h ASP 51 CO 0.01 0.17 0.00 -0.90 -1.72 0.00 0.00 179.24 176.81 1sxv n ASP 52 N -3.57 3.05 0.00 6.45 5.75 -1.26 -4.85 116.55 122.12 1sxv n ASP 52 Ca -0.01 -1.94 0.00 0.00 -0.01 0.00 0.00 54.79 52.83 1sxv n ASP 52 Cb 0.32 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 1sxv n ASP 52 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1sxv n GLY 53 N 1.42 0.67 3.72 6.12 0.00 -0.82 -5.04 105.19 111.26 1sxv n GLY 53 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 1sxv n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1sxv s ASP 54 N -2.34 4.68 0.51 1.61 1.01 -1.26 -4.74 116.67 116.14 1sxv s ASP 54 Ca 0.00 -0.73 -0.21 0.00 0.71 0.00 0.00 52.55 52.31 1sxv s ASP 54 Cb 0.00 -0.77 -0.08 0.00 1.01 0.00 0.00 42.92 43.08 1sxv s ASP 54 CO 0.00 -0.23 0.99 -2.65 0.21 0.00 0.00 175.17 173.48 1sxv n PRO 55 N -1.10 1.16 -2.47 8.23 -0.02 -1.26 -0.27 135.00 139.28 1sxv n PRO 55 Ca -0.04 0.43 -0.43 0.00 -2.02 0.00 0.00 63.50 61.45 1sxv n PRO 55 Cb 0.61 -2.11 -0.02 0.00 -0.02 0.00 0.00 33.50 31.95 1sxv n PRO 55 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1sxv s LEU 56 N -1.21 4.21 0.59 2.45 2.96 -1.26 -4.71 118.68 121.71 1sxv s LEU 56 Ca 0.69 1.70 -0.17 0.00 -0.22 0.00 0.00 54.13 56.13 1sxv s LEU 56 Cb -0.48 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.63 1sxv s LEU 56 CO 0.53 -0.68 1.11 -1.81 -1.32 0.00 0.00 176.35 174.18 1sxv s ASP 57 N 1.70 5.49 -0.00 3.68 1.01 -1.25 -0.48 116.67 126.81 1sxv s ASP 57 Ca 0.54 2.07 -0.03 0.00 0.71 0.00 0.00 52.55 55.84 1sxv s ASP 57 Cb -0.22 -2.56 -0.00 0.00 1.01 0.00 0.00 42.92 41.14 1sxv s ASP 57 CO 0.17 -1.37 0.06 0.00 0.21 0.00 0.00 175.17 174.23 1sxv s ALA 58 N -2.06 -0.12 -0.12 5.23 0.00 -0.03 -1.02 121.76 123.64 1sxv s ALA 58 Ca 0.70 -0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1sxv s ALA 58 Cb -0.22 0.04 -0.02 0.00 0.00 0.00 0.00 23.12 22.93 1sxv s ALA 58 CO 0.33 -0.13 -0.12 -0.51 0.00 0.00 0.00 175.76 175.33 1sxv s LEU 59 N -0.91 2.79 -0.17 0.00 1.43 0.39 -0.75 118.68 121.47 1sxv s LEU 59 Ca -0.10 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 52.73 1sxv s LEU 59 Cb -0.06 -1.62 0.02 0.00 0.03 0.00 0.00 46.19 44.56 1sxv s LEU 59 CO 0.00 0.20 -0.18 -0.69 0.23 0.00 0.00 176.35 175.90 1sxv s VAL 60 N 0.16 1.91 0.02 -1.59 1.01 -0.34 -0.29 120.40 121.28 1sxv s VAL 60 Ca -0.06 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 60.76 1sxv s VAL 60 Cb -0.15 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 1sxv s VAL 60 CO 0.05 0.52 1.15 -0.76 0.00 0.00 0.00 175.10 176.06 1sxv s LEU 61 N 1.30 4.35 0.02 3.92 1.43 -0.30 -3.46 118.68 125.94 1sxv s LEU 61 Ca 0.04 1.89 -0.06 0.00 -1.03 0.00 0.00 54.13 54.97 1sxv s LEU 61 Cb -0.13 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.51 1sxv s LEU 61 CO -0.11 -0.46 0.11 -0.76 0.23 0.00 0.00 176.35 175.36 1sxv s LEU 62 N 1.34 1.70 0.44 1.79 1.43 -1.26 -4.24 118.68 119.88 1sxv s LEU 62 Ca 0.57 -0.40 0.25 0.00 -1.03 0.00 0.00 54.13 53.52 1sxv s LEU 62 Cb -0.27 0.63 0.79 0.00 0.03 0.00 0.00 46.19 47.37 1sxv s LEU 62 CO 0.27 -0.45 1.77 1.55 0.23 0.00 0.00 176.35 179.72 1sxv h PRO 63 N 3.93 0.00 -2.82 1.29 0.13 -2.04 -3.44 132.00 129.05 1sxv h PRO 63 Ca -0.32 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.67 1sxv h PRO 63 Cb 1.19 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.06 1sxv h PRO 63 CO 0.46 0.17 -0.34 -1.14 -0.23 0.00 0.00 178.00 176.92 1sxv s GLN 64 N -3.47 0.37 0.90 0.86 0.74 -1.26 -5.16 119.66 112.63 1sxv s GLN 64 Ca 0.02 0.61 -0.11 0.00 0.05 0.00 0.00 55.36 55.94 1sxv s GLN 64 Cb 0.09 0.06 0.13 0.00 1.10 0.00 0.00 33.01 34.38 1sxv s GLN 64 CO 0.64 -0.11 1.11 -2.14 -0.55 0.00 0.00 175.29 174.23 1sxv s PRO 65 N 0.84 1.22 0.00 1.67 0.02 -1.26 -5.07 135.00 132.42 1sxv s PRO 65 Ca -0.05 1.23 0.00 0.00 0.02 0.00 0.00 61.00 62.19 1sxv s PRO 65 Cb -0.06 -1.77 0.00 0.00 0.02 0.00 0.00 34.50 32.68 1sxv s PRO 65 CO -0.06 -2.38 0.00 1.33 -0.33 0.00 0.00 177.00 175.55 1sxv n VAL 66 N -4.03 0.00 -4.32 3.83 0.24 -1.26 -5.06 118.33 107.73 1sxv n VAL 66 Ca 0.09 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 62.14 1sxv n VAL 66 Cb 0.53 -0.83 -0.09 0.00 -1.47 0.00 0.00 33.84 31.99 1sxv n VAL 66 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1sxv s PHE 67 N 2.00 2.60 0.26 6.34 0.08 -1.26 -4.69 117.98 123.31 1sxv s PHE 67 Ca 0.00 -0.24 -0.31 0.00 0.12 0.00 0.00 56.93 56.50 1sxv s PHE 67 Cb 0.00 -1.22 -0.12 0.00 -0.57 0.00 0.00 43.02 41.11 1sxv s PHE 67 CO 0.00 0.57 1.53 -2.30 -0.10 0.00 0.00 175.22 174.92 1sxv n PRO 68 N -0.31 2.42 -0.11 0.24 -0.02 -1.26 -2.35 135.00 133.61 1sxv n PRO 68 Ca -0.09 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1sxv n PRO 68 Cb 0.57 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1sxv n PRO 68 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1sxv n GLY 69 N 2.33 0.70 3.74 -1.23 0.00 0.11 -5.00 105.19 105.84 1sxv n GLY 69 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1sxv n GLY 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sxv s VAL 70 N -2.37 4.36 0.20 1.61 1.01 -0.99 -4.76 120.40 119.47 1sxv s VAL 70 Ca 0.00 2.05 -0.27 0.00 0.00 0.00 0.00 61.98 63.77 1sxv s VAL 70 Cb 0.00 -4.31 -0.08 0.00 0.00 0.00 0.00 36.38 31.98 1sxv s VAL 70 CO 0.00 0.39 0.84 -0.76 0.00 0.00 0.00 175.10 175.57 1sxv s LEU 71 N -0.43 4.59 -0.05 3.92 1.43 -1.26 -0.87 118.68 126.01 1sxv s LEU 71 Ca 0.44 1.75 -0.00 0.00 -1.03 0.00 0.00 54.13 55.29 1sxv s LEU 71 Cb -0.24 -3.46 0.03 0.00 0.03 0.00 0.00 46.19 42.54 1sxv s LEU 71 CO 0.30 0.17 -0.00 0.54 0.23 0.00 0.00 176.35 177.58 1sxv s VAL 72 N -1.21 0.32 0.00 -1.59 0.11 0.29 -4.97 120.40 113.34 1sxv s VAL 72 Ca 0.39 0.09 -0.30 0.00 -2.93 0.00 0.00 61.98 59.22 1sxv s VAL 72 Cb -0.23 -0.44 -0.06 0.00 -1.53 0.00 0.00 36.38 34.12 1sxv s VAL 72 CO 0.28 0.21 1.45 0.00 -3.33 0.00 0.00 175.10 173.71 1sxv s ALA 73 N 1.50 3.60 0.10 1.54 0.00 -1.26 -1.04 121.76 126.20 1sxv s ALA 73 Ca -0.02 0.92 0.02 0.00 0.00 0.00 0.00 51.96 52.87 1sxv s ALA 73 Cb -0.13 -3.62 -0.04 0.00 0.00 0.00 0.00 23.12 19.33 1sxv s ALA 73 CO -0.03 -0.97 -0.05 0.00 0.00 0.00 0.00 175.76 174.70 1sxv s ALA 74 N 2.55 0.98 0.03 0.00 0.00 0.35 -1.08 121.76 124.59 1sxv s ALA 74 Ca 0.66 -1.37 0.04 0.00 0.00 0.00 0.00 51.96 51.29 1sxv s ALA 74 Cb -0.32 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 1sxv s ALA 74 CO 0.27 -0.26 -0.12 -0.98 0.00 0.00 0.00 175.76 174.68 1sxv s ARG 75 N -3.85 0.82 0.30 0.00 1.70 -0.14 -1.36 118.95 116.42 1sxv s ARG 75 Ca 0.13 -0.67 -0.23 0.00 -0.47 0.00 0.00 55.73 54.49 1sxv s ARG 75 Cb 0.06 -0.78 -0.09 0.00 -0.57 0.00 0.00 34.95 33.56 1sxv s ARG 75 CO -0.04 0.19 0.87 -1.25 -1.08 0.00 0.00 175.30 173.99 1sxv s PRO 76 N -1.03 4.42 0.00 3.89 0.04 -1.26 -1.52 135.00 139.54 1sxv s PRO 76 Ca 0.00 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.17 1sxv s PRO 76 Cb -0.07 -2.75 0.00 0.00 0.04 0.00 0.00 34.50 31.72 1sxv s PRO 76 CO 0.01 0.28 0.44 1.33 0.04 0.00 0.00 177.00 179.09 1sxv n VAL 77 N 0.45 0.16 -2.65 -0.36 0.24 0.45 -4.90 118.33 111.72 1sxv n VAL 77 Ca 0.01 -0.38 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 1sxv n VAL 77 Cb 0.51 1.21 0.00 0.00 -1.47 0.00 0.00 33.84 34.09 1sxv n VAL 77 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1sxv n GLY 78 N -0.08 -1.77 3.58 7.63 0.00 -1.19 -1.19 105.19 112.17 1sxv n GLY 78 Ca 0.00 -1.29 -0.14 0.00 0.00 0.00 0.00 46.02 44.59 1sxv n GLY 78 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1sxv s MET 79 N -1.99 0.80 -0.45 1.61 1.75 -0.48 -0.83 119.30 119.71 1sxv s MET 79 Ca 0.00 0.91 -0.21 0.00 -1.25 0.00 0.00 55.69 55.13 1sxv s MET 79 Cb 0.00 0.39 0.03 0.00 2.84 0.00 0.00 34.83 38.09 1sxv s MET 79 CO 0.00 -0.10 0.68 0.12 -0.65 0.00 0.00 175.02 175.06 1sxv s PHE 80 N 0.29 3.04 -0.45 4.11 5.36 0.20 -0.65 117.98 129.87 1sxv s PHE 80 Ca -0.00 -0.05 -0.19 0.00 -0.96 0.00 0.00 56.93 55.72 1sxv s PHE 80 Cb -0.05 -3.45 0.03 0.00 -0.34 0.00 0.00 43.02 39.22 1sxv s PHE 80 CO 0.01 -0.92 0.58 0.50 -1.46 0.00 0.00 175.22 173.93 1sxv s ARG 81 N 2.93 3.18 0.01 10.12 3.52 0.83 -0.95 118.95 138.59 1sxv s ARG 81 Ca 0.24 -0.63 0.04 0.00 -0.13 0.00 0.00 55.73 55.25 1sxv s ARG 81 Cb -0.14 -4.00 -0.01 0.00 -1.56 0.00 0.00 34.95 29.24 1sxv s ARG 81 CO 0.19 -1.03 -0.12 0.00 -0.81 0.00 0.00 175.30 173.52 1sxv s MET 82 N 2.59 0.94 -0.15 5.12 0.23 -1.26 -1.48 119.30 125.29 1sxv s MET 82 Ca 0.18 -0.53 0.01 0.00 -1.03 0.00 0.00 55.69 54.32 1sxv s MET 82 Cb -0.16 -0.91 0.00 0.00 -1.53 0.00 0.00 34.83 32.23 1sxv s MET 82 CO 0.15 0.24 -0.18 0.08 -2.03 0.00 0.00 175.02 173.29 1sxv s VAL 83 N -0.47 2.39 0.00 5.16 1.01 -0.15 -0.92 120.40 127.42 1sxv s VAL 83 Ca 0.03 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.15 1sxv s VAL 83 Cb -0.06 -1.99 0.00 0.00 0.00 0.00 0.00 36.38 34.33 1sxv s VAL 83 CO 0.00 0.53 0.00 -0.90 0.00 0.00 0.00 175.10 174.73 1sxv n ASP 84 N 4.15 0.63 0.30 3.32 5.68 -0.44 -0.39 116.55 129.81 1sxv n ASP 84 Ca -0.20 -0.32 0.17 0.00 -0.50 0.00 0.00 54.79 53.95 1sxv n ASP 84 Cb 0.51 0.00 0.97 0.00 -1.14 0.00 0.00 41.12 41.47 1sxv n ASP 84 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1sxv h GLU 85 N 0.00 0.00 0.00 0.11 9.09 -1.82 -1.37 114.58 120.59 1sxv h GLU 85 Ca 0.00 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.31 1sxv h GLU 85 Cb 0.00 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.09 1sxv h GLU 85 CO 0.00 0.02 -0.47 0.45 0.05 0.00 0.00 179.01 179.06 1sxv h HIS 86 N 0.00 0.00 0.00 2.06 3.86 -1.96 -3.50 115.15 115.61 1sxv h HIS 86 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1sxv h HIS 86 Cb 0.09 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.56 1sxv h HIS 86 CO 0.00 0.47 0.00 0.41 0.86 0.00 0.00 177.93 179.67 1sxv n GLY 87 N -0.14 0.13 3.76 2.45 0.00 -0.52 -5.02 105.19 105.85 1sxv n GLY 87 Ca -0.02 -1.79 -0.41 0.00 0.00 0.00 0.00 46.02 43.81 1sxv n GLY 87 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sxv s GLY 88 N 0.00 2.83 -0.40 -0.02 0.00 -1.26 -1.33 107.32 107.14 1sxv s GLY 88 Ca 0.00 1.13 0.10 0.00 0.00 0.00 0.00 44.72 45.96 1sxv s GLY 88 CO 0.00 1.88 1.00 1.34 0.00 0.00 0.00 173.10 177.32 1sxv n ASP 89 N 1.48 -0.64 -4.81 1.64 2.03 -0.10 -4.50 116.55 111.65 1sxv n ASP 89 Ca 0.02 -3.13 -0.33 0.00 0.52 0.00 0.00 54.79 51.86 1sxv n ASP 89 Cb 0.43 0.56 -0.06 0.00 -0.72 0.00 0.00 41.12 41.34 1sxv n ASP 89 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1sxv s ASP 90 N -1.93 6.70 -0.18 1.67 1.01 -1.26 -4.28 116.67 118.41 1sxv s ASP 90 Ca 0.29 1.77 0.00 0.00 0.71 0.00 0.00 52.55 55.32 1sxv s ASP 90 Cb 0.35 -2.55 0.04 0.00 1.01 0.00 0.00 42.92 41.78 1sxv s ASP 90 CO -0.05 -0.53 -0.09 -0.54 0.21 0.00 0.00 175.17 174.17 1sxv s LYS 91 N -3.24 1.80 -0.04 8.23 -0.14 -0.13 -3.83 119.74 122.39 1sxv s LYS 91 Ca 0.64 -0.67 -0.30 0.00 -1.36 0.00 0.00 55.97 54.28 1sxv s LYS 91 Cb -0.12 -2.20 -0.03 0.00 -1.68 0.00 0.00 37.83 33.80 1sxv s LYS 91 CO 0.16 -0.41 1.14 0.08 -0.76 0.00 0.00 175.35 175.57 1sxv s VAL 92 N 1.51 4.38 -0.14 3.17 1.01 -0.19 -0.63 120.40 129.51 1sxv s VAL 92 Ca 0.00 1.70 -0.19 0.00 0.00 0.00 0.00 61.98 63.49 1sxv s VAL 92 Cb -0.15 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 1sxv s VAL 92 CO -0.08 0.03 0.54 -0.22 0.00 0.00 0.00 175.10 175.36 1sxv s LEU 93 N 1.92 4.23 0.14 3.92 2.96 -0.01 -0.46 118.68 131.38 1sxv s LEU 93 Ca 0.54 0.83 0.02 0.00 -0.22 0.00 0.00 54.13 55.31 1sxv s LEU 93 Cb -0.24 -2.78 -0.04 0.00 0.50 0.00 0.00 46.19 43.63 1sxv s LEU 93 CO 0.23 -0.09 -0.04 0.00 -1.32 0.00 0.00 176.35 175.12 1sxv s VAL 95 N -3.58 1.44 0.26 0.00 -7.23 -0.58 -1.15 120.40 109.56 1sxv s VAL 95 Ca 0.18 -2.13 -0.31 0.00 -1.81 0.00 0.00 61.98 57.92 1sxv s VAL 95 Cb 0.05 -2.04 -0.11 0.00 0.56 0.00 0.00 36.38 34.84 1sxv s VAL 95 CO 0.00 -0.60 1.63 -2.84 -0.31 0.00 0.00 175.10 172.98 1sxv s PRO 96 N -3.71 4.13 0.32 4.82 0.02 -1.26 -0.96 135.00 138.36 1sxv s PRO 96 Ca 0.21 2.57 -0.26 0.00 0.02 0.00 0.00 61.00 63.54 1sxv s PRO 96 Cb 0.02 -3.05 -0.10 0.00 0.02 0.00 0.00 34.50 31.39 1sxv s PRO 96 CO 0.05 -0.66 0.96 0.00 -0.33 0.00 0.00 177.00 177.02 1sxv s ALA 97 N 0.44 3.22 -0.11 -1.55 0.00 -0.24 -3.77 121.76 119.75 1sxv s ALA 97 Ca 0.67 0.57 0.00 0.00 0.00 0.00 0.00 51.96 53.20 1sxv s ALA 97 Cb -0.48 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1sxv s ALA 97 CO 0.42 0.12 0.00 0.41 0.00 0.00 0.00 175.76 176.71 1sxv n GLY 98 N 0.67 0.46 3.20 0.00 0.00 -1.26 -4.86 105.19 103.40 1sxv n GLY 98 Ca 0.02 -0.18 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 1sxv n GLY 98 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sxv s ASP 99 N -2.20 5.14 0.35 1.61 -1.08 -1.25 -4.97 116.67 114.27 1sxv s ASP 99 Ca 0.00 -1.37 0.26 0.00 -0.52 0.00 0.00 52.55 50.91 1sxv s ASP 99 Cb 0.00 -1.80 1.22 0.00 -1.46 0.00 0.00 42.92 40.88 1sxv s ASP 99 CO 0.00 -0.35 1.78 1.55 0.52 0.00 0.00 175.17 178.67 1sxv h PRO 100 N 8.11 0.00 0.00 4.34 0.13 -1.94 -1.92 132.00 140.71 1sxv h PRO 100 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 1sxv h PRO 100 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1sxv h PRO 100 CO 0.60 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.37 1sxv h ARG 101 N 0.00 0.00 -0.36 0.86 3.08 -1.96 -2.27 114.38 113.72 1sxv h ARG 101 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1sxv h ARG 101 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 1sxv h ARG 101 CO 0.00 0.00 0.00 0.91 -1.07 0.00 0.00 179.97 179.81 1sxv n TRP 102 N -2.75 0.47 0.30 3.04 7.02 -0.72 -4.66 117.44 120.13 1sxv n TRP 102 Ca -0.01 -0.30 0.18 0.00 -1.02 0.00 0.00 57.50 56.36 1sxv n TRP 102 Cb 0.16 -0.01 0.91 0.00 -2.42 0.00 0.00 31.31 29.95 1sxv n TRP 102 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1sxv h ASP 103 N 3.57 0.00 0.89 -0.99 3.32 -1.53 -0.63 116.42 121.05 1sxv h ASP 103 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1sxv h ASP 103 Cb 0.85 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.40 1sxv h ASP 103 CO 0.00 0.03 0.00 1.41 -1.72 0.00 0.00 179.24 178.96 1sxv n HIS 104 N -3.24 0.39 -3.43 4.55 8.25 -1.26 -4.50 115.22 115.97 1sxv n HIS 104 Ca -0.01 0.13 -0.44 0.00 -0.26 0.00 0.00 57.72 57.14 1sxv n HIS 104 Cb 0.19 -0.71 -0.07 0.00 1.12 0.00 0.00 29.99 30.52 1sxv n HIS 104 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1sxv s VAL 105 N -3.10 4.83 -0.04 1.59 1.01 -0.24 -4.86 120.40 119.59 1sxv s VAL 105 Ca 0.09 -1.47 0.02 0.00 0.00 0.00 0.00 61.98 60.62 1sxv s VAL 105 Cb 0.13 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1sxv s VAL 105 CO 0.44 -0.73 -0.00 0.00 0.00 0.00 0.00 175.10 174.80 1sxv n GLN 106 N 5.11 2.38 -4.11 2.72 1.13 -1.26 -4.97 117.38 118.38 1sxv n GLN 106 Ca -0.12 0.01 -0.14 0.00 -1.94 0.00 0.00 57.00 54.81 1sxv n GLN 106 Cb 0.41 -1.09 -0.05 0.00 0.11 0.00 0.00 30.24 29.62 1sxv n GLN 106 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1sxv s ASP 107 N -3.74 0.73 0.44 1.08 -1.08 -1.26 -4.57 116.67 108.27 1sxv s ASP 107 Ca -0.03 -1.41 0.16 0.00 -0.52 0.00 0.00 52.55 50.75 1sxv s ASP 107 Cb 0.01 0.61 1.00 0.00 -1.46 0.00 0.00 42.92 43.08 1sxv s ASP 107 CO 0.13 -1.19 1.97 -0.29 0.52 0.00 0.00 175.17 176.30 1sxv h ILE 108 N 2.20 1.09 0.00 4.11 6.09 -1.47 -0.11 117.51 129.42 1sxv h ILE 108 Ca -0.29 -0.74 0.00 0.00 -1.37 0.00 0.00 64.86 62.46 1sxv h ILE 108 Cb 1.24 1.41 0.00 0.00 0.47 0.00 0.00 36.82 39.94 1sxv h ILE 108 CO 0.40 0.21 0.00 0.61 -3.07 0.00 0.00 178.15 176.30 1sxv n GLY 109 N -0.86 -1.09 0.25 8.18 0.00 -1.26 -2.43 105.19 107.98 1sxv n GLY 109 Ca -0.02 0.09 0.14 0.00 0.00 0.00 0.00 46.02 46.23 1sxv n GLY 109 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sxv n ASP 110 N -2.08 0.87 -4.51 1.61 8.00 -0.05 -4.76 116.55 115.63 1sxv n ASP 110 Ca 0.01 -1.05 -0.35 0.00 0.71 0.00 0.00 54.79 54.11 1sxv n ASP 110 Cb 0.16 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.14 1sxv n ASP 110 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1sxv s VAL 111 N -2.22 4.32 0.53 2.53 1.01 -1.02 -4.85 120.40 120.70 1sxv s VAL 111 Ca 0.35 -0.19 -0.22 0.00 0.00 0.00 0.00 61.98 61.92 1sxv s VAL 111 Cb 0.21 -2.97 -0.05 0.00 0.00 0.00 0.00 36.38 33.56 1sxv s VAL 111 CO 0.41 0.41 1.38 -2.84 0.00 0.00 0.00 175.10 174.46 1sxv s PRO 112 N 0.97 3.24 0.38 2.72 0.02 -1.26 -4.80 135.00 136.27 1sxv s PRO 112 Ca 0.03 2.28 0.10 0.00 0.02 0.00 0.00 61.00 63.42 1sxv s PRO 112 Cb -0.14 -2.33 0.86 0.00 0.02 0.00 0.00 34.50 32.91 1sxv s PRO 112 CO 0.02 -1.13 1.94 0.00 -0.33 0.00 0.00 177.00 177.50 1sxv h ALA 113 N 1.62 1.85 -0.81 -1.55 0.00 -1.95 -1.17 119.26 117.26 1sxv h ALA 113 Ca -0.51 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.42 1sxv h ALA 113 Cb 1.29 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1sxv h ALA 113 CO 0.58 -0.01 0.53 0.27 0.00 0.00 0.00 179.25 180.62 1sxv h PHE 114 N 0.62 0.97 -0.00 0.00 -5.15 -1.99 0.20 116.94 111.59 1sxv h PHE 114 Ca 0.34 0.02 -0.09 0.00 -0.20 0.00 0.00 57.97 58.04 1sxv h PHE 114 Cb 0.50 -0.33 0.01 0.00 0.22 0.00 0.00 35.95 36.35 1sxv h PHE 114 CO -0.00 0.58 -0.36 1.49 -2.00 0.00 0.00 178.31 178.02 1sxv h GLU 115 N 1.02 0.25 -0.84 6.09 4.81 -1.60 -2.26 114.58 122.05 1sxv h GLU 115 Ca 0.31 -0.26 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1sxv h GLU 115 Cb 0.00 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.41 1sxv h GLU 115 CO -0.09 0.98 0.47 -0.07 -0.73 0.00 0.00 179.01 179.57 1sxv h LEU 116 N -0.37 1.04 -0.56 1.64 3.38 -1.11 -1.50 115.31 117.84 1sxv h LEU 116 Ca -0.04 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1sxv h LEU 116 Cb 1.10 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 1sxv h LEU 116 CO 0.07 0.83 -0.03 0.44 0.09 0.00 0.00 178.44 179.84 1sxv h ASP 117 N 1.17 0.99 -0.71 -0.43 3.32 -0.67 -0.79 116.42 119.29 1sxv h ASP 117 Ca 0.30 -0.32 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 1sxv h ASP 117 Cb 0.01 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.26 1sxv h ASP 117 CO -0.05 1.07 0.25 0.00 -1.72 0.00 0.00 179.24 178.79 1sxv h ALA 118 N 0.95 0.93 -0.26 3.45 0.00 -1.12 -0.42 119.26 122.79 1sxv h ALA 118 Ca 0.15 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1sxv h ALA 118 Cb 0.58 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1sxv h ALA 118 CO 0.03 0.59 0.11 0.82 0.00 0.00 0.00 179.25 180.80 1sxv h ILE 119 N 1.04 1.17 -0.55 0.00 2.04 -1.06 -1.89 117.51 118.25 1sxv h ILE 119 Ca 0.23 -0.51 0.05 0.00 1.00 0.00 0.00 64.86 65.63 1sxv h ILE 119 Cb 0.27 1.03 -0.05 0.00 -0.74 0.00 0.00 36.82 37.33 1sxv h ILE 119 CO -0.01 0.17 0.28 0.50 0.00 0.00 0.00 178.15 179.09 1sxv h LYS 120 N 0.27 0.52 -0.85 2.37 3.64 -0.97 -2.44 116.57 119.11 1sxv h LYS 120 Ca 0.09 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.50 1sxv h LYS 120 Cb 0.17 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 31.82 1sxv h LYS 120 CO -0.01 0.34 0.52 1.25 -2.27 0.00 0.00 179.45 179.29 1sxv h HIS 121 N 0.53 0.97 0.16 1.91 2.76 -0.77 -0.52 115.15 120.20 1sxv h HIS 121 Ca 0.25 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.46 1sxv h HIS 121 Cb 0.17 -0.31 -0.02 0.00 1.55 0.00 0.00 27.41 28.79 1sxv h HIS 121 CO -0.10 0.50 -0.22 0.35 -1.30 0.00 0.00 177.93 177.15 1sxv h PHE 122 N 0.96 -0.58 0.00 5.26 3.57 -0.88 -1.68 116.94 123.59 1sxv h PHE 122 Ca 0.37 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.79 1sxv h PHE 122 Cb 0.16 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 1sxv h PHE 122 CO -0.03 -0.32 -0.42 0.74 -2.23 0.00 0.00 178.31 176.05 1sxv h PHE 123 N -0.44 0.00 -0.07 0.41 0.04 -1.08 0.25 116.94 116.06 1sxv h PHE 123 Ca 0.01 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.65 1sxv h PHE 123 Cb 0.43 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.57 1sxv h PHE 123 CO -0.18 0.42 -0.56 0.28 -0.60 0.00 0.00 178.31 177.66 1sxv h VAL 124 N 0.00 1.38 0.00 -0.55 2.07 -0.96 -3.38 116.25 114.80 1sxv h VAL 124 Ca -0.00 -1.90 0.00 0.00 0.82 0.00 0.00 66.70 65.62 1sxv h VAL 124 Cb 0.80 1.95 0.00 0.00 -1.52 0.00 0.00 31.29 32.52 1sxv h VAL 124 CO 0.05 0.56 -1.27 1.41 0.02 0.00 0.00 177.57 178.34 1sxv n HIS 125 N -3.90 0.00 0.29 1.57 8.25 -0.65 -4.73 115.22 116.05 1sxv n HIS 125 Ca -0.02 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.60 1sxv n HIS 125 Cb 0.59 -0.18 0.84 0.00 1.12 0.00 0.00 29.99 32.36 1sxv n HIS 125 CO 0.00 0.00 0.00 0.10 0.64 0.00 0.00 176.34 177.08 1sxv h TYR 126 N 0.00 0.00 -0.57 4.41 -0.00 -1.14 -0.61 116.97 119.06 1sxv h TYR 126 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1sxv h TYR 126 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.11 1sxv h TYR 126 CO 0.00 0.06 0.00 1.63 -0.00 0.00 0.00 178.16 179.85 1sxv n LYS 127 N -3.40 4.10 0.10 0.10 5.02 -1.26 -4.20 118.16 118.61 1sxv n LYS 127 Ca -0.02 -2.97 0.09 0.00 -2.02 0.00 0.00 58.31 53.39 1sxv n LYS 127 Cb 0.21 -2.02 0.56 0.00 -0.02 0.00 0.00 35.03 33.76 1sxv n LYS 127 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1sxv h ASP 128 N 3.76 0.20 -0.50 4.39 3.32 -1.40 -1.58 116.42 124.60 1sxv h ASP 128 Ca 0.00 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 1sxv h ASP 128 Cb 1.64 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 41.12 1sxv h ASP 128 CO 0.33 0.14 0.05 0.18 -1.72 0.00 0.00 179.24 178.21 1sxv n LEU 129 N -4.49 5.20 -4.61 1.55 4.77 -1.26 -4.89 117.00 113.27 1sxv n LEU 129 Ca 0.02 -3.05 -0.33 0.00 -0.03 0.00 0.00 56.01 52.62 1sxv n LEU 129 Cb 0.18 -0.65 -0.10 0.00 -2.33 0.00 0.00 43.42 40.51 1sxv n LEU 129 CO 0.35 0.70 -0.37 -1.61 -1.33 0.00 0.00 177.39 175.13 1sxv s GLU 130 N -2.85 2.72 0.35 3.23 2.02 -0.60 -4.95 118.70 118.62 1sxv s GLU 130 Ca 0.51 -0.59 -0.25 0.00 0.02 0.00 0.00 54.97 54.65 1sxv s GLU 130 Cb 0.40 -2.60 -0.10 0.00 0.10 0.00 0.00 34.13 31.93 1sxv s GLU 130 CO 0.13 0.64 0.95 -1.25 0.02 0.00 0.00 175.26 175.76 1sxv s PRO 131 N -1.10 4.49 -0.20 0.39 0.04 -1.26 -4.06 135.00 133.29 1sxv s PRO 131 Ca 0.15 1.31 0.00 0.00 0.04 0.00 0.00 61.00 62.49 1sxv s PRO 131 Cb -0.11 -2.67 0.00 0.00 0.04 0.00 0.00 34.50 31.76 1sxv s PRO 131 CO 0.05 0.19 0.00 0.41 0.04 0.00 0.00 177.00 177.68 1sxv n GLY 132 N 0.32 0.40 3.70 0.56 0.00 -1.26 -5.04 105.19 103.87 1sxv n GLY 132 Ca 0.03 -0.88 -0.31 0.00 0.00 0.00 0.00 46.02 44.86 1sxv n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sxv s LYS 133 N -3.24 2.67 0.16 1.61 3.01 -1.26 -4.89 119.74 117.79 1sxv s LYS 133 Ca 0.00 -0.76 -0.21 0.00 -1.01 0.00 0.00 55.97 53.99 1sxv s LYS 133 Cb 0.00 -2.61 0.06 0.00 -1.01 0.00 0.00 37.83 34.27 1sxv s LYS 133 CO 0.00 0.56 0.56 -0.59 0.51 0.00 0.00 175.35 176.39 1sxv s PHE 134 N -1.28 -0.45 -0.20 3.18 -0.12 -1.26 -4.98 117.98 112.88 1sxv s PHE 134 Ca 0.25 0.21 -0.00 0.00 -0.05 0.00 0.00 56.93 57.33 1sxv s PHE 134 Cb -0.12 0.50 0.05 0.00 -0.63 0.00 0.00 43.02 42.82 1sxv s PHE 134 CO 0.17 -0.83 -0.04 0.54 -0.05 0.00 0.00 175.22 175.01 1sxv s VAL 135 N -3.77 1.18 -0.14 -2.49 0.11 -1.26 -2.40 120.40 111.63 1sxv s VAL 135 Ca 0.02 -0.85 0.22 0.00 -2.93 0.00 0.00 61.98 58.43 1sxv s VAL 135 Cb -0.01 -1.45 -0.16 0.00 -1.53 0.00 0.00 36.38 33.24 1sxv s VAL 135 CO -0.12 -0.02 0.76 1.17 -3.33 0.00 0.00 175.10 173.57 1sxv n LYS 136 N 4.82 0.63 -3.64 1.54 4.81 0.48 -4.94 118.16 121.87 1sxv n LYS 136 Ca -0.12 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.22 1sxv n LYS 136 Cb 0.46 -1.69 -0.07 0.00 0.02 0.00 0.00 35.03 33.75 1sxv n LYS 136 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1sxv s ALA 137 N -3.35 -1.77 -0.24 3.14 0.00 -1.15 -4.94 121.76 113.45 1sxv s ALA 137 Ca -0.04 2.17 -0.03 0.00 0.00 0.00 0.00 51.96 54.06 1sxv s ALA 137 Cb 0.11 -1.27 0.13 0.00 0.00 0.00 0.00 23.12 22.09 1sxv s ALA 137 CO 0.84 -0.35 0.38 0.00 0.00 0.00 0.00 175.76 176.63 1sxv s ALA 138 N 0.99 -1.10 -0.04 0.00 0.00 -1.25 -0.98 121.76 119.38 1sxv s ALA 138 Ca -0.05 0.97 -0.18 0.00 0.00 0.00 0.00 51.96 52.71 1sxv s ALA 138 Cb -0.05 -1.64 0.03 0.00 0.00 0.00 0.00 23.12 21.46 1sxv s ALA 138 CO -0.09 -1.21 0.39 0.16 0.00 0.00 0.00 175.76 175.01 1sxv s ASP 139 N 2.55 -0.31 0.02 0.00 -4.77 -0.55 -4.99 116.67 108.63 1sxv s ASP 139 Ca 0.12 0.31 -0.23 0.00 -3.30 0.00 0.00 52.55 49.44 1sxv s ASP 139 Cb -0.15 0.43 -0.05 0.00 -1.09 0.00 0.00 42.92 42.06 1sxv s ASP 139 CO -0.15 -0.44 0.71 0.26 0.70 0.00 0.00 175.17 176.25 1sxv s TRP 140 N -1.09 3.71 0.32 2.11 0.52 -1.26 -0.12 118.94 123.13 1sxv s TRP 140 Ca -0.11 1.37 0.05 0.00 0.02 0.00 0.00 56.10 57.42 1sxv s TRP 140 Cb -0.04 -2.75 -0.06 0.00 -1.15 0.00 0.00 33.47 29.46 1sxv s TRP 140 CO 0.05 0.28 0.02 0.14 0.02 0.00 0.00 176.95 177.46 1sxv s VAL 141 N -0.02 1.40 0.80 4.03 -7.23 0.18 -4.95 120.40 114.60 1sxv s VAL 141 Ca 0.36 -2.03 -0.08 0.00 -1.81 0.00 0.00 61.98 58.42 1sxv s VAL 141 Cb -0.20 -2.72 0.13 0.00 0.56 0.00 0.00 36.38 34.15 1sxv s VAL 141 CO 0.21 -0.09 1.11 1.51 -0.31 0.00 0.00 175.10 177.53 1sxv s ASP 142 N -3.50 4.11 0.29 4.85 1.47 -1.26 -1.38 116.67 121.25 1sxv s ASP 142 Ca 0.34 0.16 0.00 0.00 1.18 0.00 0.00 52.55 54.23 1sxv s ASP 142 Cb 0.08 -0.53 0.51 0.00 -0.34 0.00 0.00 42.92 42.64 1sxv s ASP 142 CO 0.15 -2.05 1.88 -0.09 0.68 0.00 0.00 175.17 175.74 1sxv h ARG 143 N -0.93 1.03 -0.74 2.11 2.43 -1.88 -1.90 114.38 114.51 1sxv h ARG 143 Ca -0.42 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 58.66 1sxv h ARG 143 Cb 1.27 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 30.56 1sxv h ARG 143 CO 0.47 0.68 0.37 0.00 -1.51 0.00 0.00 179.97 179.98 1sxv h ALA 144 N 1.50 0.95 -0.53 2.80 0.00 -1.93 0.16 119.26 122.21 1sxv h ALA 144 Ca 0.43 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.15 1sxv h ALA 144 Cb 0.28 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1sxv h ALA 144 CO -0.18 0.49 0.10 0.93 0.00 0.00 0.00 179.25 180.59 1sxv h GLU 145 N 1.02 0.86 -0.16 0.00 4.39 -1.84 -1.81 114.58 117.06 1sxv h GLU 145 Ca 0.25 -0.22 0.02 0.00 0.34 0.00 0.00 59.36 59.75 1sxv h GLU 145 Cb 0.09 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 1sxv h GLU 145 CO -0.04 0.84 0.04 0.00 -1.16 0.00 0.00 179.01 178.70 1sxv h ALA 146 N 0.99 0.16 -0.78 3.43 0.00 -0.81 -1.99 119.26 120.27 1sxv h ALA 146 Ca 0.16 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1sxv h ALA 146 Cb 0.38 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1sxv h ALA 146 CO 0.01 -0.40 0.46 0.93 0.00 0.00 0.00 179.25 180.25 1sxv h GLU 147 N 0.11 1.05 -0.64 0.00 5.08 -0.56 -0.62 114.58 119.00 1sxv h GLU 147 Ca 0.07 -0.09 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 1sxv h GLU 147 Cb 0.05 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.05 1sxv h GLU 147 CO -0.08 0.74 0.13 0.00 -1.00 0.00 0.00 179.01 178.81 1sxv h ALA 148 N 1.44 1.02 -0.41 3.43 0.00 -1.06 0.23 119.26 123.92 1sxv h ALA 148 Ca 0.28 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1sxv h ALA 148 Cb -0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1sxv h ALA 148 CO -0.05 0.63 -0.15 1.49 0.00 0.00 0.00 179.25 181.17 1sxv h GLU 149 N 0.97 0.82 -0.34 0.00 4.81 -0.75 -1.12 114.58 118.97 1sxv h GLU 149 Ca 0.20 -0.34 0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1sxv h GLU 149 Cb 0.38 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 1sxv h GLU 149 CO 0.00 0.97 0.21 0.28 -0.73 0.00 0.00 179.01 179.74 1sxv h VAL 150 N 0.64 1.05 -0.28 0.32 2.07 -0.94 -1.77 116.25 117.35 1sxv h VAL 150 Ca 0.10 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.49 1sxv h VAL 150 Cb 0.69 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1sxv h VAL 150 CO 0.05 0.08 0.13 -0.61 0.02 0.00 0.00 177.57 177.24 1sxv h GLN 151 N 0.43 0.26 0.00 1.57 5.75 -0.67 0.91 115.11 123.37 1sxv h GLN 151 Ca 0.13 -0.02 -0.05 0.00 -0.15 0.00 0.00 58.65 58.56 1sxv h GLN 151 Cb -0.02 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.47 1sxv h GLN 151 CO -0.05 0.17 -0.26 0.07 -2.65 0.00 0.00 178.83 176.12 1sxv h ARG 152 N 0.27 0.00 0.05 1.69 0.11 -1.11 -1.70 114.38 113.70 1sxv h ARG 152 Ca 0.12 0.00 -0.23 0.00 0.10 0.00 0.00 59.98 59.96 1sxv h ARG 152 Cb 0.05 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.12 1sxv h ARG 152 CO -0.09 0.26 -1.08 0.77 0.10 0.00 0.00 179.97 179.92 1sxv h SER 153 N 0.00 0.19 -0.52 0.08 0.02 -0.49 -1.03 113.55 111.80 1sxv h SER 153 Ca -0.00 -0.20 -0.06 0.00 -0.84 0.00 0.00 61.79 60.68 1sxv h SER 153 Cb 0.52 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 1sxv h SER 153 CO 0.03 1.14 0.08 0.58 -1.14 0.00 0.00 176.83 177.53 1sxv h VAL 154 N 0.04 1.25 -0.35 2.27 2.07 -0.61 -0.53 116.25 120.39 1sxv h VAL 154 Ca -0.06 -0.95 -0.03 0.00 0.82 0.00 0.00 66.70 66.48 1sxv h VAL 154 Cb 1.82 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 32.44 1sxv h VAL 154 CO 0.16 0.34 0.09 -0.33 0.02 0.00 0.00 177.57 177.86 1sxv h GLU 155 N 0.75 0.56 -0.71 1.57 5.08 -1.17 -2.34 114.58 118.32 1sxv h GLU 155 Ca 0.16 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1sxv h GLU 155 Cb 0.41 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1sxv h GLU 155 CO 0.01 0.60 0.32 0.00 -1.00 0.00 0.00 179.01 178.94 1sxv h ARG 156 N 0.42 1.02 -0.91 2.33 3.08 -1.17 -0.89 114.38 118.27 1sxv h ARG 156 Ca 0.11 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 1sxv h ARG 156 Cb 0.28 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 1sxv h ARG 156 CO -0.00 0.80 0.57 0.35 -1.07 0.00 0.00 179.97 180.62 1sxv h PHE 157 N 1.01 1.17 0.00 3.04 3.57 -1.11 -2.64 116.94 121.99 1sxv h PHE 157 Ca 0.24 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.67 1sxv h PHE 157 Cb 0.14 -0.39 -0.01 0.00 2.79 0.00 0.00 35.95 38.47 1sxv h PHE 157 CO 0.01 0.77 -0.40 0.87 -2.23 0.00 0.00 178.31 177.33 1sxv h LYS 158 N 1.24 0.00 0.00 1.11 1.57 -0.87 -3.49 116.57 116.13 1sxv h LYS 158 Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1sxv h LYS 158 Cb -0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1sxv h LYS 158 CO -0.06 0.40 0.00 0.00 -0.57 0.00 0.00 179.45 179.22