#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jxv n GLU 5 N 0.00 0.73 -4.12 0.00 2.13 -1.25 -4.71 120.64 113.42 1jxv n GLU 5 Ca 0.00 0.29 -0.14 0.00 0.66 0.00 0.00 57.16 57.97 1jxv n GLU 5 Cb 0.00 -2.05 -0.13 0.00 0.27 0.00 0.00 31.44 29.53 1jxv n GLU 5 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1jxv s ARG 6 N -2.67 0.50 0.16 5.31 0.52 -1.26 -0.33 118.95 121.18 1jxv s ARG 6 Ca 0.74 -0.52 0.06 0.00 -0.52 0.00 0.00 55.73 55.49 1jxv s ARG 6 Cb -0.41 -0.37 -0.04 0.00 0.52 0.00 0.00 34.95 34.65 1jxv s ARG 6 CO 0.49 0.08 -0.12 -0.08 0.02 0.00 0.00 175.30 175.69 1jxv s THR 7 N -0.83 1.36 -0.23 0.02 -1.32 -0.06 -4.76 115.64 109.82 1jxv s THR 7 Ca -0.04 -2.06 -0.09 0.00 -1.21 0.00 0.00 61.69 58.29 1jxv s THR 7 Cb -0.07 -1.86 -0.04 0.00 -1.51 0.00 0.00 72.50 69.02 1jxv s THR 7 CO 0.00 -0.66 0.11 0.12 -2.21 0.00 0.00 174.62 171.98 1jxv s PHE 8 N -3.06 3.21 -0.10 9.09 5.36 -1.26 -1.69 117.98 129.53 1jxv s PHE 8 Ca 0.17 -0.02 0.02 0.00 -0.96 0.00 0.00 56.93 56.15 1jxv s PHE 8 Cb 0.01 -2.22 0.01 0.00 -0.34 0.00 0.00 43.02 40.48 1jxv s PHE 8 CO 0.03 -0.06 -0.17 0.42 -1.46 0.00 0.00 175.22 173.98 1jxv s ILE 9 N 1.11 1.58 -0.13 3.12 1.01 -0.42 -1.60 121.20 125.88 1jxv s ILE 9 Ca 0.06 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 60.02 1jxv s ILE 9 Cb -0.14 -1.43 -0.00 0.00 0.01 0.00 0.00 42.46 40.90 1jxv s ILE 9 CO 0.04 0.46 -0.19 0.00 0.00 0.00 0.00 174.94 175.25 1jxv s ALA 10 N 0.83 2.38 -0.28 9.38 0.00 -0.03 0.12 121.76 134.16 1jxv s ALA 10 Ca -0.10 -1.00 -0.23 0.00 0.00 0.00 0.00 51.96 50.63 1jxv s ALA 10 Cb -0.16 -1.06 -0.00 0.00 0.00 0.00 0.00 23.12 21.90 1jxv s ALA 10 CO 0.01 0.11 0.76 0.42 0.00 0.00 0.00 175.76 177.06 1jxv s ILE 11 N 0.59 4.84 0.89 0.00 1.01 0.26 0.33 121.20 129.12 1jxv s ILE 11 Ca -0.11 1.25 -0.12 0.00 0.00 0.00 0.00 60.65 61.68 1jxv s ILE 11 Cb -0.16 -4.10 0.12 0.00 0.01 0.00 0.00 42.46 38.33 1jxv s ILE 11 CO 0.03 -0.16 1.13 -0.54 0.00 0.00 0.00 174.94 175.40 1jxv s LYS 12 N 2.84 1.33 0.33 2.79 1.02 -0.36 -1.70 119.74 126.00 1jxv s LYS 12 Ca 0.32 0.36 0.10 0.00 0.02 0.00 0.00 55.97 56.76 1jxv s LYS 12 Cb -0.15 -1.86 0.87 0.00 -0.52 0.00 0.00 37.83 36.18 1jxv s LYS 12 CO 0.11 -2.08 1.75 -1.35 -0.92 0.00 0.00 175.35 172.86 1jxv h PRO 13 N -1.41 0.59 0.00 -1.68 0.11 -1.85 -0.67 132.00 127.09 1jxv h PRO 13 Ca -0.50 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.49 1jxv h PRO 13 Cb 1.32 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1jxv h PRO 13 CO 0.61 0.39 -0.41 0.38 -0.21 0.00 0.00 178.00 178.77 1jxv h ASP 14 N 0.61 0.00 -0.01 -2.05 2.03 -1.89 -0.33 116.42 114.78 1jxv h ASP 14 Ca 0.61 0.00 -0.19 0.00 -0.73 0.00 0.00 57.03 56.72 1jxv h ASP 14 Cb 1.16 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.66 1jxv h ASP 14 CO -0.42 0.41 -0.68 1.23 -1.03 0.00 0.00 179.24 178.75 1jxv h GLY 15 N 1.85 0.71 0.49 7.15 0.00 -1.28 -1.63 103.07 110.36 1jxv h GLY 15 Ca -0.00 -0.93 -0.00 0.00 0.00 0.00 0.00 47.33 46.39 1jxv h GLY 15 CO 0.05 0.83 -0.03 -2.08 0.00 0.00 0.00 176.54 175.31 1jxv h VAL 16 N 0.46 1.22 -0.99 4.60 2.07 -1.17 -1.65 116.25 120.80 1jxv h VAL 16 Ca -0.02 -1.11 0.23 0.00 0.82 0.00 0.00 66.70 66.62 1jxv h VAL 16 Cb 1.28 1.93 -0.09 0.00 -1.52 0.00 0.00 31.29 32.89 1jxv h VAL 16 CO 0.13 0.27 0.63 1.56 0.02 0.00 0.00 177.57 180.19 1jxv h GLN 17 N -0.60 0.47 -0.43 1.57 1.08 -1.08 -0.89 115.11 115.22 1jxv h GLN 17 Ca -0.01 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1jxv h GLN 17 Cb 0.51 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.83 1jxv h GLN 17 CO 0.01 0.31 0.00 0.54 -0.95 0.00 0.00 178.83 178.74 1jxv n ARG 18 N -4.62 2.15 -3.02 1.46 1.74 -0.62 -4.95 116.66 108.81 1jxv n ARG 18 Ca 0.23 -1.77 -0.13 0.00 -0.77 0.00 0.00 57.85 55.41 1jxv n ARG 18 Cb 0.75 -1.41 0.05 0.00 -1.02 0.00 0.00 32.46 30.83 1jxv n ARG 18 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jxv n GLY 19 N 1.31 -0.02 0.49 -0.13 0.00 -0.34 -4.94 105.19 101.56 1jxv n GLY 19 Ca 0.17 -0.11 0.04 0.00 0.00 0.00 0.00 46.02 46.13 1jxv n GLY 19 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jxv n LEU 20 N -3.12 2.74 0.01 0.99 4.77 -0.64 -4.68 117.00 117.08 1jxv n LEU 20 Ca -0.10 -2.08 -0.13 0.00 -0.03 0.00 0.00 56.01 53.68 1jxv n LEU 20 Cb 0.58 -0.20 -0.09 0.00 -2.33 0.00 0.00 43.42 41.38 1jxv n LEU 20 CO 0.39 0.67 0.73 0.58 -1.33 0.00 0.00 177.39 178.44 1jxv h VAL 21 N 1.48 1.23 -0.42 4.08 2.07 -1.89 -1.31 116.25 121.49 1jxv h VAL 21 Ca 0.00 -0.67 -0.13 0.00 0.82 0.00 0.00 66.70 66.72 1jxv h VAL 21 Cb 0.72 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 1jxv h VAL 21 CO 0.01 0.18 -0.26 1.23 0.02 0.00 0.00 177.57 178.74 1jxv h GLY 22 N -0.28 0.96 0.24 2.17 0.00 -1.97 -1.86 103.07 102.34 1jxv h GLY 22 Ca 0.00 -0.87 0.08 0.00 0.00 0.00 0.00 47.33 46.54 1jxv h GLY 22 CO 0.00 0.79 -0.07 -2.09 0.00 0.00 0.00 176.54 175.18 1jxv h GLU 23 N 0.76 0.03 -0.30 4.80 4.57 -1.84 -0.81 114.58 121.79 1jxv h GLU 23 Ca 0.09 -0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.21 1jxv h GLU 23 Cb 0.82 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.39 1jxv h GLU 23 CO 0.07 0.02 -0.06 0.82 -1.18 0.00 0.00 179.01 178.69 1jxv h ILE 24 N 0.03 1.28 -0.46 2.32 2.04 -0.93 -2.87 117.51 118.91 1jxv h ILE 24 Ca 0.20 -1.07 -0.04 0.00 1.00 0.00 0.00 64.86 64.94 1jxv h ILE 24 Cb 0.30 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 1jxv h ILE 24 CO -0.39 0.34 0.11 0.40 0.00 0.00 0.00 178.15 178.61 1jxv h ILE 25 N 0.33 1.20 -0.52 -0.67 2.04 -1.26 -2.34 117.51 116.30 1jxv h ILE 25 Ca 0.08 -0.73 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 1jxv h ILE 25 Cb 0.53 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 1jxv h ILE 25 CO 0.03 0.27 0.19 0.50 0.00 0.00 0.00 178.15 179.13 1jxv h LYS 26 N 0.68 0.75 -0.57 2.37 3.64 -1.00 -1.14 116.57 121.29 1jxv h LYS 26 Ca 0.15 -0.12 -0.05 0.00 -1.27 0.00 0.00 60.65 59.36 1jxv h LYS 26 Cb 0.26 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 1jxv h LYS 26 CO -0.00 0.64 0.15 0.00 -2.27 0.00 0.00 179.45 177.96 1jxv h ARG 27 N 0.74 0.88 0.07 1.90 2.47 -1.21 -0.04 114.38 119.20 1jxv h ARG 27 Ca 0.18 -0.18 -0.26 0.00 -1.26 0.00 0.00 59.98 58.46 1jxv h ARG 27 Cb 0.18 -0.13 0.01 0.00 -1.65 0.00 0.00 29.97 28.38 1jxv h ARG 27 CO -0.01 0.78 -1.11 0.74 0.56 0.00 0.00 179.97 180.93 1jxv h PHE 28 N 0.85 0.65 -0.05 3.04 0.04 -1.36 -2.84 116.94 117.27 1jxv h PHE 28 Ca 0.19 -0.40 -0.01 0.00 2.80 0.00 0.00 57.97 60.55 1jxv h PHE 28 Cb 0.29 -0.05 -0.00 0.00 2.20 0.00 0.00 35.95 38.39 1jxv h PHE 28 CO 0.02 1.26 0.00 0.93 -0.60 0.00 0.00 178.31 179.92 1jxv h GLU 29 N 0.18 0.08 0.00 1.51 5.08 -1.00 -2.55 114.58 117.88 1jxv h GLU 29 Ca -0.12 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.19 1jxv h GLU 29 Cb 1.78 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 31.02 1jxv h GLU 29 CO 0.19 0.36 -0.10 -0.56 -1.00 0.00 0.00 179.01 177.90 1jxv h GLN 30 N -0.21 0.00 -0.14 2.33 3.07 -1.10 -1.71 115.11 117.35 1jxv h GLN 30 Ca 0.01 0.00 -0.13 0.00 0.09 0.00 0.00 58.65 58.63 1jxv h GLN 30 Cb 0.32 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.87 1jxv h GLN 30 CO 0.00 0.10 -0.47 -0.22 0.09 0.00 0.00 178.83 178.34 1jxv h LYS 31 N 0.00 0.35 0.00 0.06 1.63 -1.44 -3.47 116.57 113.70 1jxv h LYS 31 Ca -0.00 -0.19 0.00 0.00 -0.85 0.00 0.00 60.65 59.61 1jxv h LYS 31 Cb 0.43 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.07 1jxv h LYS 31 CO 0.01 0.75 0.00 0.41 -3.45 0.00 0.00 179.45 177.17 1jxv n GLY 32 N 0.00 1.08 3.84 5.01 0.00 -0.64 -5.11 105.19 109.36 1jxv n GLY 32 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 1jxv n GLY 32 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jxv s PHE 33 N -2.00 3.35 -0.22 1.61 0.08 -0.97 -5.01 117.98 114.82 1jxv s PHE 33 Ca 0.00 1.43 -0.07 0.00 0.12 0.00 0.00 56.93 58.41 1jxv s PHE 33 Cb 0.00 -2.83 -0.03 0.00 -0.57 0.00 0.00 43.02 39.58 1jxv s PHE 33 CO 0.00 -0.72 0.05 0.50 -0.10 0.00 0.00 175.22 174.95 1jxv s ARG 34 N -4.45 3.74 -0.11 0.44 3.52 -0.67 -4.56 118.95 116.86 1jxv s ARG 34 Ca 0.59 -0.45 -0.29 0.00 -0.13 0.00 0.00 55.73 55.44 1jxv s ARG 34 Cb -0.12 -3.24 -0.03 0.00 -1.56 0.00 0.00 34.95 30.00 1jxv s ARG 34 CO 0.41 -0.01 1.44 -1.17 -0.81 0.00 0.00 175.30 175.15 1jxv s LEU 35 N 1.13 4.25 -0.01 -0.88 2.96 -1.26 -1.06 118.68 123.81 1jxv s LEU 35 Ca 0.04 1.94 0.05 0.00 -0.22 0.00 0.00 54.13 55.94 1jxv s LEU 35 Cb -0.14 -3.54 -0.08 0.00 0.50 0.00 0.00 46.19 42.93 1jxv s LEU 35 CO 0.03 -0.83 0.14 0.55 -1.32 0.00 0.00 176.35 174.92 1jxv n VAL 36 N 5.39 0.00 -3.74 1.68 3.14 -0.06 -4.90 118.33 119.84 1jxv n VAL 36 Ca 0.15 -0.19 -0.12 0.00 -2.96 0.00 0.00 64.34 61.22 1jxv n VAL 36 Cb 0.44 0.54 -0.11 0.00 -1.06 0.00 0.00 33.84 33.64 1jxv n VAL 36 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1jxv s GLY 37 N -2.32 -0.24 -0.17 7.55 0.00 -0.95 -0.55 107.32 110.63 1jxv s GLY 37 Ca -0.01 1.06 -0.13 0.00 0.00 0.00 0.00 44.72 45.64 1jxv s GLY 37 CO 0.22 1.08 0.43 -2.27 0.00 0.00 0.00 173.10 172.56 1jxv s LEU 38 N 0.67 0.14 -0.29 0.66 2.96 -1.26 -0.87 118.68 120.69 1jxv s LEU 38 Ca -0.04 0.90 -0.16 0.00 -0.22 0.00 0.00 54.13 54.61 1jxv s LEU 38 Cb -0.05 1.47 0.15 0.00 0.50 0.00 0.00 46.19 48.25 1jxv s LEU 38 CO -0.04 -0.17 0.99 -0.75 -1.32 0.00 0.00 176.35 175.05 1jxv s LYS 39 N 0.71 0.35 -0.20 1.98 2.20 -0.82 -5.01 119.74 118.95 1jxv s LYS 39 Ca -0.04 0.65 -0.02 0.00 -0.36 0.00 0.00 55.97 56.21 1jxv s LYS 39 Cb -0.05 0.15 0.00 0.00 -1.51 0.00 0.00 37.83 36.42 1jxv s LYS 39 CO -0.05 -0.08 -0.11 0.12 -0.36 0.00 0.00 175.35 174.87 1jxv s PHE 40 N 1.55 2.88 0.17 4.03 5.36 -1.26 -0.26 117.98 130.45 1jxv s PHE 40 Ca -0.08 -1.16 -0.10 0.00 -0.96 0.00 0.00 56.93 54.63 1jxv s PHE 40 Cb -0.04 -2.01 -0.00 0.00 -0.34 0.00 0.00 43.02 40.62 1jxv s PHE 40 CO -0.15 -0.61 0.32 0.00 -1.46 0.00 0.00 175.22 173.32 1jxv s MET 41 N 1.31 1.21 -0.37 10.12 0.23 -0.55 -4.99 119.30 126.26 1jxv s MET 41 Ca 0.04 -1.14 -0.12 0.00 -1.03 0.00 0.00 55.69 53.44 1jxv s MET 41 Cb -0.14 0.40 0.02 0.00 -1.53 0.00 0.00 34.83 33.58 1jxv s MET 41 CO -0.06 -0.45 0.23 -1.14 -2.03 0.00 0.00 175.02 171.57 1jxv s GLN 42 N -3.96 3.01 0.15 3.16 0.74 -1.26 0.07 119.66 121.58 1jxv s GLN 42 Ca 0.16 -0.97 -0.31 0.00 0.05 0.00 0.00 55.36 54.29 1jxv s GLN 42 Cb 0.03 -3.79 -0.10 0.00 1.10 0.00 0.00 33.01 30.24 1jxv s GLN 42 CO 0.00 -0.65 1.58 0.00 -0.55 0.00 0.00 175.29 175.67 1jxv s ALA 43 N 1.62 3.77 0.54 1.58 0.00 -1.26 -5.00 121.76 123.01 1jxv s ALA 43 Ca 0.04 1.35 -0.19 0.00 0.00 0.00 0.00 51.96 53.15 1jxv s ALA 43 Cb -0.19 -3.63 -0.06 0.00 0.00 0.00 0.00 23.12 19.24 1jxv s ALA 43 CO 0.08 -0.82 1.11 -1.54 0.00 0.00 0.00 175.76 174.58 1jxv s SER 44 N 1.32 5.82 0.45 0.00 1.04 -1.26 -4.58 113.70 116.49 1jxv s SER 44 Ca 0.71 2.10 0.14 0.00 0.48 0.00 0.00 55.95 59.38 1jxv s SER 44 Cb -0.43 -2.57 1.06 0.00 0.10 0.00 0.00 66.02 64.18 1jxv s SER 44 CO 0.31 -1.15 2.01 -0.33 0.98 0.00 0.00 173.24 175.07 1jxv h GLU 45 N 1.19 0.34 0.06 4.02 5.08 -1.94 0.29 114.58 123.62 1jxv h GLU 45 Ca -0.50 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1jxv h GLU 45 Cb 1.25 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1jxv h GLU 45 CO 0.57 0.23 -0.03 -0.44 -1.00 0.00 0.00 179.01 178.34 1jxv h ASP 46 N 0.35 -0.07 -0.95 1.42 3.32 -1.99 0.18 116.42 118.69 1jxv h ASP 46 Ca 0.23 -0.22 0.01 0.00 0.02 0.00 0.00 57.03 57.07 1jxv h ASP 46 Cb 0.44 0.02 -0.05 0.00 0.22 0.00 0.00 39.33 39.96 1jxv h ASP 46 CO -0.05 0.19 0.63 0.25 -1.72 0.00 0.00 179.24 178.53 1jxv h LEU 47 N -0.32 1.08 -0.88 1.55 5.85 -1.57 -1.90 115.31 119.13 1jxv h LEU 47 Ca -0.01 -0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.59 1jxv h LEU 47 Cb 0.28 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 1jxv h LEU 47 CO 0.01 0.78 -0.18 -0.07 -0.34 0.00 0.00 178.44 178.64 1jxv h LEU 48 N 1.27 0.63 -0.70 2.25 3.38 -0.24 -1.45 115.31 120.46 1jxv h LEU 48 Ca 0.35 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 58.04 1jxv h LEU 48 Cb -0.13 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1jxv h LEU 48 CO -0.08 0.82 0.03 0.11 0.09 0.00 0.00 178.44 179.40 1jxv h LYS 49 N 0.57 1.03 -0.35 1.13 1.57 0.04 0.41 116.57 120.97 1jxv h LYS 49 Ca 0.09 -0.30 -0.14 0.00 -1.87 0.00 0.00 60.65 58.43 1jxv h LYS 49 Cb 0.62 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 1jxv h LYS 49 CO 0.04 0.99 -0.34 1.49 -0.57 0.00 0.00 179.45 181.06 1jxv h GLU 50 N 0.95 0.79 -0.23 3.15 4.22 -1.15 -2.91 114.58 119.39 1jxv h GLU 50 Ca 0.18 -0.38 -0.02 0.00 0.08 0.00 0.00 59.36 59.22 1jxv h GLU 50 Cb 0.51 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1jxv h GLU 50 CO 0.02 1.01 0.08 1.25 -2.18 0.00 0.00 179.01 179.19 1jxv h HIS 51 N 0.66 0.37 -1.48 0.92 2.76 -0.93 -3.17 115.15 114.28 1jxv h HIS 51 Ca 0.07 -0.04 -0.69 0.00 -2.20 0.00 0.00 60.37 57.51 1jxv h HIS 51 Cb 0.88 -0.11 -0.26 0.00 1.55 0.00 0.00 27.41 29.47 1jxv h HIS 51 CO 0.05 0.43 0.91 0.66 -1.30 0.00 0.00 177.93 178.68 1jxv n TYR 52 N -4.77 2.89 0.11 5.26 4.01 0.11 -4.69 117.16 120.07 1jxv n TYR 52 Ca -0.03 -2.53 -0.02 0.00 -0.16 0.00 0.00 57.90 55.16 1jxv n TYR 52 Cb 0.15 -1.29 0.04 0.00 -0.31 0.00 0.00 39.34 37.93 1jxv n TYR 52 CO 0.00 0.00 0.00 -0.24 -0.46 0.00 0.00 176.86 176.16 1jxv h VAL 53 N 1.59 1.35 0.00 -0.72 3.04 -1.49 -2.79 116.25 117.23 1jxv h VAL 53 Ca 0.56 -2.61 0.00 0.00 -1.01 0.00 0.00 66.70 63.64 1jxv h VAL 53 Cb 0.41 2.47 0.00 0.00 -2.01 0.00 0.00 31.29 32.16 1jxv h VAL 53 CO 1.42 0.70 0.00 0.47 -1.01 0.00 0.00 177.57 179.15 1jxv n ASP 54 N -3.44 0.00 -0.08 3.17 10.43 -1.26 -1.58 116.55 123.79 1jxv n ASP 54 Ca 0.00 0.18 0.07 0.00 2.57 0.00 0.00 54.79 57.61 1jxv n ASP 54 Cb 0.76 -0.35 0.10 0.00 1.84 0.00 0.00 41.12 43.47 1jxv n ASP 54 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1jxv n LEU 55 N -1.35 2.29 -0.04 0.64 4.77 -1.06 -4.77 117.00 117.48 1jxv n LEU 55 Ca 0.07 -2.71 0.11 0.00 -0.03 0.00 0.00 56.01 53.45 1jxv n LEU 55 Cb 0.14 -0.29 0.52 0.00 -2.33 0.00 0.00 43.42 41.46 1jxv n LEU 55 CO 0.13 0.64 1.18 0.50 -1.33 0.00 0.00 177.39 178.51 1jxv h LYS 56 N 0.09 0.35 -0.00 3.23 3.64 -1.26 -2.68 116.57 119.94 1jxv h LYS 56 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1jxv h LYS 56 Cb 0.84 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 1jxv h LYS 56 CO 0.01 0.23 -0.70 -0.25 -2.27 0.00 0.00 179.45 176.47 1jxv n ASP 57 N -4.47 1.05 -4.75 4.20 10.43 -1.26 -4.93 116.55 116.82 1jxv n ASP 57 Ca 0.08 -1.02 -0.32 0.00 2.57 0.00 0.00 54.79 56.09 1jxv n ASP 57 Cb 0.33 0.86 0.08 0.00 1.84 0.00 0.00 41.12 44.24 1jxv n ASP 57 CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 1jxv s ARG 58 N -2.48 2.33 -0.00 -1.24 1.81 -1.01 -4.99 118.95 113.37 1jxv s ARG 58 Ca 0.09 1.36 -0.19 0.00 -1.72 0.00 0.00 55.73 55.27 1jxv s ARG 58 Cb 0.13 -1.89 -0.32 0.00 -0.45 0.00 0.00 34.95 32.42 1jxv s ARG 58 CO 0.64 -1.61 0.98 -1.00 -0.68 0.00 0.00 175.30 173.63 1jxv h PRO 59 N -0.65 0.44 0.00 3.54 0.13 -1.91 -3.24 132.00 130.31 1jxv h PRO 59 Ca -0.45 -0.69 0.00 0.00 -0.87 0.00 0.00 66.00 63.99 1jxv h PRO 59 Cb 1.25 0.25 0.00 0.00 0.13 0.00 0.00 31.00 32.62 1jxv h PRO 59 CO 0.51 1.32 0.00 1.97 -0.23 0.00 0.00 178.00 181.57 1jxv n PHE 60 N -3.96 0.55 -0.29 1.56 1.16 -1.26 -3.54 117.46 111.69 1jxv n PHE 60 Ca -0.14 0.26 0.03 0.00 -1.87 0.00 0.00 57.45 55.72 1jxv n PHE 60 Cb 0.92 -0.91 0.10 0.00 -1.61 0.00 0.00 39.48 37.98 1jxv n PHE 60 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 1jxv h PHE 61 N 0.00 -0.44 -0.41 2.97 3.57 -1.78 -0.47 116.94 120.38 1jxv h PHE 61 Ca 0.00 0.07 0.07 0.00 3.53 0.00 0.00 57.97 61.64 1jxv h PHE 61 Cb 0.15 0.32 -0.06 0.00 2.79 0.00 0.00 35.95 39.15 1jxv h PHE 61 CO 0.00 -0.36 0.06 0.00 -2.23 0.00 0.00 178.31 175.79 1jxv h ALA 62 N 1.82 0.43 -0.61 2.41 0.00 -1.83 -1.26 119.26 120.22 1jxv h ALA 62 Ca 0.40 0.09 -0.10 0.00 0.00 0.00 0.00 54.91 55.30 1jxv h ALA 62 Cb 0.60 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1jxv h ALA 62 CO -0.85 -0.34 -0.00 0.78 0.00 0.00 0.00 179.25 178.84 1jxv h GLY 63 N 0.19 1.17 0.66 0.00 0.00 -1.50 -1.86 103.07 101.73 1jxv h GLY 63 Ca 0.20 -0.86 0.04 0.00 0.00 0.00 0.00 47.33 46.70 1jxv h GLY 63 CO -0.28 0.79 -0.02 -2.00 0.00 0.00 0.00 176.54 175.03 1jxv h LEU 64 N 0.98 -0.12 -0.85 3.11 6.46 -0.44 0.10 115.31 124.55 1jxv h LEU 64 Ca 0.17 0.05 -0.11 0.00 -0.12 0.00 0.00 57.88 57.87 1jxv h LEU 64 Cb 0.57 0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.58 1jxv h LEU 64 CO 0.03 -0.03 -0.32 0.58 -0.62 0.00 0.00 178.44 178.08 1jxv h VAL 65 N 0.04 1.28 -0.52 1.05 2.07 -1.19 -1.53 116.25 117.45 1jxv h VAL 65 Ca 0.09 -1.40 -0.07 0.00 0.82 0.00 0.00 66.70 66.15 1jxv h VAL 65 Cb 0.13 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1jxv h VAL 65 CO -0.18 0.44 0.06 0.50 0.02 0.00 0.00 177.57 178.41 1jxv h LYS 66 N 0.41 0.88 -0.07 1.57 1.63 -0.71 -2.61 116.57 117.67 1jxv h LYS 66 Ca 0.05 -0.25 -0.04 0.00 -0.85 0.00 0.00 60.65 59.56 1jxv h LYS 66 Cb 0.76 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 32.30 1jxv h LYS 66 CO 0.06 0.88 -0.12 -0.92 -3.45 0.00 0.00 179.45 175.90 1jxv h TYR 67 N 0.76 0.25 0.00 1.91 3.20 -0.59 -2.44 116.97 120.06 1jxv h TYR 67 Ca 0.15 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.94 1jxv h TYR 67 Cb 0.44 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.67 1jxv h TYR 67 CO 0.03 0.71 0.00 -1.33 -1.64 0.00 0.00 178.16 175.93 1jxv n MET 68 N -4.64 0.00 -0.00 1.82 2.81 -0.59 -1.39 117.12 115.13 1jxv n MET 68 Ca -0.08 0.38 0.10 0.00 -1.81 0.00 0.00 57.70 56.29 1jxv n MET 68 Cb 0.36 -1.51 -0.12 0.00 -0.71 0.00 0.00 33.22 31.24 1jxv n MET 68 CO 0.00 0.00 0.00 1.58 1.51 0.00 0.00 175.97 179.06 1jxv n HIS 69 N -1.51 0.00 0.65 2.03 -0.00 -0.98 -4.49 115.22 110.90 1jxv n HIS 69 Ca 0.02 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.82 1jxv n HIS 69 Cb 0.09 -0.05 0.37 0.00 -0.00 0.00 0.00 29.99 30.39 1jxv n HIS 69 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 1jxv n SER 70 N -1.57 0.00 -3.59 0.26 3.41 -0.49 -4.83 113.62 106.82 1jxv n SER 70 Ca 0.03 0.30 -0.02 0.00 -0.26 0.00 0.00 58.87 58.92 1jxv n SER 70 Cb 0.34 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 1jxv n SER 70 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1jxv s GLY 71 N -2.81 -0.13 0.46 5.00 0.00 -1.26 -5.10 107.32 103.48 1jxv s GLY 71 Ca 0.11 0.06 -0.20 0.00 0.00 0.00 0.00 44.72 44.69 1jxv s GLY 71 CO 0.27 1.45 1.00 2.56 0.00 0.00 0.00 173.10 178.38 1jxv s PRO 72 N -2.58 4.00 0.18 2.90 0.04 -1.26 -4.61 135.00 133.67 1jxv s PRO 72 Ca 0.18 1.23 0.10 0.00 0.04 0.00 0.00 61.00 62.55 1jxv s PRO 72 Cb -0.00 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 1jxv s PRO 72 CO 0.02 -0.24 -0.22 0.14 0.04 0.00 0.00 177.00 176.74 1jxv s VAL 73 N -2.10 2.14 -0.39 -0.36 -7.23 0.11 -3.79 120.40 108.77 1jxv s VAL 73 Ca 0.64 -1.99 -0.14 0.00 -1.81 0.00 0.00 61.98 58.69 1jxv s VAL 73 Cb -0.13 -2.01 0.02 0.00 0.56 0.00 0.00 36.38 34.82 1jxv s VAL 73 CO 0.17 -0.20 0.27 -0.69 -0.31 0.00 0.00 175.10 174.34 1jxv s VAL 74 N -1.83 5.07 -0.11 1.32 1.01 -0.69 -1.48 120.40 123.70 1jxv s VAL 74 Ca 0.19 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.30 1jxv s VAL 74 Cb -0.07 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1jxv s VAL 74 CO 0.09 -0.26 0.51 0.00 0.00 0.00 0.00 175.10 175.44 1jxv s ALA 75 N 1.65 3.45 0.09 5.51 0.00 0.64 -0.57 121.76 132.53 1jxv s ALA 75 Ca 0.04 -0.14 0.05 0.00 0.00 0.00 0.00 51.96 51.91 1jxv s ALA 75 Cb -0.19 -2.70 -0.03 0.00 0.00 0.00 0.00 23.12 20.20 1jxv s ALA 75 CO 0.09 -0.01 -0.12 -1.64 0.00 0.00 0.00 175.76 174.08 1jxv s MET 76 N 0.63 0.85 -0.11 0.00 -1.94 0.12 -1.95 119.30 116.90 1jxv s MET 76 Ca 0.28 -1.06 0.03 0.00 -1.71 0.00 0.00 55.69 53.23 1jxv s MET 76 Cb -0.16 -0.71 0.01 0.00 2.01 0.00 0.00 34.83 35.98 1jxv s MET 76 CO 0.12 0.14 -0.21 0.08 -0.01 0.00 0.00 175.02 175.14 1jxv s VAL 77 N -1.80 1.88 0.15 -6.03 1.01 -0.05 -1.30 120.40 114.27 1jxv s VAL 77 Ca 0.02 -0.89 0.11 0.00 0.00 0.00 0.00 61.98 61.21 1jxv s VAL 77 Cb -0.07 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 1jxv s VAL 77 CO 0.02 0.52 -0.25 0.26 0.00 0.00 0.00 175.10 175.65 1jxv s TRP 78 N 0.66 2.34 -0.01 5.22 0.52 -0.68 -0.88 118.94 126.11 1jxv s TRP 78 Ca -0.12 -0.36 0.03 0.00 0.02 0.00 0.00 56.10 55.68 1jxv s TRP 78 Cb -0.16 -1.22 -0.01 0.00 -1.15 0.00 0.00 33.47 30.93 1jxv s TRP 78 CO 0.03 0.41 -0.11 -2.00 0.02 0.00 0.00 176.95 175.29 1jxv s GLU 79 N -2.31 0.94 0.00 4.98 2.12 -0.22 -0.88 118.70 123.33 1jxv s GLU 79 Ca 0.17 -0.41 0.00 0.00 0.36 0.00 0.00 54.97 55.09 1jxv s GLU 79 Cb -0.09 -0.91 0.00 0.00 0.26 0.00 0.00 34.13 33.39 1jxv s GLU 79 CO 0.08 0.24 0.00 0.41 -0.54 0.00 0.00 175.26 175.45 1jxv n GLY 80 N 2.83 1.44 3.67 -1.50 0.00 0.55 -1.67 105.19 110.50 1jxv n GLY 80 Ca -0.14 -1.09 -0.54 0.00 0.00 0.00 0.00 46.02 44.26 1jxv n GLY 80 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1jxv n LEU 81 N 0.00 2.73 -2.47 0.99 0.00 -1.26 -1.89 117.00 115.10 1jxv n LEU 81 Ca 0.00 0.95 -0.19 0.00 0.00 0.00 0.00 56.01 56.78 1jxv n LEU 81 Cb 0.00 -1.23 -0.01 0.00 0.00 0.00 0.00 43.42 42.18 1jxv n LEU 81 CO 0.00 -0.33 -0.22 0.59 0.00 0.00 0.00 177.39 177.43 1jxv n ASN 82 N 6.44 -5.33 0.26 1.96 3.02 -1.26 -4.86 115.26 115.49 1jxv n ASN 82 Ca 0.27 0.02 0.11 0.00 -0.03 0.00 0.00 54.58 54.95 1jxv n ASN 82 Cb 0.20 -4.45 0.72 0.00 -0.61 0.00 0.00 39.78 35.64 1jxv n ASN 82 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 1jxv h VAL 83 N -0.10 0.76 -0.02 2.41 3.04 -1.67 -0.69 116.25 119.98 1jxv h VAL 83 Ca -0.44 -0.32 -0.01 0.00 -1.01 0.00 0.00 66.70 64.93 1jxv h VAL 83 Cb 1.32 1.19 -0.00 0.00 -2.01 0.00 0.00 31.29 31.79 1jxv h VAL 83 CO 0.52 0.08 -0.01 0.58 -1.01 0.00 0.00 177.57 177.73 1jxv h VAL 84 N 0.00 1.31 -0.04 1.51 2.07 -1.85 0.64 116.25 119.88 1jxv h VAL 84 Ca -0.00 -0.93 -0.19 0.00 0.82 0.00 0.00 66.70 66.41 1jxv h VAL 84 Cb 0.18 1.89 0.01 0.00 -1.52 0.00 0.00 31.29 31.86 1jxv h VAL 84 CO 0.01 0.25 -0.71 0.11 0.02 0.00 0.00 177.57 177.25 1jxv h LYS 85 N -0.34 0.55 -0.52 1.57 6.56 -1.77 -2.46 116.57 120.17 1jxv h LYS 85 Ca 0.01 -0.54 -0.05 0.00 -1.06 0.00 0.00 60.65 59.01 1jxv h LYS 85 Cb 0.40 0.14 -0.02 0.00 -0.57 0.00 0.00 32.23 32.18 1jxv h LYS 85 CO 0.00 1.17 0.13 1.15 -2.06 0.00 0.00 179.45 179.84 1jxv h THR 86 N 0.14 1.24 -0.65 -0.16 2.02 -1.15 -0.30 112.91 114.06 1jxv h THR 86 Ca -0.08 -0.85 0.12 0.00 0.77 0.00 0.00 66.41 66.38 1jxv h THR 86 Cb 1.38 0.80 -0.09 0.00 -1.74 0.00 0.00 68.15 68.50 1jxv h THR 86 CO 0.14 0.31 0.19 1.23 0.37 0.00 0.00 175.52 177.76 1jxv h GLY 87 N 0.72 0.89 1.03 2.16 0.00 0.27 0.18 103.07 108.33 1jxv h GLY 87 Ca 0.16 -0.07 -0.06 0.00 0.00 0.00 0.00 47.33 47.36 1jxv h GLY 87 CO 0.00 -0.11 0.16 3.21 0.00 0.00 0.00 176.54 179.81 1jxv h ARG 88 N 0.32 1.03 -1.00 4.80 3.08 -0.89 0.47 114.38 122.19 1jxv h ARG 88 Ca 0.35 -0.25 0.02 0.00 0.07 0.00 0.00 59.98 60.17 1jxv h ARG 88 Cb 0.52 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.38 1jxv h ARG 88 CO -0.40 0.92 0.66 0.28 -1.07 0.00 0.00 179.97 180.36 1jxv h VAL 89 N 0.95 1.22 -0.20 2.04 2.07 -0.24 -0.23 116.25 121.85 1jxv h VAL 89 Ca 0.20 -0.45 -0.16 0.00 0.82 0.00 0.00 66.70 67.11 1jxv h VAL 89 Cb 0.36 -0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 29.91 1jxv h VAL 89 CO 0.00 0.24 -0.53 0.24 0.02 0.00 0.00 177.57 177.55 1jxv h MET 90 N 1.31 0.56 -0.49 1.57 2.86 -0.02 -2.70 114.93 118.03 1jxv h MET 90 Ca 0.38 -0.34 -0.10 0.00 -2.06 0.00 0.00 59.70 57.58 1jxv h MET 90 Cb -0.08 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 1jxv h MET 90 CO -0.10 0.95 -0.10 -0.07 1.06 0.00 0.00 176.91 178.65 1jxv h LEU 91 N 0.44 0.87 0.00 1.22 3.38 -0.64 -1.39 115.31 119.19 1jxv h LEU 91 Ca 0.01 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1jxv h LEU 91 Cb 1.06 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1jxv h LEU 91 CO 0.10 0.99 0.00 0.61 0.09 0.00 0.00 178.44 180.23 1jxv n GLY 92 N -0.39 -0.26 3.67 0.83 0.00 -0.12 -1.31 105.19 107.61 1jxv n GLY 92 Ca 0.02 -1.84 -0.40 0.00 0.00 0.00 0.00 46.02 43.79 1jxv n GLY 92 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jxv n GLU 93 N -0.31 1.60 -0.20 1.61 4.71 -1.26 -4.85 120.64 121.94 1jxv n GLU 93 Ca 0.00 0.58 0.04 0.00 -0.01 0.00 0.00 57.16 57.77 1jxv n GLU 93 Cb 0.00 -2.27 0.31 0.00 -1.01 0.00 0.00 31.44 28.46 1jxv n GLU 93 CO 0.00 0.00 0.00 1.15 0.09 0.00 0.00 177.13 178.37 1jxv h THR 94 N 1.65 1.09 -3.56 2.62 2.02 -1.95 -3.34 112.91 111.43 1jxv h THR 94 Ca -0.47 -0.30 -0.62 0.00 0.77 0.00 0.00 66.41 65.79 1jxv h THR 94 Cb 1.32 0.14 -0.12 0.00 -1.74 0.00 0.00 68.15 67.75 1jxv h THR 94 CO 0.57 0.16 0.37 0.21 0.37 0.00 0.00 175.52 177.21 1jxv s ASN 95 N -6.26 6.51 0.65 4.18 2.47 -1.26 -4.80 114.94 116.44 1jxv s ASN 95 Ca -0.10 0.24 0.28 0.00 0.42 0.00 0.00 52.86 53.70 1jxv s ASN 95 Cb 0.19 -2.39 1.54 0.00 -1.45 0.00 0.00 41.25 39.13 1jxv s ASN 95 CO 0.78 -0.78 1.88 -0.65 -3.72 0.00 0.00 177.10 174.60 1jxv h PRO 96 N 8.61 0.00 0.00 0.43 0.11 -1.79 0.19 132.00 139.55 1jxv h PRO 96 Ca -0.25 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.79 1jxv h PRO 96 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1jxv h PRO 96 CO 0.92 0.00 -0.35 0.00 -0.21 0.00 0.00 178.00 178.37 1jxv h ALA 97 N 1.29 1.00 -0.03 -0.75 0.00 -1.89 -2.14 119.26 116.75 1jxv h ALA 97 Ca 0.03 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1jxv h ALA 97 Cb 0.80 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1jxv h ALA 97 CO -0.00 0.44 -0.10 -0.25 0.00 0.00 0.00 179.25 179.33 1jxv n ASP 98 N -3.51 2.71 -4.73 0.00 8.00 0.65 -4.96 116.55 114.71 1jxv n ASP 98 Ca -0.00 -1.86 -0.41 0.00 0.71 0.00 0.00 54.79 53.22 1jxv n ASP 98 Cb 0.50 0.10 -0.04 0.00 -0.02 0.00 0.00 41.12 41.66 1jxv n ASP 98 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1jxv s SER 99 N -2.10 7.17 0.21 -2.24 0.01 -0.81 -4.58 113.70 111.36 1jxv s SER 99 Ca 0.26 2.13 -0.16 0.00 1.31 0.00 0.00 55.95 59.49 1jxv s SER 99 Cb 0.20 -2.60 -0.08 0.00 0.21 0.00 0.00 66.02 63.75 1jxv s SER 99 CO 0.36 -0.32 0.65 -0.54 0.41 0.00 0.00 173.24 173.80 1jxv s LYS 100 N -0.08 4.08 0.32 12.44 -0.14 -1.26 -4.60 119.74 130.49 1jxv s LYS 100 Ca 0.52 0.65 -0.27 0.00 -1.36 0.00 0.00 55.97 55.51 1jxv s LYS 100 Cb -0.31 -2.80 -0.13 0.00 -1.68 0.00 0.00 37.83 32.91 1jxv s LYS 100 CO 0.35 0.38 1.05 -2.30 -0.76 0.00 0.00 175.35 174.06 1jxv n PRO 101 N 0.50 1.47 0.00 -1.68 -0.02 -1.26 -2.16 135.00 131.85 1jxv n PRO 101 Ca -0.02 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1jxv n PRO 101 Cb 0.52 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1jxv n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jxv n GLY 102 N 1.14 2.35 3.96 -1.23 0.00 -1.26 -4.97 105.19 105.18 1jxv n GLY 102 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1jxv n GLY 102 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jxv s THR 103 N -2.33 3.55 0.05 2.61 -4.23 -0.92 -4.92 115.64 109.46 1jxv s THR 103 Ca 0.00 -0.50 -0.23 0.00 -1.18 0.00 0.00 61.69 59.79 1jxv s THR 103 Cb 0.00 -3.33 -0.14 0.00 1.34 0.00 0.00 72.50 70.37 1jxv s THR 103 CO 0.00 -0.24 1.52 0.40 -0.54 0.00 0.00 174.62 175.76 1jxv h ILE 104 N 0.24 1.21 -0.01 2.99 2.04 -1.24 0.61 117.51 123.34 1jxv h ILE 104 Ca -0.45 -0.64 -0.14 0.00 1.00 0.00 0.00 64.86 64.64 1jxv h ILE 104 Cb 1.27 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 38.80 1jxv h ILE 104 CO 0.56 0.18 -0.65 0.03 0.00 0.00 0.00 178.15 178.27 1jxv h ARG 105 N -0.08 0.02 -0.44 2.37 3.08 -1.47 -1.29 114.38 116.58 1jxv h ARG 105 Ca 0.03 -0.02 -0.09 0.00 0.07 0.00 0.00 59.98 59.97 1jxv h ARG 105 Cb 0.27 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1jxv h ARG 105 CO 0.00 0.66 -0.07 0.78 -1.07 0.00 0.00 179.97 180.28 1jxv h GLY 106 N 1.90 0.88 1.51 0.04 0.00 -1.68 -2.44 103.07 103.28 1jxv h GLY 106 Ca -0.01 -0.70 -0.24 0.00 0.00 0.00 0.00 47.33 46.39 1jxv h GLY 106 CO 0.09 0.64 -0.98 -0.55 0.00 0.00 0.00 176.54 175.73 1jxv h ASP 107 N 0.65 0.57 -0.00 0.19 3.32 -0.68 -3.42 116.42 117.05 1jxv h ASP 107 Ca 0.12 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.69 1jxv h ASP 107 Cb 0.59 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.96 1jxv h ASP 107 CO 0.04 1.28 -0.07 0.49 -1.72 0.00 0.00 179.24 179.25 1jxv n PHE 108 N -3.74 0.00 -3.97 4.55 3.72 -0.50 -5.07 117.46 112.44 1jxv n PHE 108 Ca -0.07 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.22 1jxv n PHE 108 Cb 0.86 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.37 1jxv n PHE 108 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1jxv n ILE 110 N -0.48 0.00 -5.12 0.00 5.41 -1.26 -4.72 119.36 113.18 1jxv n ILE 110 Ca -0.03 0.00 -0.31 0.00 1.00 0.00 0.00 62.75 63.41 1jxv n ILE 110 Cb 0.61 -0.82 -0.15 0.00 -0.71 0.00 0.00 39.64 38.57 1jxv n ILE 110 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 1jxv s GLN 111 N -1.87 2.06 0.49 0.38 0.74 -1.26 -4.10 119.66 116.10 1jxv s GLN 111 Ca 0.00 -0.96 0.21 0.00 0.05 0.00 0.00 55.36 54.66 1jxv s GLN 111 Cb 0.00 -2.06 1.28 0.00 1.10 0.00 0.00 33.01 33.33 1jxv s GLN 111 CO 0.00 0.55 2.05 -0.24 -0.55 0.00 0.00 175.29 177.11 1jxv h VAL 112 N 4.37 0.83 0.00 1.34 3.04 -1.95 -0.25 116.25 123.63 1jxv h VAL 112 Ca -0.45 -0.52 0.00 0.00 -1.01 0.00 0.00 66.70 64.73 1jxv h VAL 112 Cb 1.13 1.30 0.00 0.00 -2.01 0.00 0.00 31.29 31.71 1jxv h VAL 112 CO 0.46 0.13 0.00 1.23 -1.01 0.00 0.00 177.57 178.39 1jxv h GLY 113 N 0.61 0.00 -6.00 3.17 0.00 -1.95 -3.29 103.07 95.61 1jxv h GLY 113 Ca -0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 1jxv h GLY 113 CO 0.02 0.00 -0.77 0.54 0.00 0.00 0.00 176.54 176.32 1jxv n ARG 114 N -2.90 2.06 -0.77 4.80 5.12 -0.12 -4.94 116.66 119.92 1jxv n ARG 114 Ca 0.03 -4.24 -0.03 0.00 -1.93 0.00 0.00 57.85 51.68 1jxv n ARG 114 Cb 0.44 -1.95 0.22 0.00 -1.16 0.00 0.00 32.46 30.01 1jxv n ARG 114 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1jxv n ASN 115 N 0.79 3.25 0.00 0.55 6.94 -1.15 -4.25 115.26 121.38 1jxv n ASN 115 Ca 0.27 -3.49 0.00 0.00 -0.02 0.00 0.00 54.58 51.35 1jxv n ASN 115 Cb 0.46 -0.64 0.00 0.00 -2.36 0.00 0.00 39.78 37.23 1jxv n ASN 115 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1jxv n ILE 116 N -0.86 0.00 -3.55 1.53 0.13 -1.26 -4.77 119.36 110.57 1jxv n ILE 116 Ca 0.34 0.00 -0.15 0.00 -1.10 0.00 0.00 62.75 61.84 1jxv n ILE 116 Cb 1.10 0.00 -0.05 0.00 -0.84 0.00 0.00 39.64 39.85 1jxv n ILE 116 CO 0.00 0.00 0.00 -0.51 2.80 0.00 0.00 176.55 178.84 1jxv s ILE 117 N 0.00 0.02 -0.02 9.51 2.07 -1.26 -1.22 121.20 130.30 1jxv s ILE 117 Ca 0.00 -0.16 0.06 0.00 -1.41 0.00 0.00 60.65 59.14 1jxv s ILE 117 Cb 0.00 -0.97 -0.01 0.00 0.13 0.00 0.00 42.46 41.61 1jxv s ILE 117 CO 0.00 -0.09 -0.20 -2.28 -1.91 0.00 0.00 174.94 170.46 1jxv s HIS 118 N -2.20 1.77 0.03 3.50 5.65 0.15 -4.88 115.29 119.30 1jxv s HIS 118 Ca -0.07 -0.34 0.04 0.00 0.25 0.00 0.00 55.06 54.94 1jxv s HIS 118 Cb -0.01 -1.14 -0.02 0.00 -1.18 0.00 0.00 32.58 30.24 1jxv s HIS 118 CO 0.00 -0.04 -0.11 0.20 -0.65 0.00 0.00 174.74 174.14 1jxv s GLY 119 N -0.44 0.63 0.25 1.59 0.00 -1.26 -0.85 107.32 107.24 1jxv s GLY 119 Ca 0.07 -0.68 -0.30 0.00 0.00 0.00 0.00 44.72 43.81 1jxv s GLY 119 CO -0.01 -0.65 1.23 1.44 0.00 0.00 0.00 173.10 175.10 1jxv n SER 120 N 2.12 2.01 0.10 1.64 7.64 -0.63 -4.91 113.62 121.60 1jxv n SER 120 Ca -0.17 1.16 0.12 0.00 1.01 0.00 0.00 58.87 60.98 1jxv n SER 120 Cb 0.55 -1.34 0.02 0.00 -1.01 0.00 0.00 64.21 62.43 1jxv n SER 120 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 1jxv h ASP 121 N 3.20 0.00 -5.20 6.43 3.04 -1.92 -3.45 116.42 118.52 1jxv h ASP 121 Ca -0.43 -0.04 -0.10 0.00 -3.24 0.00 0.00 57.03 53.22 1jxv h ASP 121 Cb 1.31 0.00 -0.14 0.00 -1.04 0.00 0.00 39.33 39.46 1jxv h ASP 121 CO 0.69 0.02 -0.45 -0.94 -2.04 0.00 0.00 179.24 176.52 1jxv s SER 122 N -5.18 0.21 0.38 4.15 1.04 -1.26 -4.93 113.70 108.11 1jxv s SER 122 Ca 0.01 -0.78 0.08 0.00 0.48 0.00 0.00 55.95 55.73 1jxv s SER 122 Cb 0.10 0.31 0.81 0.00 0.10 0.00 0.00 66.02 67.35 1jxv s SER 122 CO 0.78 -0.72 1.97 0.58 0.98 0.00 0.00 173.24 176.83 1jxv h VAL 123 N 2.83 0.99 -0.00 5.02 2.07 -1.93 0.31 116.25 125.53 1jxv h VAL 123 Ca -0.34 -0.23 -0.26 0.00 0.82 0.00 0.00 66.70 66.69 1jxv h VAL 123 Cb 1.19 0.27 0.02 0.00 -1.52 0.00 0.00 31.29 31.24 1jxv h VAL 123 CO 0.58 0.12 -1.03 1.05 0.02 0.00 0.00 177.57 178.31 1jxv h GLU 124 N 0.67 0.69 0.00 1.57 -0.00 -1.97 -2.26 114.58 113.27 1jxv h GLU 124 Ca 0.30 -0.74 -0.08 0.00 -0.00 0.00 0.00 59.36 58.85 1jxv h GLU 124 Cb 0.31 0.21 -0.01 0.00 -0.00 0.00 0.00 28.75 29.26 1jxv h GLU 124 CO -0.10 1.31 -0.37 0.66 -0.00 0.00 0.00 179.01 180.52 1jxv h SER 125 N 0.39 0.00 -0.17 3.06 4.64 -1.88 -2.00 113.55 117.59 1jxv h SER 125 Ca -0.13 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1jxv h SER 125 Cb 1.69 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.77 1jxv h SER 125 CO 0.20 0.37 0.09 0.00 -0.87 0.00 0.00 176.83 176.62 1jxv h ALA 126 N 1.63 0.21 -0.43 5.18 0.00 -0.28 0.19 119.26 125.77 1jxv h ALA 126 Ca -0.00 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1jxv h ALA 126 Cb 0.90 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1jxv h ALA 126 CO 0.05 -0.26 -0.10 0.93 0.00 0.00 0.00 179.25 179.88 1jxv h GLU 127 N 0.17 0.76 -0.02 0.00 4.39 -1.17 0.67 114.58 119.38 1jxv h GLU 127 Ca 0.06 -0.24 0.02 0.00 0.34 0.00 0.00 59.36 59.54 1jxv h GLU 127 Cb 0.07 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 1jxv h GLU 127 CO -0.01 0.83 -0.14 -0.22 -1.16 0.00 0.00 179.01 178.31 1jxv h LYS 128 N 0.69 -0.22 -0.14 2.33 1.63 -1.00 -2.29 116.57 117.58 1jxv h LYS 128 Ca 0.12 0.02 -0.20 0.00 -0.85 0.00 0.00 60.65 59.73 1jxv h LYS 128 Cb 0.56 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.25 1jxv h LYS 128 CO 0.03 -0.15 -0.73 0.93 -3.45 0.00 0.00 179.45 176.09 1jxv h GLU 129 N -0.23 0.63 -0.84 1.90 5.08 -0.22 0.21 114.58 121.11 1jxv h GLU 129 Ca 0.05 -0.50 -0.02 0.00 -1.00 0.00 0.00 59.36 57.89 1jxv h GLU 129 Cb 0.30 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.61 1jxv h GLU 129 CO -0.15 1.12 0.44 0.82 -1.00 0.00 0.00 179.01 180.24 1jxv h ILE 130 N 0.44 1.25 -0.11 3.13 2.04 -0.91 0.13 117.51 123.49 1jxv h ILE 130 Ca -0.04 -0.66 -0.16 0.00 1.00 0.00 0.00 64.86 65.01 1jxv h ILE 130 Cb 1.33 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1jxv h ILE 130 CO 0.14 0.29 -0.61 1.23 0.00 0.00 0.00 178.15 179.20 1jxv h GLY 131 N 1.19 0.41 1.68 5.37 0.00 -1.05 0.16 103.07 110.83 1jxv h GLY 131 Ca 0.29 -0.51 -0.15 0.00 0.00 0.00 0.00 47.33 46.97 1jxv h GLY 131 CO -0.04 0.45 -0.57 -2.00 0.00 0.00 0.00 176.54 174.38 1jxv h LEU 132 N 0.27 0.37 0.00 3.11 5.85 -0.51 -3.36 115.31 121.04 1jxv h LEU 132 Ca -0.01 -0.20 -0.14 0.00 0.84 0.00 0.00 57.88 58.37 1jxv h LEU 132 Cb 1.15 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 1jxv h LEU 132 CO 0.10 0.86 -2.04 0.79 -0.34 0.00 0.00 178.44 177.82 1jxv n TRP 133 N -3.91 0.00 -4.99 1.25 7.02 -0.01 -4.97 117.44 111.83 1jxv n TRP 133 Ca -0.03 0.00 -0.28 0.00 -1.02 0.00 0.00 57.50 56.18 1jxv n TRP 133 Cb 0.60 -0.64 -0.16 0.00 -2.42 0.00 0.00 31.31 28.70 1jxv n TRP 133 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 1jxv s PHE 134 N -2.95 1.93 0.36 -5.99 0.40 0.54 -5.08 117.98 107.18 1jxv s PHE 134 Ca -0.08 -0.51 -0.26 0.00 -0.60 0.00 0.00 56.93 55.48 1jxv s PHE 134 Cb 0.09 -1.27 -0.09 0.00 0.51 0.00 0.00 43.02 42.26 1jxv s PHE 134 CO 0.78 -0.14 1.10 -1.01 0.70 0.00 0.00 175.22 176.65 1jxv s HIS 135 N -0.16 3.33 0.50 0.36 3.76 -1.26 -4.56 115.29 117.26 1jxv s HIS 135 Ca -0.00 1.64 0.38 0.00 -0.15 0.00 0.00 55.06 56.93 1jxv s HIS 135 Cb -0.11 -3.25 1.99 0.00 1.11 0.00 0.00 32.58 32.32 1jxv s HIS 135 CO 0.02 -0.78 2.23 -1.00 -0.85 0.00 0.00 174.74 174.36 1jxv h PRO 136 N 3.01 0.00 -0.01 8.40 0.13 -1.95 0.15 132.00 141.74 1jxv h PRO 136 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1jxv h PRO 136 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1jxv h PRO 136 CO 0.64 0.02 -0.07 -0.85 -0.23 0.00 0.00 178.00 177.51 1jxv n GLU 137 N -3.26 0.94 0.00 0.86 0.00 -1.26 -2.82 120.64 115.11 1jxv n GLU 137 Ca -0.02 -0.34 0.13 0.00 0.00 0.00 0.00 57.16 56.93 1jxv n GLU 137 Cb 0.15 -1.49 0.38 0.00 0.00 0.00 0.00 31.44 30.47 1jxv n GLU 137 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1jxv n GLU 138 N -0.73 0.45 -3.46 3.44 1.02 0.52 -4.81 120.64 117.08 1jxv n GLU 138 Ca 0.17 -0.24 -0.40 0.00 -0.02 0.00 0.00 57.16 56.67 1jxv n GLU 138 Cb 0.26 -1.49 -0.10 0.00 -0.02 0.00 0.00 31.44 30.09 1jxv n GLU 138 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1jxv s LEU 139 N -2.71 4.25 -0.19 -4.62 1.43 -1.13 -4.63 118.68 111.08 1jxv s LEU 139 Ca 0.19 -0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 53.09 1jxv s LEU 139 Cb 0.19 -2.28 -0.05 0.00 0.03 0.00 0.00 46.19 44.08 1jxv s LEU 139 CO 0.58 -0.22 0.23 -0.69 0.23 0.00 0.00 176.35 176.48 1jxv s VAL 140 N 1.93 5.34 -0.19 -1.59 1.01 0.28 -5.02 120.40 122.16 1jxv s VAL 140 Ca 0.11 0.38 -0.06 0.00 0.00 0.00 0.00 61.98 62.40 1jxv s VAL 140 Cb -0.16 -3.56 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 1jxv s VAL 140 CO 0.11 0.38 0.04 -1.81 0.00 0.00 0.00 175.10 173.81 1jxv s ASP 141 N 0.62 5.30 0.25 3.32 1.01 -1.26 -4.60 116.67 121.31 1jxv s ASP 141 Ca 0.12 -0.03 -0.18 0.00 0.71 0.00 0.00 52.55 53.16 1jxv s ASP 141 Cb -0.13 -1.90 0.02 0.00 1.01 0.00 0.00 42.92 41.92 1jxv s ASP 141 CO 0.03 0.13 0.62 -0.72 0.21 0.00 0.00 175.17 175.44 1jxv s TYR 142 N 0.61 -0.05 -0.18 4.23 1.13 -1.26 -5.16 117.35 116.67 1jxv s TYR 142 Ca 0.02 -0.35 -0.05 0.00 -1.41 0.00 0.00 57.07 55.28 1jxv s TYR 142 Cb -0.13 0.52 -0.03 0.00 -1.10 0.00 0.00 41.96 41.22 1jxv s TYR 142 CO 0.02 -1.11 -0.01 0.99 -2.51 0.00 0.00 175.55 172.93 1jxv s THR 143 N -3.93 4.03 0.39 -3.49 2.01 -1.26 -5.09 115.64 108.29 1jxv s THR 143 Ca 0.13 -0.30 -0.26 0.00 0.31 0.00 0.00 61.69 61.57 1jxv s THR 143 Cb -0.04 -2.79 -0.09 0.00 0.01 0.00 0.00 72.50 69.59 1jxv s THR 143 CO 0.05 0.46 1.28 -0.55 -0.69 0.00 0.00 174.62 175.17 1jxv s SER 144 N 0.62 6.45 0.50 3.53 0.15 -1.26 -4.89 113.70 118.80 1jxv s SER 144 Ca -0.01 2.60 0.33 0.00 0.70 0.00 0.00 55.95 59.58 1jxv s SER 144 Cb -0.14 -2.64 1.66 0.00 -1.71 0.00 0.00 66.02 63.20 1jxv s SER 144 CO 0.02 -0.75 2.01 0.00 1.20 0.00 0.00 173.24 175.73 1jxv n ALA 146 N -1.96 2.41 -0.25 0.00 0.00 -1.26 -4.67 120.51 114.78 1jxv n ALA 146 Ca -0.01 -0.92 0.02 0.00 0.00 0.00 0.00 53.44 52.53 1jxv n ALA 146 Cb 0.14 -0.78 0.15 0.00 0.00 0.00 0.00 19.45 18.97 1jxv n ALA 146 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1jxv h GLN 147 N 4.10 0.54 0.00 0.00 4.15 -1.86 0.14 115.11 122.19 1jxv h GLN 147 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1jxv h GLN 147 Cb 0.92 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.49 1jxv h GLN 147 CO 0.00 0.36 0.00 0.09 -1.93 0.00 0.00 178.83 177.35 1jxv n ASN 148 N -4.90 0.18 -0.09 -0.69 3.02 -1.26 -0.59 115.26 110.93 1jxv n ASN 148 Ca 0.12 0.53 0.09 0.00 -0.03 0.00 0.00 54.58 55.29 1jxv n ASN 148 Cb 0.31 -0.57 -0.09 0.00 -0.61 0.00 0.00 39.78 38.82 1jxv n ASN 148 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1jxv n TRP 149 N -1.68 0.00 -0.10 3.10 7.02 0.38 -4.25 117.44 121.91 1jxv n TRP 149 Ca 0.05 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.39 1jxv n TRP 149 Cb 0.26 0.00 -0.14 0.00 -2.42 0.00 0.00 31.31 29.01 1jxv n TRP 149 CO 0.00 0.00 0.00 -0.89 -2.02 0.00 0.00 177.69 174.78 1jxv n ILE 150 N -1.17 1.46 -4.31 -0.99 5.41 -0.61 -4.99 119.36 114.16 1jxv n ILE 150 Ca 0.05 -0.74 -0.20 0.00 1.00 0.00 0.00 62.75 62.85 1jxv n ILE 150 Cb 0.32 -0.91 -0.13 0.00 -0.71 0.00 0.00 39.64 38.22 1jxv n ILE 150 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 1jxv s TYR 151 N -2.51 1.24 -2.00 1.39 2.02 0.25 -5.10 117.35 112.64 1jxv s TYR 151 Ca -0.19 -0.38 0.22 0.00 -0.37 0.00 0.00 57.07 56.35 1jxv s TYR 151 Cb 0.07 -0.73 1.31 0.00 -0.40 0.00 0.00 41.96 42.21 1jxv s TYR 151 CO 0.75 0.04 1.68 0.39 -1.57 0.00 0.00 175.55 176.84