#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p6a s ILE 24 N 0.00 3.81 -2.03 -0.61 1.01 -1.26 -1.19 121.20 120.93 1p6a s ILE 24 Ca 0.00 1.48 0.28 0.00 0.00 0.00 0.00 60.65 62.41 1p6a s ILE 24 Cb 0.00 -3.81 0.52 0.00 0.01 0.00 0.00 42.46 39.18 1p6a s ILE 24 CO 0.00 0.10 1.81 0.35 0.00 0.00 0.00 174.94 177.20 1p6a n THR 25 N 0.29 0.00 -4.69 2.92 -2.24 0.14 -4.88 114.28 105.83 1p6a n THR 25 Ca 0.03 -0.13 -0.24 0.00 -2.27 0.00 0.00 64.05 61.44 1p6a n THR 25 Cb 0.49 0.16 -0.16 0.00 -2.10 0.00 0.00 70.33 68.72 1p6a n THR 25 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1p6a s THR 26 N -2.24 1.19 0.90 4.28 -4.23 -1.26 -5.04 115.64 109.24 1p6a s THR 26 Ca 0.34 -0.61 -0.14 0.00 -1.18 0.00 0.00 61.69 60.10 1p6a s THR 26 Cb 0.20 -1.02 0.15 0.00 1.34 0.00 0.00 72.50 73.17 1p6a s THR 26 CO 0.42 0.35 1.26 -2.16 -0.54 0.00 0.00 174.62 173.95 1p6a s PRO 27 N -0.08 1.22 -0.09 3.99 0.04 -1.26 -4.90 135.00 133.91 1p6a s PRO 27 Ca 0.00 -0.18 -0.30 0.00 0.04 0.00 0.00 61.00 60.56 1p6a s PRO 27 Cb -0.09 -1.89 -0.08 0.00 0.04 0.00 0.00 34.50 32.49 1p6a s PRO 27 CO 0.01 -2.06 2.08 -1.91 0.04 0.00 0.00 177.00 175.16 1p6a n GLU 28 N -3.57 2.38 -4.62 4.56 2.13 -1.26 -4.86 120.64 115.40 1p6a n GLU 28 Ca 0.12 0.79 -0.28 0.00 0.66 0.00 0.00 57.16 58.45 1p6a n GLU 28 Cb 0.60 -3.06 -0.09 0.00 0.27 0.00 0.00 31.44 29.16 1p6a n GLU 28 CO 0.00 0.00 0.00 -1.83 -0.41 0.00 0.00 177.13 174.89 1p6a s GLU 29 N 5.29 1.97 -0.16 5.31 -1.05 -1.14 -5.03 118.70 123.89 1p6a s GLU 29 Ca 0.95 -2.18 0.00 0.00 -0.15 0.00 0.00 54.97 53.60 1p6a s GLU 29 Cb -0.43 -1.32 0.03 0.00 -0.44 0.00 0.00 34.13 31.97 1p6a s GLU 29 CO 0.40 -0.23 -0.11 1.41 0.95 0.00 0.00 175.26 177.68 1p6a s MET 30 N -3.80 2.05 -0.26 -4.83 -2.45 -1.26 -1.45 119.30 107.30 1p6a s MET 30 Ca 0.24 -0.62 -0.08 0.00 -1.25 0.00 0.00 55.69 53.97 1p6a s MET 30 Cb 0.06 -2.16 -0.03 0.00 1.25 0.00 0.00 34.83 33.95 1p6a s MET 30 CO 0.12 -0.33 0.11 0.42 1.05 0.00 0.00 175.02 176.39 1p6a s ILE 31 N 1.49 4.61 -0.32 10.11 1.01 -0.51 -4.95 121.20 132.63 1p6a s ILE 31 Ca 0.02 -0.08 -0.07 0.00 0.00 0.00 0.00 60.65 60.53 1p6a s ILE 31 Cb -0.14 -3.17 0.02 0.00 0.01 0.00 0.00 42.46 39.18 1p6a s ILE 31 CO -0.09 0.31 0.10 -0.70 0.00 0.00 0.00 174.94 174.55 1p6a s GLU 32 N 1.66 2.89 0.41 2.79 2.12 -1.26 -1.06 118.70 126.25 1p6a s GLU 32 Ca 0.07 -1.00 0.03 0.00 0.36 0.00 0.00 54.97 54.43 1p6a s GLU 32 Cb -0.15 -3.42 -0.03 0.00 0.26 0.00 0.00 34.13 30.78 1p6a s GLU 32 CO 0.06 -0.54 0.09 0.15 -0.54 0.00 0.00 175.26 174.48 1p6a s LYS 33 N 1.46 1.93 0.11 4.30 1.02 0.17 -4.98 119.74 123.75 1p6a s LYS 33 Ca 0.01 -2.17 0.07 0.00 0.02 0.00 0.00 55.97 53.90 1p6a s LYS 33 Cb -0.18 -0.83 -0.04 0.00 -0.52 0.00 0.00 37.83 36.25 1p6a s LYS 33 CO 0.03 -0.40 -0.10 0.00 -0.92 0.00 0.00 175.35 173.96 1p6a s ALA 34 N -3.16 2.97 0.20 5.17 0.00 -1.26 -0.55 121.76 125.13 1p6a s ALA 34 Ca 0.23 -1.26 -0.31 0.00 0.00 0.00 0.00 51.96 50.62 1p6a s ALA 34 Cb 0.04 -0.89 -0.16 0.00 0.00 0.00 0.00 23.12 22.11 1p6a s ALA 34 CO 0.13 0.63 0.97 1.17 0.00 0.00 0.00 175.76 178.66 1p6a n LYS 35 N 0.63 0.90 0.00 0.00 4.81 -0.57 -1.33 118.16 122.59 1p6a n LYS 35 Ca -0.13 0.32 0.00 0.00 -0.87 0.00 0.00 58.31 57.63 1p6a n LYS 35 Cb 0.53 -1.67 0.00 0.00 0.02 0.00 0.00 35.03 33.91 1p6a n LYS 35 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1p6a n GLY 36 N 1.73 2.49 3.48 3.14 0.00 -0.07 -4.91 105.19 111.06 1p6a n GLY 36 Ca 0.14 -0.48 -0.29 0.00 0.00 0.00 0.00 46.02 45.39 1p6a n GLY 36 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p6a s GLU 37 N 0.00 -1.46 -0.07 1.61 2.02 -0.44 -3.71 118.70 116.65 1p6a s GLU 37 Ca 0.00 0.33 0.03 0.00 0.02 0.00 0.00 54.97 55.34 1p6a s GLU 37 Cb 0.00 -1.53 -0.02 0.00 0.10 0.00 0.00 34.13 32.67 1p6a s GLU 37 CO 0.00 -3.95 -0.14 0.99 0.02 0.00 0.00 175.26 172.18 1p6a s THR 38 N -2.62 3.04 -0.16 3.63 2.01 -1.26 -0.92 115.64 119.35 1p6a s THR 38 Ca 0.69 -0.72 -0.06 0.00 0.31 0.00 0.00 61.69 61.91 1p6a s THR 38 Cb -0.17 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 70.10 1p6a s THR 38 CO 0.59 0.58 0.06 0.00 -0.69 0.00 0.00 174.62 175.16 1p6a s ALA 39 N -0.48 3.42 -0.41 7.40 0.00 -0.84 -4.94 121.76 125.91 1p6a s ALA 39 Ca 0.06 -0.74 -0.09 0.00 0.00 0.00 0.00 51.96 51.19 1p6a s ALA 39 Cb -0.12 -1.84 0.07 0.00 0.00 0.00 0.00 23.12 21.23 1p6a s ALA 39 CO 0.02 0.30 0.25 -0.47 0.00 0.00 0.00 175.76 175.85 1p6a s TYR 40 N 0.01 3.33 -0.45 0.00 5.04 -1.26 -1.73 117.35 122.29 1p6a s TYR 40 Ca 0.06 -1.49 -0.21 0.00 -2.44 0.00 0.00 57.07 52.99 1p6a s TYR 40 Cb -0.12 -2.90 0.03 0.00 0.35 0.00 0.00 41.96 39.32 1p6a s TYR 40 CO 0.01 -0.83 0.67 -0.51 -1.34 0.00 0.00 175.55 173.55 1p6a s LEU 41 N 1.43 4.51 0.27 6.97 1.02 -0.38 -4.99 118.68 127.51 1p6a s LEU 41 Ca 0.03 -0.38 -0.30 0.00 0.02 0.00 0.00 54.13 53.50 1p6a s LEU 41 Cb -0.23 -2.73 -0.09 0.00 0.02 0.00 0.00 46.19 43.17 1p6a s LEU 41 CO 0.02 -0.82 1.10 -2.84 0.02 0.00 0.00 176.35 173.83 1p6a s PRO 42 N 2.89 4.64 -0.49 1.29 0.02 -1.26 -1.82 135.00 140.28 1p6a s PRO 42 Ca 0.23 1.79 0.05 0.00 0.02 0.00 0.00 61.00 63.09 1p6a s PRO 42 Cb -0.14 -3.20 0.22 0.00 0.02 0.00 0.00 34.50 31.40 1p6a s PRO 42 CO 0.19 0.20 0.87 0.00 -0.33 0.00 0.00 177.00 177.93 1p6a s LYS 44 N 0.73 3.83 0.27 0.00 1.02 -1.26 -0.08 119.74 124.24 1p6a s LYS 44 Ca 0.31 0.09 0.03 0.00 0.02 0.00 0.00 55.97 56.42 1p6a s LYS 44 Cb 0.15 -3.27 -0.05 0.00 -0.52 0.00 0.00 37.83 34.14 1p6a s LYS 44 CO -0.17 0.59 0.06 -0.59 -0.92 0.00 0.00 175.35 174.32 1p6a s PHE 45 N -0.60 1.65 0.05 3.18 -0.12 0.63 0.28 117.98 123.05 1p6a s PHE 45 Ca 0.18 -1.05 0.07 0.00 -0.05 0.00 0.00 56.93 56.08 1p6a s PHE 45 Cb -0.14 -1.00 -0.03 0.00 -0.63 0.00 0.00 43.02 41.23 1p6a s PHE 45 CO 0.07 -0.16 -0.19 0.95 -0.05 0.00 0.00 175.22 175.84 1p6a s THR 46 N -3.54 1.51 -0.06 -4.49 -4.23 -0.33 -4.54 115.64 99.96 1p6a s THR 46 Ca 0.34 -1.18 0.02 0.00 -1.18 0.00 0.00 61.69 59.69 1p6a s THR 46 Cb 0.07 -1.33 -0.03 0.00 1.34 0.00 0.00 72.50 72.55 1p6a s THR 46 CO 0.12 0.12 -0.09 -0.76 -0.54 0.00 0.00 174.62 173.47 1p6a s LEU 47 N -1.25 3.04 0.51 4.79 1.43 -1.26 -2.06 118.68 123.89 1p6a s LEU 47 Ca 0.06 -0.07 -0.03 0.00 -1.03 0.00 0.00 54.13 53.05 1p6a s LEU 47 Cb -0.09 -1.65 -0.01 0.00 0.03 0.00 0.00 46.19 44.48 1p6a s LEU 47 CO 0.02 0.36 0.78 -0.44 0.23 0.00 0.00 176.35 177.30 1p6a s SER 48 N -0.79 5.83 0.41 2.29 0.01 -1.26 -4.98 113.70 115.20 1p6a s SER 48 Ca 0.12 0.59 0.16 0.00 1.31 0.00 0.00 55.95 58.13 1p6a s SER 48 Cb -0.11 -1.76 0.88 0.00 0.21 0.00 0.00 66.02 65.25 1p6a s SER 48 CO 0.01 -0.82 1.89 -0.65 0.41 0.00 0.00 173.24 174.08 1p6a h PRO 49 N 0.14 0.00 -0.52 12.44 0.11 -2.02 -2.70 132.00 139.45 1p6a h PRO 49 Ca -0.46 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.56 1p6a h PRO 49 Cb 1.24 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 1p6a h PRO 49 CO 0.60 0.30 -0.04 0.93 -0.21 0.00 0.00 178.00 179.58 1p6a h GLU 50 N 0.00 0.91 -5.39 1.05 3.07 -1.95 -3.39 114.58 108.87 1p6a h GLU 50 Ca -0.00 -0.28 -0.09 0.00 -0.50 0.00 0.00 59.36 58.49 1p6a h GLU 50 Cb 0.56 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 1p6a h GLU 50 CO 0.04 0.92 0.23 -0.51 -1.40 0.00 0.00 179.01 178.29 1p6a s ASP 51 N -6.63 4.12 0.00 1.42 1.01 -1.02 -4.43 116.67 111.14 1p6a s ASP 51 Ca -0.10 -0.38 0.11 0.00 0.71 0.00 0.00 52.55 52.89 1p6a s ASP 51 Cb 0.14 -2.56 -0.08 0.00 1.01 0.00 0.00 42.92 41.43 1p6a s ASP 51 CO 0.83 -3.78 0.55 0.00 0.21 0.00 0.00 175.17 172.99 1p6a n GLN 52 N 8.68 2.83 -1.18 8.23 6.02 -0.56 -4.83 117.38 136.58 1p6a n GLN 52 Ca 0.44 -0.25 -0.30 0.00 -0.01 0.00 0.00 57.00 56.89 1p6a n GLN 52 Cb 0.45 -1.06 0.14 0.00 1.02 0.00 0.00 30.24 30.78 1p6a n GLN 52 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1p6a s GLY 53 N -1.84 1.62 0.32 1.08 0.00 -0.37 -4.95 107.32 103.17 1p6a s GLY 53 Ca 0.06 -0.04 -0.29 0.00 0.00 0.00 0.00 44.72 44.45 1p6a s GLY 53 CO 0.39 0.45 1.38 2.56 0.00 0.00 0.00 173.10 177.88 1p6a s PRO 54 N -4.92 4.28 0.26 2.90 0.04 -1.26 -4.44 135.00 131.87 1p6a s PRO 54 Ca 0.63 2.31 -0.30 0.00 0.04 0.00 0.00 61.00 63.68 1p6a s PRO 54 Cb -0.18 -3.06 -0.11 0.00 0.04 0.00 0.00 34.50 31.19 1p6a s PRO 54 CO 0.57 -0.32 1.55 -1.17 0.04 0.00 0.00 177.00 177.67 1p6a s LEU 55 N -1.44 4.36 -0.09 -3.56 2.96 -1.26 -4.52 118.68 115.13 1p6a s LEU 55 Ca 0.53 2.83 -0.02 0.00 -0.22 0.00 0.00 54.13 57.25 1p6a s LEU 55 Cb -0.42 -3.62 0.03 0.00 0.50 0.00 0.00 46.19 42.68 1p6a s LEU 55 CO 0.52 -0.84 0.01 -0.62 -1.32 0.00 0.00 176.35 174.09 1p6a s ASP 56 N 0.57 1.80 -0.10 3.68 -1.08 0.10 -4.44 116.67 117.20 1p6a s ASP 56 Ca 0.64 -0.20 0.03 0.00 -0.52 0.00 0.00 52.55 52.50 1p6a s ASP 56 Cb -0.46 -0.47 -0.00 0.00 -1.46 0.00 0.00 42.92 40.53 1p6a s ASP 56 CO 0.44 -0.21 -0.22 -0.63 0.52 0.00 0.00 175.17 175.07 1p6a s ILE 57 N 1.95 2.28 -0.02 4.11 -1.09 -0.68 -0.44 121.20 127.32 1p6a s ILE 57 Ca 0.04 -0.95 0.00 0.00 -2.23 0.00 0.00 60.65 57.52 1p6a s ILE 57 Cb -0.13 -1.89 0.02 0.00 -1.58 0.00 0.00 42.46 38.88 1p6a s ILE 57 CO -0.06 0.55 0.01 -0.70 -1.23 0.00 0.00 174.94 173.52 1p6a s GLU 58 N 0.29 0.10 -0.20 2.79 2.12 -0.54 -1.04 118.70 122.21 1p6a s GLU 58 Ca -0.16 0.09 -0.03 0.00 0.36 0.00 0.00 54.97 55.24 1p6a s GLU 58 Cb -0.17 -0.28 -0.00 0.00 0.26 0.00 0.00 34.13 33.93 1p6a s GLU 58 CO 0.08 -0.11 -0.08 -1.58 -0.54 0.00 0.00 175.26 173.03 1p6a s TRP 59 N 0.77 2.91 0.34 5.30 0.52 -0.78 -0.38 118.94 127.62 1p6a s TRP 59 Ca -0.07 -1.01 0.09 0.00 0.02 0.00 0.00 56.10 55.13 1p6a s TRP 59 Cb -0.10 -2.04 -0.05 0.00 -1.15 0.00 0.00 33.47 30.13 1p6a s TRP 59 CO -0.02 -0.54 0.07 -0.51 0.02 0.00 0.00 176.95 175.97 1p6a s LEU 60 N 1.28 3.10 -0.02 2.99 1.02 0.11 -0.30 118.68 126.86 1p6a s LEU 60 Ca 0.03 -0.90 -0.02 0.00 0.02 0.00 0.00 54.13 53.26 1p6a s LEU 60 Cb -0.14 -1.51 0.00 0.00 0.02 0.00 0.00 46.19 44.56 1p6a s LEU 60 CO -0.04 -0.27 0.04 -0.51 0.02 0.00 0.00 176.35 175.60 1p6a s ILE 61 N -2.48 0.00 -0.54 -0.59 2.07 0.98 -0.72 121.20 119.92 1p6a s ILE 61 Ca 0.36 -0.03 0.03 0.00 -1.41 0.00 0.00 60.65 59.60 1p6a s ILE 61 Cb -0.01 -0.08 0.13 0.00 0.13 0.00 0.00 42.46 42.63 1p6a s ILE 61 CO 0.21 -0.02 0.28 -0.44 -1.91 0.00 0.00 174.94 173.06 1p6a s SER 62 N -0.03 4.40 0.68 4.50 0.01 -0.33 -0.91 113.70 122.01 1p6a s SER 62 Ca -0.01 -3.04 -0.17 0.00 1.31 0.00 0.00 55.95 54.05 1p6a s SER 62 Cb -0.01 -1.66 -0.02 0.00 0.21 0.00 0.00 66.02 64.55 1p6a s SER 62 CO 0.00 -0.24 0.95 -2.65 0.41 0.00 0.00 173.24 171.72 1p6a n PRO 63 N 3.09 0.66 0.05 12.44 -0.02 -1.25 -2.03 135.00 147.94 1p6a n PRO 63 Ca 0.06 0.28 -0.19 0.00 -2.02 0.00 0.00 63.50 61.63 1p6a n PRO 63 Cb 0.33 -2.19 -0.14 0.00 -0.02 0.00 0.00 33.50 31.47 1p6a n PRO 63 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1p6a h ALA 64 N 0.04 0.30 0.24 3.55 0.00 -1.43 -3.40 119.26 118.55 1p6a h ALA 64 Ca -0.48 -1.19 -0.01 0.00 0.00 0.00 0.00 54.91 53.23 1p6a h ALA 64 Cb 1.35 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.55 1p6a h ALA 64 CO 0.48 1.17 -0.12 0.38 0.00 0.00 0.00 179.25 181.16 1p6a h ASP 65 N 0.07 -0.28 -3.32 0.00 3.04 -1.87 -3.45 116.42 110.62 1p6a h ASP 65 Ca -0.30 0.01 -0.45 0.00 -3.24 0.00 0.00 57.03 53.05 1p6a h ASP 65 Cb 2.04 0.07 0.14 0.00 -1.04 0.00 0.00 39.33 40.54 1p6a h ASP 65 CO 0.15 -0.19 0.32 0.54 -2.04 0.00 0.00 179.24 178.01 1p6a s ASN 66 N -2.57 3.48 -0.03 4.15 4.22 -1.26 -5.00 114.94 117.93 1p6a s ASN 66 Ca -0.05 0.01 0.21 0.00 -2.14 0.00 0.00 52.86 50.89 1p6a s ASN 66 Cb 0.00 -0.15 0.66 0.00 1.28 0.00 0.00 41.25 43.05 1p6a s ASN 66 CO 0.14 -2.47 1.55 0.00 -2.04 0.00 0.00 177.10 174.29 1p6a n GLN 67 N -3.46 2.94 -2.51 3.55 10.64 -1.26 -4.74 117.38 122.54 1p6a n GLN 67 Ca 0.16 -2.65 -0.35 0.00 -1.83 0.00 0.00 57.00 52.33 1p6a n GLN 67 Cb 0.60 -1.65 -0.03 0.00 -0.86 0.00 0.00 30.24 28.30 1p6a n GLN 67 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 1p6a s LYS 68 N -1.25 3.81 0.13 2.61 1.02 -1.26 -5.06 119.74 119.74 1p6a s LYS 68 Ca 0.49 1.42 0.05 0.00 0.02 0.00 0.00 55.97 57.94 1p6a s LYS 68 Cb 0.27 -2.16 -0.04 0.00 -0.52 0.00 0.00 37.83 35.38 1p6a s LYS 68 CO 0.30 -0.44 -0.11 0.14 -0.92 0.00 0.00 175.35 174.33 1p6a s VAL 69 N -1.90 1.15 -1.63 3.17 -7.23 -1.26 -3.90 120.40 108.81 1p6a s VAL 69 Ca 0.66 -1.92 -0.16 0.00 -1.81 0.00 0.00 61.98 58.76 1p6a s VAL 69 Cb -0.18 -1.70 0.12 0.00 0.56 0.00 0.00 36.38 35.19 1p6a s VAL 69 CO 0.22 -0.65 0.84 0.47 -0.31 0.00 0.00 175.10 175.67 1p6a n ASP 70 N 0.08 -3.67 -4.70 4.85 9.92 -1.17 -4.92 116.55 116.92 1p6a n ASP 70 Ca -0.12 -0.93 -0.42 0.00 -0.53 0.00 0.00 54.79 52.79 1p6a n ASP 70 Cb 0.59 -3.19 -0.03 0.00 -0.64 0.00 0.00 41.12 37.85 1p6a n ASP 70 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 1p6a s GLN 71 N -6.79 4.42 0.29 -1.24 -1.52 -0.09 -4.68 119.66 110.04 1p6a s GLN 71 Ca 0.67 1.69 -0.29 0.00 -1.95 0.00 0.00 55.36 55.47 1p6a s GLN 71 Cb -0.35 -3.44 -0.10 0.00 -0.22 0.00 0.00 33.01 28.89 1p6a s GLN 71 CO 0.89 -0.30 1.37 0.08 -0.25 0.00 0.00 175.29 177.08 1p6a s VAL 72 N 1.49 2.71 -0.03 1.09 1.01 -1.26 -0.01 120.40 125.39 1p6a s VAL 72 Ca 0.57 0.65 -0.06 0.00 0.00 0.00 0.00 61.98 63.14 1p6a s VAL 72 Cb -0.27 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 1p6a s VAL 72 CO 0.26 0.13 -0.12 -0.38 0.00 0.00 0.00 175.10 174.99 1p6a n ILE 73 N 1.58 1.06 -3.75 2.22 5.41 0.59 -3.25 119.36 123.21 1p6a n ILE 73 Ca 0.03 0.17 -0.12 0.00 1.00 0.00 0.00 62.75 63.83 1p6a n ILE 73 Cb 0.41 -1.77 -0.07 0.00 -0.71 0.00 0.00 39.64 37.49 1p6a n ILE 73 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 1p6a s ILE 74 N -2.26 0.08 0.18 1.39 2.07 -1.22 -3.96 121.20 117.48 1p6a s ILE 74 Ca -0.11 -0.64 0.01 0.00 -1.41 0.00 0.00 60.65 58.50 1p6a s ILE 74 Cb 0.03 -0.89 -0.05 0.00 0.13 0.00 0.00 42.46 41.68 1p6a s ILE 74 CO 0.15 -0.35 0.02 -0.76 -1.91 0.00 0.00 174.94 172.09 1p6a s LEU 75 N -1.95 2.00 -0.31 8.50 1.43 0.34 -1.86 118.68 126.84 1p6a s LEU 75 Ca -0.06 -1.21 -0.02 0.00 -1.03 0.00 0.00 54.13 51.80 1p6a s LEU 75 Cb -0.01 -0.01 0.11 0.00 0.03 0.00 0.00 46.19 46.31 1p6a s LEU 75 CO -0.02 -0.61 0.16 -0.47 0.23 0.00 0.00 176.35 175.64 1p6a s TYR 76 N -3.70 0.52 -0.03 0.29 5.04 -0.21 -1.78 117.35 117.48 1p6a s TYR 76 Ca 0.26 -1.18 0.02 0.00 -2.44 0.00 0.00 57.07 53.73 1p6a s TYR 76 Cb 0.06 -0.94 0.01 0.00 0.35 0.00 0.00 41.96 41.44 1p6a s TYR 76 CO 0.05 -0.83 -0.07 0.45 -1.34 0.00 0.00 175.55 173.81 1p6a s SER 77 N 1.70 1.04 -1.37 4.32 0.15 -0.71 -1.69 113.70 117.15 1p6a s SER 77 Ca 0.12 -0.16 -0.07 0.00 0.70 0.00 0.00 55.95 56.55 1p6a s SER 77 Cb -0.19 -0.33 0.03 0.00 -1.71 0.00 0.00 66.02 63.83 1p6a s SER 77 CO -0.23 0.03 1.00 0.61 1.20 0.00 0.00 173.24 175.86 1p6a n GLY 78 N 3.45 -0.45 3.03 9.45 0.00 -1.26 -2.19 105.19 117.23 1p6a n GLY 78 Ca -0.20 0.18 -0.21 0.00 0.00 0.00 0.00 46.02 45.79 1p6a n GLY 78 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1p6a n ASP 79 N -3.00 -5.04 -3.89 1.61 9.92 -1.26 -4.98 116.55 109.91 1p6a n ASP 79 Ca -0.10 -0.25 -0.11 0.00 -0.53 0.00 0.00 54.79 53.80 1p6a n ASP 79 Cb 0.59 -4.13 -0.12 0.00 -0.64 0.00 0.00 41.12 36.83 1p6a n ASP 79 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1p6a s LYS 80 N -5.69 0.24 -0.04 -1.24 1.02 -0.93 -5.14 119.74 107.96 1p6a s LYS 80 Ca 0.28 -0.20 -0.19 0.00 0.02 0.00 0.00 55.97 55.89 1p6a s LYS 80 Cb -0.14 0.10 -0.05 0.00 -0.52 0.00 0.00 37.83 37.22 1p6a s LYS 80 CO 0.35 -0.04 0.53 0.42 -0.92 0.00 0.00 175.35 175.68 1p6a s ILE 81 N -0.68 5.02 -0.10 2.17 -1.09 -1.26 -1.73 121.20 123.53 1p6a s ILE 81 Ca -0.08 1.09 0.01 0.00 -2.23 0.00 0.00 60.65 59.44 1p6a s ILE 81 Cb -0.05 -3.86 0.02 0.00 -1.58 0.00 0.00 42.46 37.00 1p6a s ILE 81 CO 0.00 0.42 -0.10 -0.31 -1.23 0.00 0.00 174.94 173.71 1p6a s TYR 82 N -0.08 1.60 0.00 3.97 1.51 -0.73 -4.98 117.35 118.64 1p6a s TYR 82 Ca 0.28 -0.76 0.00 0.00 -1.01 0.00 0.00 57.07 55.58 1p6a s TYR 82 Cb -0.17 -1.25 0.00 0.00 -0.11 0.00 0.00 41.96 40.43 1p6a s TYR 82 CO 0.14 -0.46 0.00 -0.40 -1.11 0.00 0.00 175.55 173.72 1p6a n ASP 83 N 4.55 0.75 -2.66 2.29 5.68 -1.26 -0.50 116.55 125.39 1p6a n ASP 83 Ca -0.16 -0.77 -0.11 0.00 -0.50 0.00 0.00 54.79 53.24 1p6a n ASP 83 Cb 0.51 0.00 0.05 0.00 -1.14 0.00 0.00 41.12 40.54 1p6a n ASP 83 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1p6a n ASP 84 N -1.74 -3.98 -0.07 -1.12 8.00 -1.26 -4.97 116.55 111.41 1p6a n ASP 84 Ca 0.00 -0.45 -0.10 0.00 0.71 0.00 0.00 54.79 54.94 1p6a n ASP 84 Cb 0.00 -3.65 -0.06 0.00 -0.02 0.00 0.00 41.12 37.39 1p6a n ASP 84 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1p6a n TYR 85 N -2.83 0.00 -3.28 1.24 4.02 -1.25 -4.85 117.16 110.21 1p6a n TYR 85 Ca -0.10 0.00 -0.46 0.00 -0.01 0.00 0.00 57.90 57.33 1p6a n TYR 85 Cb 0.59 -0.52 -0.05 0.00 -0.02 0.00 0.00 39.34 39.34 1p6a n TYR 85 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 1p6a s TYR 86 N -2.27 3.21 0.22 -0.72 5.04 -1.20 -4.94 117.35 116.68 1p6a s TYR 86 Ca -0.19 -1.23 -0.10 0.00 -2.44 0.00 0.00 57.07 53.11 1p6a s TYR 86 Cb 0.05 -3.83 0.31 0.00 0.35 0.00 0.00 41.96 38.85 1p6a s TYR 86 CO 0.31 -1.06 1.67 -1.00 -1.34 0.00 0.00 175.55 174.13 1p6a h PRO 87 N 8.94 0.15 0.00 4.97 0.13 -1.93 -1.09 132.00 143.16 1p6a h PRO 87 Ca -0.30 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1p6a h PRO 87 Cb 1.10 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1p6a h PRO 87 CO 1.05 0.10 0.00 -0.25 -0.23 0.00 0.00 178.00 178.67 1p6a n ASP 88 N -5.24 0.11 -0.25 1.44 8.00 -1.26 -1.46 116.55 117.89 1p6a n ASP 88 Ca 0.09 0.55 0.02 0.00 0.71 0.00 0.00 54.79 56.16 1p6a n ASP 88 Cb 0.36 -0.56 0.06 0.00 -0.02 0.00 0.00 41.12 40.95 1p6a n ASP 88 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1p6a n LEU 89 N -1.64 2.30 -4.60 0.64 7.94 -0.43 -5.04 117.00 116.17 1p6a n LEU 89 Ca 0.00 -1.93 -0.47 0.00 -1.11 0.00 0.00 56.01 52.50 1p6a n LEU 89 Cb 0.04 -0.09 -0.03 0.00 0.53 0.00 0.00 43.42 43.87 1p6a n LEU 89 CO 0.04 0.57 0.75 1.17 -1.11 0.00 0.00 177.39 178.81 1p6a n LYS 90 N -0.07 1.37 -1.23 1.96 4.81 -0.54 -2.41 118.16 122.05 1p6a n LYS 90 Ca 0.04 0.49 -0.08 0.00 -0.87 0.00 0.00 58.31 57.89 1p6a n LYS 90 Cb 0.31 -1.99 -0.03 0.00 0.02 0.00 0.00 35.03 33.33 1p6a n LYS 90 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1p6a n GLY 91 N 1.88 0.75 0.00 3.14 0.00 -1.26 -4.78 105.19 104.92 1p6a n GLY 91 Ca 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1p6a n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p6a n ARG 92 N -0.30 1.45 -4.72 1.61 1.74 -1.01 -4.97 116.66 110.45 1p6a n ARG 92 Ca -0.08 -1.08 -0.29 0.00 -0.77 0.00 0.00 57.85 55.63 1p6a n ARG 92 Cb 0.57 -0.97 -0.17 0.00 -1.02 0.00 0.00 32.46 30.87 1p6a n ARG 92 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1p6a s VAL 93 N -0.60 1.63 -0.01 1.55 1.01 -1.25 -1.42 120.40 121.30 1p6a s VAL 93 Ca 0.00 -0.75 -0.15 0.00 0.00 0.00 0.00 61.98 61.09 1p6a s VAL 93 Cb 0.00 -1.45 0.02 0.00 0.00 0.00 0.00 36.38 34.95 1p6a s VAL 93 CO 0.00 0.47 0.31 -1.00 0.00 0.00 0.00 175.10 174.88 1p6a s HIS 94 N 0.71 -0.18 0.29 5.22 3.76 -1.18 -4.97 115.29 118.93 1p6a s HIS 94 Ca -0.12 0.27 -0.29 0.00 -0.15 0.00 0.00 55.06 54.77 1p6a s HIS 94 Cb -0.16 0.10 -0.10 0.00 1.11 0.00 0.00 32.58 33.53 1p6a s HIS 94 CO 0.03 -0.39 1.20 -0.06 -0.85 0.00 0.00 174.74 174.66 1p6a s PHE 95 N -1.33 3.34 0.08 1.40 0.40 -1.26 -1.04 117.98 119.57 1p6a s PHE 95 Ca -0.14 1.54 -0.10 0.00 -0.60 0.00 0.00 56.93 57.63 1p6a s PHE 95 Cb -0.05 -3.47 -0.24 0.00 0.51 0.00 0.00 43.02 39.76 1p6a s PHE 95 CO 0.04 -1.19 1.16 1.79 0.70 0.00 0.00 175.22 177.72 1p6a h THR 96 N 3.16 1.35 -4.11 0.64 1.35 -1.41 -3.46 112.91 110.43 1p6a h THR 96 Ca -0.47 -2.59 -0.46 0.00 -0.55 0.00 0.00 66.41 62.35 1p6a h THR 96 Cb 1.22 2.69 0.00 0.00 -1.73 0.00 0.00 68.15 70.33 1p6a h THR 96 CO 0.67 0.78 0.36 -0.55 -0.25 0.00 0.00 175.52 176.53 1p6a s SER 97 N -7.30 6.70 0.00 5.36 0.15 -1.26 -4.95 113.70 112.40 1p6a s SER 97 Ca -0.07 1.69 0.23 0.00 0.70 0.00 0.00 55.95 58.49 1p6a s SER 97 Cb 0.07 -2.53 0.49 0.00 -1.71 0.00 0.00 66.02 62.33 1p6a s SER 97 CO 0.91 -0.53 1.43 -0.46 1.20 0.00 0.00 173.24 175.80 1p6a n ASN 98 N -1.05 3.22 -3.27 5.45 6.94 -1.26 -4.60 115.26 120.69 1p6a n ASN 98 Ca 0.07 -1.96 -0.18 0.00 -0.02 0.00 0.00 54.58 52.49 1p6a n ASN 98 Cb 0.54 -0.25 -0.07 0.00 -2.36 0.00 0.00 39.78 37.63 1p6a n ASN 98 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1p6a s ASP 99 N -1.44 0.89 0.09 0.53 3.68 -1.26 -5.03 116.67 114.14 1p6a s ASP 99 Ca 0.38 -2.11 -0.29 0.00 2.13 0.00 0.00 52.55 52.67 1p6a s ASP 99 Cb 0.22 0.43 -0.13 0.00 -1.45 0.00 0.00 42.92 41.99 1p6a s ASP 99 CO 0.31 -0.20 1.64 -0.07 0.13 0.00 0.00 175.17 176.98 1p6a h LEU 100 N 6.26 -0.69 -1.80 -1.34 -0.00 -1.81 -2.77 115.31 113.16 1p6a h LEU 100 Ca 0.12 0.06 0.36 0.00 -0.00 0.00 0.00 57.88 58.42 1p6a h LEU 100 Cb 1.02 0.23 -0.07 0.00 -0.00 0.00 0.00 40.66 41.84 1p6a h LEU 100 CO 0.22 -0.39 0.87 0.11 -0.00 0.00 0.00 178.44 179.25 1p6a h LYS 101 N -0.58 0.09 -0.02 1.13 1.57 -1.96 0.23 116.57 117.04 1p6a h LYS 101 Ca -0.02 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1p6a h LYS 101 Cb 0.52 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 1p6a h LYS 101 CO -0.03 0.06 0.05 0.66 -0.57 0.00 0.00 179.45 179.62 1p6a h SER 102 N 0.10 0.00 0.00 0.86 4.64 -1.91 -3.45 113.55 113.79 1p6a h SER 102 Ca 0.63 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.95 1p6a h SER 102 Cb 2.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.36 1p6a h SER 102 CO -0.11 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.46 1p6a n GLY 103 N -1.20 1.77 2.76 -0.77 0.00 0.78 -4.99 105.19 103.55 1p6a n GLY 103 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 1p6a n GLY 103 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1p6a s ASP 104 N -1.77 1.79 -0.08 1.61 -1.08 -0.93 -0.26 116.67 115.94 1p6a s ASP 104 Ca 0.00 -0.20 0.12 0.00 -0.52 0.00 0.00 52.55 51.95 1p6a s ASP 104 Cb 0.00 -0.45 0.23 0.00 -1.46 0.00 0.00 42.92 41.24 1p6a s ASP 104 CO 0.00 -0.22 1.15 0.00 0.52 0.00 0.00 175.17 176.62 1p6a n ALA 105 N 5.14 2.27 -1.66 3.66 0.00 0.88 -4.27 120.51 126.53 1p6a n ALA 105 Ca -0.07 -1.93 -0.37 0.00 0.00 0.00 0.00 53.44 51.07 1p6a n ALA 105 Cb 0.50 -0.31 0.07 0.00 0.00 0.00 0.00 19.45 19.71 1p6a n ALA 105 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1p6a n SER 106 N -0.83 1.77 -4.34 0.00 7.64 -1.20 -4.72 113.62 111.95 1p6a n SER 106 Ca 0.11 0.80 -0.19 0.00 1.01 0.00 0.00 58.87 60.60 1p6a n SER 106 Cb 0.53 -1.53 -0.10 0.00 -1.01 0.00 0.00 64.21 62.10 1p6a n SER 106 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 1p6a s ILE 107 N -1.47 0.79 0.15 0.44 -4.36 -0.76 -1.10 121.20 114.89 1p6a s ILE 107 Ca 0.81 -2.00 0.10 0.00 -0.26 0.00 0.00 60.65 59.30 1p6a s ILE 107 Cb -0.38 -2.67 -0.04 0.00 1.25 0.00 0.00 42.46 40.62 1p6a s ILE 107 CO 0.42 0.00 -0.22 0.20 0.24 0.00 0.00 174.94 175.58 1p6a s ASN 108 N -3.40 2.99 -0.33 4.36 0.01 -0.20 -1.25 114.94 117.11 1p6a s ASN 108 Ca 0.36 -0.79 -0.01 0.00 -0.71 0.00 0.00 52.86 51.71 1p6a s ASN 108 Cb 0.08 -0.19 0.11 0.00 0.41 0.00 0.00 41.25 41.65 1p6a s ASN 108 CO 0.15 0.08 0.14 -0.69 -1.51 0.00 0.00 177.10 175.26 1p6a s VAL 109 N -1.50 0.73 0.37 1.60 1.01 -0.71 -3.12 120.40 118.79 1p6a s VAL 109 Ca 0.14 -1.52 -0.24 0.00 0.00 0.00 0.00 61.98 60.36 1p6a s VAL 109 Cb -0.08 -1.55 -0.10 0.00 0.00 0.00 0.00 36.38 34.64 1p6a s VAL 109 CO 0.07 -0.75 0.97 0.42 0.00 0.00 0.00 175.10 175.80 1p6a s THR 110 N 1.43 4.14 -1.13 3.92 -4.23 -0.51 -1.99 115.64 117.27 1p6a s THR 110 Ca 0.12 1.60 -0.11 0.00 -1.18 0.00 0.00 61.69 62.13 1p6a s THR 110 Cb -0.19 -3.81 -0.03 0.00 1.34 0.00 0.00 72.50 69.81 1p6a s THR 110 CO -0.20 -0.02 0.84 -3.20 -0.54 0.00 0.00 174.62 171.49 1p6a n ASN 111 N 0.05 -5.00 -4.60 3.99 4.05 -1.17 -4.87 115.26 107.72 1p6a n ASN 111 Ca 0.04 -0.85 -0.44 0.00 0.45 0.00 0.00 54.58 53.79 1p6a n ASN 111 Cb 0.51 -4.29 -0.01 0.00 1.23 0.00 0.00 39.78 37.22 1p6a n ASN 111 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1p6a n LEU 112 N -3.82 2.03 -4.32 1.20 4.77 -0.10 -4.57 117.00 112.18 1p6a n LEU 112 Ca -0.13 1.15 -0.17 0.00 -0.03 0.00 0.00 56.01 56.84 1p6a n LEU 112 Cb 0.62 -1.31 -0.10 0.00 -2.33 0.00 0.00 43.42 40.30 1p6a n LEU 112 CO 0.64 -1.37 -0.38 -1.10 -1.33 0.00 0.00 177.39 173.85 1p6a s GLN 113 N -1.65 1.28 0.55 3.23 -0.21 -1.26 -0.89 119.66 120.71 1p6a s GLN 113 Ca 0.59 -1.60 0.26 0.00 0.02 0.00 0.00 55.36 54.62 1p6a s GLN 113 Cb -0.66 -0.80 1.60 0.00 1.00 0.00 0.00 33.01 34.14 1p6a s GLN 113 CO 0.60 0.04 2.18 -0.07 -2.12 0.00 0.00 175.29 175.91 1p6a h LEU 114 N 2.56 0.00 -0.80 2.90 3.38 -1.95 -0.52 115.31 120.88 1p6a h LEU 114 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1p6a h LEU 114 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1p6a h LEU 114 CO 0.64 0.04 0.00 0.77 0.09 0.00 0.00 178.44 179.98 1p6a h SER 115 N 0.00 0.00 0.24 -0.43 4.64 -1.96 -3.02 113.55 113.02 1p6a h SER 115 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1p6a h SER 115 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1p6a h SER 115 CO 0.01 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.44 1p6a n ASP 116 N -2.51 0.00 -4.75 4.97 8.00 -0.20 -4.75 116.55 117.30 1p6a n ASP 116 Ca 0.02 -0.56 -0.41 0.00 0.71 0.00 0.00 54.79 54.55 1p6a n ASP 116 Cb 0.29 -0.13 -0.03 0.00 -0.02 0.00 0.00 41.12 41.23 1p6a n ASP 116 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1p6a s ILE 117 N -2.25 2.91 -5.00 0.53 1.01 -1.14 -4.90 121.20 112.36 1p6a s ILE 117 Ca 0.36 0.82 0.00 0.00 0.00 0.00 0.00 60.65 61.83 1p6a s ILE 117 Cb 0.20 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 39.15 1p6a s ILE 117 CO 0.38 0.15 0.00 0.61 0.00 0.00 0.00 174.94 176.08 1p6a n GLY 118 N 1.70 -2.30 3.59 6.18 0.00 -1.08 -1.15 105.19 112.13 1p6a n GLY 118 Ca 0.04 -1.37 -0.39 0.00 0.00 0.00 0.00 46.02 44.29 1p6a n GLY 118 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p6a s THR 119 N -2.09 5.18 -0.16 2.61 2.01 -0.86 -2.04 115.64 120.29 1p6a s THR 119 Ca 0.00 0.42 -0.09 0.00 0.31 0.00 0.00 61.69 62.32 1p6a s THR 119 Cb 0.00 -3.71 -0.05 0.00 0.01 0.00 0.00 72.50 68.75 1p6a s THR 119 CO 0.00 0.11 0.15 -0.31 -0.69 0.00 0.00 174.62 173.88 1p6a s TYR 120 N 2.04 3.50 -0.06 4.92 1.51 0.53 -1.19 117.35 128.61 1p6a s TYR 120 Ca 0.14 0.45 0.06 0.00 -1.01 0.00 0.00 57.07 56.70 1p6a s TYR 120 Cb -0.16 -2.09 -0.01 0.00 -0.11 0.00 0.00 41.96 39.59 1p6a s TYR 120 CO 0.11 0.48 -0.25 -1.14 -1.11 0.00 0.00 175.55 173.63 1p6a s GLN 121 N -0.23 2.51 -0.22 -0.62 0.74 0.10 -0.14 119.66 121.79 1p6a s GLN 121 Ca 0.12 -0.90 -0.04 0.00 0.05 0.00 0.00 55.36 54.59 1p6a s GLN 121 Cb -0.12 -2.13 -0.01 0.00 1.10 0.00 0.00 33.01 31.85 1p6a s GLN 121 CO 0.01 0.38 -0.03 0.00 -0.55 0.00 0.00 175.29 175.10 1p6a s LYS 123 N 1.43 3.27 -0.26 0.00 1.02 0.48 -1.27 119.74 124.43 1p6a s LYS 123 Ca 0.05 -0.69 -0.01 0.00 0.02 0.00 0.00 55.97 55.34 1p6a s LYS 123 Cb -0.14 -2.96 0.03 0.00 -0.52 0.00 0.00 37.83 34.24 1p6a s LYS 123 CO -0.02 -0.22 -0.05 0.08 -0.92 0.00 0.00 175.35 174.21 1p6a s VAL 124 N 1.44 2.87 0.02 3.17 1.01 -0.06 -1.47 120.40 127.39 1p6a s VAL 124 Ca 0.05 -1.12 0.07 0.00 0.00 0.00 0.00 61.98 60.98 1p6a s VAL 124 Cb -0.14 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.71 1p6a s VAL 124 CO -0.05 0.13 -0.20 -0.54 0.00 0.00 0.00 175.10 174.45 1p6a s LYS 125 N 1.30 1.45 -0.48 2.72 1.02 0.42 -1.50 119.74 124.67 1p6a s LYS 125 Ca -0.01 -0.85 0.07 0.00 0.02 0.00 0.00 55.97 55.20 1p6a s LYS 125 Cb -0.17 -1.50 0.19 0.00 -0.52 0.00 0.00 37.83 35.82 1p6a s LYS 125 CO -0.04 0.39 0.68 0.21 -0.92 0.00 0.00 175.35 175.67 1p6a s LYS 126 N -0.93 0.99 -0.03 1.68 2.20 -0.79 0.02 119.74 122.87 1p6a s LYS 126 Ca 0.07 -0.86 -0.16 0.00 -0.36 0.00 0.00 55.97 54.67 1p6a s LYS 126 Cb -0.08 -0.07 -0.08 0.00 -1.51 0.00 0.00 37.83 36.09 1p6a s LYS 126 CO 0.01 -1.29 0.45 0.00 -0.36 0.00 0.00 175.35 174.16 1p6a n ALA 127 N 3.41 -1.57 1.60 3.13 0.00 -1.26 -1.16 120.51 124.66 1p6a n ALA 127 Ca 0.16 0.23 0.11 0.00 0.00 0.00 0.00 53.44 53.94 1p6a n ALA 127 Cb 0.56 -0.70 0.51 0.00 0.00 0.00 0.00 19.45 19.82 1p6a n ALA 127 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1p6a n PRO 128 N 0.72 1.40 -2.28 0.00 -0.04 -1.26 -1.24 135.00 132.30 1p6a n PRO 128 Ca 0.08 -0.59 -0.35 0.00 -0.04 0.00 0.00 63.50 62.60 1p6a n PRO 128 Cb 0.02 -1.38 -0.00 0.00 -0.04 0.00 0.00 33.50 32.10 1p6a n PRO 128 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1p6a s GLY 129 N -1.67 2.64 -0.28 0.55 0.00 -0.31 -5.05 107.32 103.20 1p6a s GLY 129 Ca 0.33 0.82 -0.20 0.00 0.00 0.00 0.00 44.72 45.66 1p6a s GLY 129 CO 0.27 1.18 0.76 0.54 0.00 0.00 0.00 173.10 175.85 1p6a s VAL 130 N -1.77 0.00 0.06 1.40 0.11 -1.26 -1.89 120.40 117.05 1p6a s VAL 130 Ca 0.72 0.00 -0.11 0.00 -2.93 0.00 0.00 61.98 59.66 1p6a s VAL 130 Cb -0.24 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.62 1p6a s VAL 130 CO 0.27 0.00 0.25 0.00 -3.33 0.00 0.00 175.10 172.29 1p6a s ALA 131 N 0.99 -0.48 -0.02 1.54 0.00 -0.56 -4.97 121.76 118.25 1p6a s ALA 131 Ca -0.05 -0.27 -0.25 0.00 0.00 0.00 0.00 51.96 51.40 1p6a s ALA 131 Cb -0.05 0.39 0.05 0.00 0.00 0.00 0.00 23.12 23.52 1p6a s ALA 131 CO -0.10 -0.45 0.55 0.54 0.00 0.00 0.00 175.76 176.30 1p6a s ASN 132 N -2.37 -0.49 0.05 0.00 4.22 -1.26 -0.88 114.94 114.21 1p6a s ASN 132 Ca -0.01 0.46 0.04 0.00 -2.14 0.00 0.00 52.86 51.20 1p6a s ASN 132 Cb 0.01 0.47 -0.02 0.00 1.28 0.00 0.00 41.25 42.98 1p6a s ASN 132 CO -0.07 -0.58 -0.12 -0.75 -2.04 0.00 0.00 177.10 173.54 1p6a s LYS 133 N -1.43 0.75 -0.05 3.55 2.20 -0.39 -4.95 119.74 119.41 1p6a s LYS 133 Ca -0.11 -0.80 0.06 0.00 -0.36 0.00 0.00 55.97 54.76 1p6a s LYS 133 Cb -0.02 -0.69 -0.01 0.00 -1.51 0.00 0.00 37.83 35.60 1p6a s LYS 133 CO 0.07 0.16 -0.24 0.15 -0.36 0.00 0.00 175.35 175.12 1p6a s LYS 134 N -1.44 2.52 -0.09 4.03 1.02 -1.26 -0.91 119.74 123.61 1p6a s LYS 134 Ca -0.03 -0.89 0.02 0.00 0.02 0.00 0.00 55.97 55.09 1p6a s LYS 134 Cb -0.09 -2.17 0.01 0.00 -0.52 0.00 0.00 37.83 35.06 1p6a s LYS 134 CO 0.01 0.41 -0.15 0.42 -0.92 0.00 0.00 175.35 175.13 1p6a s ILE 135 N -0.23 1.37 -0.53 2.17 1.01 0.80 -2.89 121.20 122.89 1p6a s ILE 135 Ca -0.01 -0.60 -0.18 0.00 0.00 0.00 0.00 60.65 59.86 1p6a s ILE 135 Cb -0.13 -1.25 0.08 0.00 0.01 0.00 0.00 42.46 41.17 1p6a s ILE 135 CO 0.03 0.41 0.61 -1.00 0.00 0.00 0.00 174.94 174.99 1p6a s HIS 136 N 0.76 3.07 -0.15 3.97 3.76 -0.53 -0.35 115.29 125.83 1p6a s HIS 136 Ca -0.12 -0.78 -0.20 0.00 -0.15 0.00 0.00 55.06 53.82 1p6a s HIS 136 Cb -0.16 -3.66 -0.04 0.00 1.11 0.00 0.00 32.58 29.84 1p6a s HIS 136 CO 0.02 -1.09 0.56 -1.17 -0.85 0.00 0.00 174.74 172.21 1p6a s LEU 137 N 2.45 4.22 -0.06 0.89 2.96 -0.87 -1.43 118.68 126.84 1p6a s LEU 137 Ca 0.12 0.85 0.05 0.00 -0.22 0.00 0.00 54.13 54.93 1p6a s LEU 137 Cb -0.22 -2.80 -0.01 0.00 0.50 0.00 0.00 46.19 43.66 1p6a s LEU 137 CO 0.09 -0.12 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.08 1p6a s VAL 138 N 1.16 1.92 -0.13 1.68 1.01 -0.22 -2.63 120.40 123.18 1p6a s VAL 138 Ca 0.28 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.30 1p6a s VAL 138 Cb -0.16 -1.63 0.01 0.00 0.00 0.00 0.00 36.38 34.60 1p6a s VAL 138 CO 0.11 0.54 -0.21 -0.69 0.00 0.00 0.00 175.10 174.85 1p6a s VAL 139 N -0.05 1.96 -0.09 2.92 1.01 -1.25 -0.66 120.40 124.24 1p6a s VAL 139 Ca -0.06 -0.92 -0.03 0.00 0.00 0.00 0.00 61.98 60.97 1p6a s VAL 139 Cb -0.14 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 1p6a s VAL 139 CO 0.04 0.53 0.04 -0.76 0.00 0.00 0.00 175.10 174.95 1p6a s LEU 140 N 0.85 3.81 0.13 3.92 1.43 0.29 -4.82 118.68 124.28 1p6a s LEU 140 Ca -0.07 0.23 -0.27 0.00 -1.03 0.00 0.00 54.13 52.98 1p6a s LEU 140 Cb -0.15 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 1p6a s LEU 140 CO -0.02 0.38 1.60 -0.37 0.23 0.00 0.00 176.35 178.17 1p6a h VAL 141 N 4.04 0.24 -3.16 -1.59 -1.51 -1.97 -1.51 116.25 110.79 1p6a h VAL 141 Ca -0.52 0.00 -0.66 0.00 -1.23 0.00 0.00 66.70 64.29 1p6a h VAL 141 Cb 1.20 0.24 -0.14 0.00 -2.13 0.00 0.00 31.29 30.47 1p6a h VAL 141 CO 0.56 0.00 -0.58 -0.54 -1.23 0.00 0.00 177.57 175.78 1p6a s LYS 142 N -5.97 3.31 -0.91 5.19 1.02 -1.26 -4.38 119.74 116.75 1p6a s LYS 142 Ca -0.15 -0.34 -0.26 0.00 0.02 0.00 0.00 55.97 55.24 1p6a s LYS 142 Cb 0.10 -2.97 -0.16 0.00 -0.52 0.00 0.00 37.83 34.27 1p6a s LYS 142 CO 0.65 0.62 2.27 -2.14 -0.92 0.00 0.00 175.35 175.83 1p6a s PRO 143 N -0.61 1.52 -0.29 -1.68 0.02 -1.26 -4.84 135.00 127.85 1p6a s PRO 143 Ca 0.11 0.08 -0.15 0.00 0.02 0.00 0.00 61.00 61.06 1p6a s PRO 143 Cb -0.12 -4.88 0.12 0.00 0.02 0.00 0.00 34.50 29.65 1p6a s PRO 143 CO 0.02 -4.76 0.82 0.45 -0.33 0.00 0.00 177.00 173.20 1p6a s SER 144 N 9.79 -0.80 0.00 2.53 0.15 -1.26 -4.96 113.70 119.15 1p6a s SER 144 Ca 0.87 1.20 0.00 0.00 0.70 0.00 0.00 55.95 58.72 1p6a s SER 144 Cb -0.09 1.57 0.00 0.00 -1.71 0.00 0.00 66.02 65.79 1p6a s SER 144 CO 0.11 -0.18 0.44 0.61 1.20 0.00 0.00 173.24 175.41 1p6a n GLY 145 N 4.48 -0.28 3.69 9.45 0.00 -1.26 -5.03 105.19 116.23 1p6a n GLY 145 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1p6a n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32