#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j12 n LEU 20 N 0.00 3.35 -3.99 1.04 0.00 -1.26 -4.62 117.00 111.52 2j12 n LEU 20 Ca 0.00 1.08 -0.09 0.00 0.00 0.00 0.00 56.01 57.00 2j12 n LEU 20 Cb 0.00 -1.47 -0.08 0.00 0.00 0.00 0.00 43.42 41.87 2j12 n LEU 20 CO 0.00 -0.15 -0.18 -0.94 0.00 0.00 0.00 177.39 176.11 2j12 s SER 21 N 1.00 0.23 -0.03 1.96 1.04 -0.84 -4.57 113.70 112.48 2j12 s SER 21 Ca 0.78 -0.89 0.06 0.00 0.48 0.00 0.00 55.95 56.38 2j12 s SER 21 Cb -0.63 0.32 -0.01 0.00 0.10 0.00 0.00 66.02 65.80 2j12 s SER 21 CO 0.36 -0.73 -0.20 -0.63 0.98 0.00 0.00 173.24 173.03 2j12 s ILE 22 N -3.93 1.58 0.14 -1.02 1.01 -1.26 -0.66 121.20 117.06 2j12 s ILE 22 Ca 0.11 -0.83 -0.30 0.00 0.00 0.00 0.00 60.65 59.63 2j12 s ILE 22 Cb 0.06 -1.33 -0.08 0.00 0.01 0.00 0.00 42.46 41.13 2j12 s ILE 22 CO -0.06 0.45 1.25 -0.89 0.00 0.00 0.00 174.94 175.69 2j12 s THR 23 N -0.26 3.57 -0.97 2.92 2.01 -0.15 -3.68 115.64 119.08 2j12 s THR 23 Ca 0.03 1.22 -0.07 0.00 0.31 0.00 0.00 61.69 63.18 2j12 s THR 23 Cb -0.10 -3.78 -0.04 0.00 0.01 0.00 0.00 72.50 68.60 2j12 s THR 23 CO 0.01 0.15 0.82 0.41 -0.69 0.00 0.00 174.62 175.32 2j12 n THR 24 N 3.14 -8.55 0.28 -0.82 -1.04 -1.26 -4.66 114.28 101.37 2j12 n THR 24 Ca 0.07 -0.91 0.17 0.00 -2.04 0.00 0.00 64.05 61.34 2j12 n THR 24 Cb 0.44 -6.05 0.84 0.00 -1.82 0.00 0.00 70.33 63.74 2j12 n THR 24 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2j12 h PRO 25 N -0.77 0.00 -4.82 -2.82 0.13 -1.90 -3.35 132.00 118.47 2j12 h PRO 25 Ca -0.45 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.09 2j12 h PRO 25 Cb 1.24 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 32.03 2j12 h PRO 25 CO 0.41 0.00 -0.84 -2.00 -0.23 0.00 0.00 178.00 175.34 2j12 s GLU 26 N -3.77 2.26 -0.04 0.86 2.12 -1.26 -0.89 118.70 117.98 2j12 s GLU 26 Ca -0.02 -0.59 -0.03 0.00 0.36 0.00 0.00 54.97 54.68 2j12 s GLU 26 Cb 0.10 -1.85 0.01 0.00 0.26 0.00 0.00 34.13 32.65 2j12 s GLU 26 CO 0.37 0.02 0.10 -2.00 -0.54 0.00 0.00 175.26 173.21 2j12 s GLU 27 N 0.75 0.12 -0.09 4.30 2.12 -0.59 -5.01 118.70 120.29 2j12 s GLU 27 Ca -0.12 0.16 -0.00 0.00 0.36 0.00 0.00 54.97 55.37 2j12 s GLU 27 Cb -0.16 0.04 -0.03 0.00 0.26 0.00 0.00 34.13 34.24 2j12 s GLU 27 CO 0.02 -0.03 -0.06 1.41 -0.54 0.00 0.00 175.26 176.06 2j12 s MET 28 N 0.15 2.96 -0.05 4.30 -2.45 -1.26 -0.50 119.30 122.43 2j12 s MET 28 Ca -0.01 -0.55 0.02 0.00 -1.25 0.00 0.00 55.69 53.91 2j12 s MET 28 Cb -0.02 -2.66 0.01 0.00 1.25 0.00 0.00 34.83 33.42 2j12 s MET 28 CO -0.00 0.57 -0.10 0.42 1.05 0.00 0.00 175.02 176.96 2j12 s ILE 29 N -0.54 0.92 -0.02 10.11 1.01 -0.38 -4.95 121.20 127.35 2j12 s ILE 29 Ca 0.08 -0.36 0.08 0.00 0.00 0.00 0.00 60.65 60.44 2j12 s ILE 29 Cb -0.12 -0.86 -0.02 0.00 0.01 0.00 0.00 42.46 41.47 2j12 s ILE 29 CO 0.02 0.31 -0.25 -1.83 0.00 0.00 0.00 174.94 173.19 2j12 s GLU 30 N 0.68 2.16 0.08 2.79 -1.05 -1.26 -0.63 118.70 121.47 2j12 s GLU 30 Ca -0.13 -0.91 -0.07 0.00 -0.15 0.00 0.00 54.97 53.72 2j12 s GLU 30 Cb -0.15 -2.08 -0.01 0.00 -0.44 0.00 0.00 34.13 31.46 2j12 s GLU 30 CO 0.02 0.56 0.14 0.15 0.95 0.00 0.00 175.26 177.09 2j12 s LYS 31 N -0.62 0.81 0.32 -4.83 -0.14 -0.46 -4.98 119.74 109.85 2j12 s LYS 31 Ca 0.10 -1.04 -0.15 0.00 -1.36 0.00 0.00 55.97 53.52 2j12 s LYS 31 Cb -0.10 0.31 -0.09 0.00 -1.68 0.00 0.00 37.83 36.27 2j12 s LYS 31 CO -0.01 -0.24 0.74 0.00 -0.76 0.00 0.00 175.35 175.08 2j12 s ALA 32 N -3.88 3.32 0.19 5.17 0.00 -1.26 -0.86 121.76 124.44 2j12 s ALA 32 Ca 0.06 0.06 -0.32 0.00 0.00 0.00 0.00 51.96 51.76 2j12 s ALA 32 Cb 0.06 -2.78 -0.15 0.00 0.00 0.00 0.00 23.12 20.24 2j12 s ALA 32 CO -0.10 0.33 1.13 1.17 0.00 0.00 0.00 175.76 178.29 2j12 n LYS 33 N -0.30 1.17 0.00 0.00 4.81 0.45 -1.83 118.16 122.46 2j12 n LYS 33 Ca 0.03 0.41 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 2j12 n LYS 33 Cb 0.53 -1.89 0.00 0.00 0.02 0.00 0.00 35.03 33.69 2j12 n LYS 33 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2j12 n GLY 34 N 1.91 2.83 3.95 3.14 0.00 0.13 -4.90 105.19 112.25 2j12 n GLY 34 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 2j12 n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j12 s GLU 35 N -0.50 1.09 -0.22 1.61 2.02 -0.76 -4.09 118.70 117.85 2j12 s GLU 35 Ca 0.00 -0.61 -0.07 0.00 0.02 0.00 0.00 54.97 54.31 2j12 s GLU 35 Cb 0.00 -2.02 -0.03 0.00 0.10 0.00 0.00 34.13 32.18 2j12 s GLU 35 CO 0.00 -2.02 0.06 0.99 0.02 0.00 0.00 175.26 174.31 2j12 s THR 36 N -3.61 4.48 0.01 3.63 2.01 -1.26 -1.26 115.64 119.64 2j12 s THR 36 Ca 0.70 -0.13 -0.22 0.00 0.31 0.00 0.00 61.69 62.35 2j12 s THR 36 Cb -0.05 -3.06 -0.05 0.00 0.01 0.00 0.00 72.50 69.35 2j12 s THR 36 CO 0.50 0.39 0.67 0.00 -0.69 0.00 0.00 174.62 175.48 2j12 s ALA 37 N 1.10 3.43 -0.29 7.40 0.00 -0.23 -4.91 121.76 128.27 2j12 s ALA 37 Ca 0.04 0.13 -0.09 0.00 0.00 0.00 0.00 51.96 52.04 2j12 s ALA 37 Cb -0.14 -2.85 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 2j12 s ALA 37 CO 0.03 0.12 0.14 -0.47 0.00 0.00 0.00 175.76 175.58 2j12 s TYR 38 N -0.10 3.16 -0.49 0.00 5.04 -1.26 -1.27 117.35 122.43 2j12 s TYR 38 Ca 0.34 -0.38 -0.09 0.00 -2.44 0.00 0.00 57.07 54.50 2j12 s TYR 38 Cb -0.19 -2.34 0.12 0.00 0.35 0.00 0.00 41.96 39.91 2j12 s TYR 38 CO 0.19 -0.37 0.36 -0.51 -1.34 0.00 0.00 175.55 173.89 2j12 s LEU 39 N 1.65 5.71 0.25 6.97 1.43 0.59 -5.01 118.68 130.28 2j12 s LEU 39 Ca 0.06 -1.98 -0.30 0.00 -1.03 0.00 0.00 54.13 50.88 2j12 s LEU 39 Cb -0.16 -2.01 -0.09 0.00 0.03 0.00 0.00 46.19 43.96 2j12 s LEU 39 CO 0.07 -0.68 1.10 -2.84 0.23 0.00 0.00 176.35 174.23 2j12 s PRO 40 N 1.27 4.63 -0.42 1.29 0.02 -1.26 -1.99 135.00 138.53 2j12 s PRO 40 Ca 0.07 1.78 0.06 0.00 0.02 0.00 0.00 61.00 62.93 2j12 s PRO 40 Cb -0.26 -3.21 0.20 0.00 0.02 0.00 0.00 34.50 31.26 2j12 s PRO 40 CO -0.01 0.18 0.49 0.00 -0.33 0.00 0.00 177.00 177.32 2j12 s LYS 42 N -0.17 4.08 0.16 0.00 1.02 -1.26 -0.55 119.74 123.02 2j12 s LYS 42 Ca 0.33 -0.02 0.11 0.00 0.02 0.00 0.00 55.97 56.42 2j12 s LYS 42 Cb 0.09 -3.58 -0.04 0.00 -0.52 0.00 0.00 37.83 33.77 2j12 s LYS 42 CO -0.16 -0.09 -0.25 -0.59 -0.92 0.00 0.00 175.35 173.34 2j12 s PHE 43 N 1.51 2.27 -0.17 3.18 -0.12 -0.24 -0.98 117.98 123.42 2j12 s PHE 43 Ca 0.14 -0.37 0.01 0.00 -0.05 0.00 0.00 56.93 56.66 2j12 s PHE 43 Cb -0.15 -1.17 0.02 0.00 -0.63 0.00 0.00 43.02 41.09 2j12 s PHE 43 CO 0.08 0.42 -0.20 0.99 -0.05 0.00 0.00 175.22 176.46 2j12 s THR 44 N -1.42 2.06 0.43 -4.49 2.01 0.17 -4.53 115.64 109.86 2j12 s THR 44 Ca 0.17 -0.95 -0.13 0.00 0.31 0.00 0.00 61.69 61.10 2j12 s THR 44 Cb -0.09 -1.85 -0.07 0.00 0.01 0.00 0.00 72.50 70.50 2j12 s THR 44 CO 0.08 0.54 0.83 -0.76 -0.69 0.00 0.00 174.62 174.62 2j12 s LEU 45 N 1.22 3.80 0.30 4.42 1.43 -1.26 -1.99 118.68 126.59 2j12 s LEU 45 Ca 0.03 1.28 0.08 0.00 -1.03 0.00 0.00 54.13 54.50 2j12 s LEU 45 Cb -0.13 -4.17 -0.04 0.00 0.03 0.00 0.00 46.19 41.88 2j12 s LEU 45 CO -0.11 -0.43 0.14 -0.94 0.23 0.00 0.00 176.35 175.23 2j12 s SER 46 N -3.03 4.95 0.50 2.29 1.04 -1.26 -4.88 113.70 113.31 2j12 s SER 46 Ca 0.54 -0.56 0.25 0.00 0.48 0.00 0.00 55.95 56.66 2j12 s SER 46 Cb -0.10 -0.97 1.33 0.00 0.10 0.00 0.00 66.02 66.38 2j12 s SER 46 CO 0.30 -0.16 1.90 -0.65 0.98 0.00 0.00 173.24 175.61 2j12 h PRO 47 N 1.58 0.13 0.00 4.02 0.11 -1.99 -1.48 132.00 134.37 2j12 h PRO 47 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2j12 h PRO 47 Cb 1.25 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2j12 h PRO 47 CO 0.61 0.09 0.00 1.05 -0.21 0.00 0.00 178.00 179.54 2j12 h GLU 48 N 0.14 0.00 -4.71 1.05 4.11 -1.98 -3.41 114.58 109.78 2j12 h GLU 48 Ca 0.40 0.00 -0.71 0.00 0.07 0.00 0.00 59.36 59.12 2j12 h GLU 48 Cb 1.37 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.54 2j12 h GLU 48 CO -0.06 0.00 2.50 -0.25 0.07 0.00 0.00 179.01 181.27 2j12 n ASP 49 N -2.59 4.53 -0.44 3.06 8.00 -0.56 -4.30 116.55 124.25 2j12 n ASP 49 Ca 0.02 -2.91 0.09 0.00 0.71 0.00 0.00 54.79 52.70 2j12 n ASP 49 Cb 0.31 -1.67 0.00 0.00 -0.02 0.00 0.00 41.12 39.75 2j12 n ASP 49 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j12 n GLN 50 N 6.67 1.52 -0.30 -1.24 1.13 -1.17 -4.87 117.38 119.12 2j12 n GLN 50 Ca 0.48 -0.93 -0.05 0.00 -1.94 0.00 0.00 57.00 54.56 2j12 n GLN 50 Cb 0.42 -1.35 0.03 0.00 0.11 0.00 0.00 30.24 29.45 2j12 n GLN 50 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2j12 n GLY 51 N 1.24 -1.26 3.72 1.08 0.00 0.30 -4.96 105.19 105.32 2j12 n GLY 51 Ca 0.08 -1.67 -0.41 0.00 0.00 0.00 0.00 46.02 44.02 2j12 n GLY 51 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2j12 s PRO 52 N -3.47 4.57 0.20 1.61 0.04 -1.26 -4.52 135.00 132.17 2j12 s PRO 52 Ca 0.12 1.61 -0.30 0.00 0.04 0.00 0.00 61.00 62.47 2j12 s PRO 52 Cb -0.00 -3.35 -0.09 0.00 0.04 0.00 0.00 34.50 31.09 2j12 s PRO 52 CO 0.09 0.00 1.36 -1.17 0.04 0.00 0.00 177.00 177.32 2j12 s LEU 53 N 0.32 4.40 -0.04 -3.56 2.96 -1.26 -4.16 118.68 117.35 2j12 s LEU 53 Ca 0.52 2.46 -0.02 0.00 -0.22 0.00 0.00 54.13 56.87 2j12 s LEU 53 Cb -0.26 -3.61 0.03 0.00 0.50 0.00 0.00 46.19 42.85 2j12 s LEU 53 CO 0.31 -0.60 0.06 -0.62 -1.32 0.00 0.00 176.35 174.18 2j12 s ASP 54 N 0.49 1.10 -0.10 3.68 -1.08 0.27 -4.23 116.67 116.80 2j12 s ASP 54 Ca 0.59 0.09 0.03 0.00 -0.52 0.00 0.00 52.55 52.74 2j12 s ASP 54 Cb -0.38 -0.13 -0.00 0.00 -1.46 0.00 0.00 42.92 40.95 2j12 s ASP 54 CO 0.38 -0.25 -0.22 -0.63 0.52 0.00 0.00 175.17 174.98 2j12 s ILE 55 N 2.14 2.28 -0.05 4.11 -1.09 0.07 -0.80 121.20 127.87 2j12 s ILE 55 Ca 0.05 -0.94 0.02 0.00 -2.23 0.00 0.00 60.65 57.54 2j12 s ILE 55 Cb -0.12 -1.89 0.02 0.00 -1.58 0.00 0.00 42.46 38.89 2j12 s ILE 55 CO -0.03 0.55 -0.08 -0.70 -1.23 0.00 0.00 174.94 173.46 2j12 s GLU 56 N 0.30 1.17 -0.08 2.79 2.12 -0.27 -1.13 118.70 123.61 2j12 s GLU 56 Ca -0.16 -0.24 -0.01 0.00 0.36 0.00 0.00 54.97 54.93 2j12 s GLU 56 Cb -0.17 -1.05 -0.03 0.00 0.26 0.00 0.00 34.13 33.13 2j12 s GLU 56 CO 0.08 -0.03 -0.04 -1.58 -0.54 0.00 0.00 175.26 173.15 2j12 s TRP 57 N 0.77 3.03 0.13 5.30 0.52 -0.50 -0.35 118.94 127.84 2j12 s TRP 57 Ca -0.13 0.08 0.04 0.00 0.02 0.00 0.00 56.10 56.11 2j12 s TRP 57 Cb -0.15 -1.76 -0.04 0.00 -1.15 0.00 0.00 33.47 30.37 2j12 s TRP 57 CO 0.02 0.37 -0.09 -0.51 0.02 0.00 0.00 176.95 176.76 2j12 s LEU 58 N -0.78 2.52 0.05 2.99 1.02 -0.08 -0.54 118.68 123.86 2j12 s LEU 58 Ca 0.12 -1.01 0.07 0.00 0.02 0.00 0.00 54.13 53.34 2j12 s LEU 58 Cb -0.11 -0.25 -0.03 0.00 0.02 0.00 0.00 46.19 45.82 2j12 s LEU 58 CO 0.02 -0.37 -0.21 -0.51 0.02 0.00 0.00 176.35 175.30 2j12 s ILE 59 N -3.41 1.66 -0.36 -0.59 1.10 -0.21 -0.58 121.20 118.81 2j12 s ILE 59 Ca 0.15 -1.23 -0.19 0.00 -0.51 0.00 0.00 60.65 58.87 2j12 s ILE 59 Cb 0.03 -1.45 0.00 0.00 0.15 0.00 0.00 42.46 41.19 2j12 s ILE 59 CO -0.01 0.18 0.56 -0.44 -2.11 0.00 0.00 174.94 173.11 2j12 s SER 60 N -1.24 6.34 0.70 4.50 0.01 -0.72 -1.11 113.70 122.19 2j12 s SER 60 Ca 0.07 -0.03 -0.16 0.00 1.31 0.00 0.00 55.95 57.14 2j12 s SER 60 Cb -0.09 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.85 2j12 s SER 60 CO 0.02 -0.54 1.01 -2.65 0.41 0.00 0.00 173.24 171.49 2j12 n PRO 61 N 5.87 0.61 -0.03 12.44 -0.02 -1.26 -4.44 135.00 148.17 2j12 n PRO 61 Ca -0.04 0.26 0.06 0.00 -2.02 0.00 0.00 63.50 61.77 2j12 n PRO 61 Cb 0.49 -2.26 0.44 0.00 -0.02 0.00 0.00 33.50 32.15 2j12 n PRO 61 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2j12 h ALA 62 N -0.10 1.78 -1.68 3.55 0.00 -1.94 -3.36 119.26 117.51 2j12 h ALA 62 Ca -0.48 -0.02 -0.53 0.00 0.00 0.00 0.00 54.91 53.87 2j12 h ALA 62 Cb 1.34 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2j12 h ALA 62 CO 0.48 0.17 1.32 0.34 0.00 0.00 0.00 179.25 181.56 2j12 s ASP 63 N -6.56 5.54 0.22 0.00 2.15 -1.26 -4.86 116.67 111.91 2j12 s ASP 63 Ca -0.08 0.83 0.20 0.00 0.43 0.00 0.00 52.55 53.93 2j12 s ASP 63 Cb 0.18 -2.53 0.91 0.00 -0.30 0.00 0.00 42.92 41.18 2j12 s ASP 63 CO 0.74 -2.07 1.60 0.59 -0.17 0.00 0.00 175.17 175.86 2j12 n ASN 64 N 11.67 0.49 -0.37 -0.34 3.02 -1.26 -1.76 115.26 126.71 2j12 n ASN 64 Ca 0.22 0.66 0.12 0.00 -0.03 0.00 0.00 54.58 55.56 2j12 n ASN 64 Cb 0.50 -0.75 0.54 0.00 -0.61 0.00 0.00 39.78 39.45 2j12 n ASN 64 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2j12 n GLN 65 N -2.09 1.50 -4.33 3.52 1.13 -1.26 -4.84 117.38 111.01 2j12 n GLN 65 Ca 0.01 -0.74 -0.34 0.00 -1.94 0.00 0.00 57.00 53.99 2j12 n GLN 65 Cb 0.14 -1.43 -0.10 0.00 0.11 0.00 0.00 30.24 28.96 2j12 n GLN 65 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 2j12 s LYS 66 N -1.93 3.39 0.89 -1.09 2.20 -0.73 -5.11 119.74 117.38 2j12 s LYS 66 Ca 0.36 -0.44 -0.11 0.00 -0.36 0.00 0.00 55.97 55.42 2j12 s LYS 66 Cb 0.19 -2.90 0.13 0.00 -1.51 0.00 0.00 37.83 33.73 2j12 s LYS 66 CO 0.30 0.47 1.10 0.14 -0.36 0.00 0.00 175.35 176.99 2j12 s VAL 67 N -0.23 2.62 0.67 4.02 -7.23 -1.26 -4.61 120.40 114.38 2j12 s VAL 67 Ca 0.05 0.20 -0.17 0.00 -1.81 0.00 0.00 61.98 60.25 2j12 s VAL 67 Cb -0.12 -2.50 -0.01 0.00 0.56 0.00 0.00 36.38 34.30 2j12 s VAL 67 CO 0.02 -0.26 1.07 0.47 -0.31 0.00 0.00 175.10 176.09 2j12 n ASP 68 N -3.99 1.05 -4.35 4.85 8.00 -1.26 -4.58 116.55 116.26 2j12 n ASP 68 Ca 0.09 0.75 -0.31 0.00 0.71 0.00 0.00 54.79 56.03 2j12 n ASP 68 Cb 0.53 -1.45 -0.15 0.00 -0.02 0.00 0.00 41.12 40.03 2j12 n ASP 68 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2j12 s GLN 69 N -3.21 2.13 0.33 -1.24 -1.52 -0.26 -4.96 119.66 110.93 2j12 s GLN 69 Ca 0.77 -0.92 -0.28 0.00 -1.95 0.00 0.00 55.36 52.98 2j12 s GLN 69 Cb -0.37 -2.09 -0.10 0.00 -0.22 0.00 0.00 33.01 30.23 2j12 s GLN 69 CO 0.46 0.56 1.24 0.08 -0.25 0.00 0.00 175.29 177.38 2j12 s VAL 70 N -0.67 2.96 -0.17 1.09 1.01 -1.26 -1.04 120.40 122.32 2j12 s VAL 70 Ca 0.11 0.95 -0.13 0.00 0.00 0.00 0.00 61.98 62.90 2j12 s VAL 70 Cb -0.10 -3.59 -0.07 0.00 0.00 0.00 0.00 36.38 32.62 2j12 s VAL 70 CO -0.00 0.21 -0.28 -0.38 0.00 0.00 0.00 175.10 174.65 2j12 n ILE 71 N 0.79 1.34 -3.53 2.22 2.08 0.30 -1.82 119.36 120.73 2j12 n ILE 71 Ca 0.00 -0.05 -0.18 0.00 0.56 0.00 0.00 62.75 63.09 2j12 n ILE 71 Cb 0.43 -2.01 -0.06 0.00 -0.75 0.00 0.00 39.64 37.25 2j12 n ILE 71 CO 0.00 0.00 0.00 -0.51 0.56 0.00 0.00 176.55 176.60 2j12 s ILE 72 N -2.57 0.00 0.09 1.39 2.07 -1.21 -4.39 121.20 116.58 2j12 s ILE 72 Ca -0.27 -0.02 0.06 0.00 -1.41 0.00 0.00 60.65 59.02 2j12 s ILE 72 Cb 0.07 -0.98 -0.03 0.00 0.13 0.00 0.00 42.46 41.65 2j12 s ILE 72 CO 0.36 -0.01 -0.16 -0.76 -1.91 0.00 0.00 174.94 172.46 2j12 s LEU 73 N -1.14 2.31 -0.17 8.50 1.43 0.02 -1.41 118.68 128.22 2j12 s LEU 73 Ca -0.11 -0.68 0.01 0.00 -1.03 0.00 0.00 54.13 52.32 2j12 s LEU 73 Cb -0.00 -0.64 0.03 0.00 0.03 0.00 0.00 46.19 45.60 2j12 s LEU 73 CO 0.09 -0.05 -0.14 -0.47 0.23 0.00 0.00 176.35 176.02 2j12 s TYR 74 N -1.40 2.36 -0.18 0.29 5.04 -0.28 -1.48 117.35 121.69 2j12 s TYR 74 Ca 0.03 -1.43 -0.13 0.00 -2.44 0.00 0.00 57.07 53.10 2j12 s TYR 74 Cb -0.09 -1.66 0.05 0.00 0.35 0.00 0.00 41.96 40.61 2j12 s TYR 74 CO 0.03 -0.72 0.46 0.45 -1.34 0.00 0.00 175.55 174.43 2j12 s SER 75 N 1.42 -0.54 -1.58 4.32 0.15 -0.13 -0.75 113.70 116.59 2j12 s SER 75 Ca 0.03 0.97 -0.15 0.00 0.70 0.00 0.00 55.95 57.50 2j12 s SER 75 Cb -0.14 0.91 0.10 0.00 -1.71 0.00 0.00 66.02 65.18 2j12 s SER 75 CO -0.10 -0.18 0.92 0.61 1.20 0.00 0.00 173.24 175.68 2j12 n GLY 76 N 3.61 -0.47 2.45 9.45 0.00 -1.26 -1.46 105.19 117.51 2j12 n GLY 76 Ca -0.18 0.18 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 2j12 n GLY 76 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2j12 n ASP 77 N -2.79 -5.36 -4.22 1.61 8.00 -1.26 -4.99 116.55 107.55 2j12 n ASP 77 Ca 0.04 0.25 -0.22 0.00 0.71 0.00 0.00 54.79 55.58 2j12 n ASP 77 Cb 0.52 -4.62 -0.13 0.00 -0.02 0.00 0.00 41.12 36.88 2j12 n ASP 77 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2j12 s LYS 78 N -4.33 1.05 -0.19 -1.24 2.20 -0.53 -5.14 119.74 111.55 2j12 s LYS 78 Ca 0.00 -0.98 -0.11 0.00 -0.36 0.00 0.00 55.97 54.53 2j12 s LYS 78 Cb 0.00 -1.17 -0.05 0.00 -1.51 0.00 0.00 37.83 35.10 2j12 s LYS 78 CO 0.00 0.28 0.15 0.42 -0.36 0.00 0.00 175.35 175.84 2j12 s ILE 79 N -1.05 5.39 -0.20 5.43 1.01 -1.26 -0.96 121.20 129.56 2j12 s ILE 79 Ca 0.03 0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.93 2j12 s ILE 79 Cb -0.09 -3.49 0.02 0.00 0.01 0.00 0.00 42.46 38.90 2j12 s ILE 79 CO 0.03 0.43 -0.16 -0.31 0.00 0.00 0.00 174.94 174.93 2j12 s TYR 80 N 0.38 2.88 -0.04 3.97 2.02 -0.55 -4.99 117.35 121.02 2j12 s TYR 80 Ca 0.09 -1.63 0.06 0.00 -0.37 0.00 0.00 57.07 55.22 2j12 s TYR 80 Cb -0.11 -1.96 0.08 0.00 -0.40 0.00 0.00 41.96 39.57 2j12 s TYR 80 CO -0.01 -0.78 0.94 -0.40 -1.57 0.00 0.00 175.55 173.74 2j12 n ASP 81 N 4.63 1.35 -3.55 2.29 5.68 -1.26 -0.80 116.55 124.88 2j12 n ASP 81 Ca -0.19 -2.12 -0.41 0.00 -0.50 0.00 0.00 54.79 51.57 2j12 n ASP 81 Cb 0.49 -0.16 -0.01 0.00 -1.14 0.00 0.00 41.12 40.30 2j12 n ASP 81 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2j12 n ASP 82 N -0.59 7.14 0.00 -1.12 5.75 -1.26 -4.81 116.55 121.67 2j12 n ASP 82 Ca 0.05 -2.97 0.00 0.00 -0.01 0.00 0.00 54.79 51.86 2j12 n ASP 82 Cb 0.49 -1.47 0.00 0.00 -1.03 0.00 0.00 41.12 39.12 2j12 n ASP 82 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 2j12 n TYR 83 N 3.10 0.00 -1.27 2.11 4.01 -1.26 -5.04 117.16 118.81 2j12 n TYR 83 Ca 0.60 0.00 -0.49 0.00 -0.16 0.00 0.00 57.90 57.85 2j12 n TYR 83 Cb 0.28 0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.19 2j12 n TYR 83 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 2j12 n TYR 84 N 0.00 0.87 -0.35 -0.72 9.36 -0.76 -4.83 117.16 120.73 2j12 n TYR 84 Ca 0.00 0.58 0.09 0.00 3.32 0.00 0.00 57.90 61.89 2j12 n TYR 84 Cb 0.00 -2.19 0.27 0.00 -0.63 0.00 0.00 39.34 36.78 2j12 n TYR 84 CO 0.00 0.00 0.00 -1.35 0.22 0.00 0.00 176.86 175.73 2j12 h PRO 85 N 9.60 0.83 0.00 2.98 0.11 -1.96 -1.93 132.00 141.63 2j12 h PRO 85 Ca -0.08 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.98 2j12 h PRO 85 Cb 1.30 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 2j12 h PRO 85 CO 1.14 0.55 -0.01 -0.44 -0.21 0.00 0.00 178.00 179.02 2j12 h ASP 86 N 0.85 0.00 -0.01 -2.05 3.32 -2.01 -2.40 116.42 114.12 2j12 h ASP 86 Ca 0.52 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.57 2j12 h ASP 86 Cb 0.66 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.21 2j12 h ASP 86 CO -0.32 0.01 -0.37 0.18 -1.72 0.00 0.00 179.24 177.02 2j12 n LEU 87 N -3.23 1.39 -4.65 1.55 4.77 -0.76 -4.97 117.00 111.09 2j12 n LEU 87 Ca -0.02 -0.72 -0.51 0.00 -0.03 0.00 0.00 56.01 54.73 2j12 n LEU 87 Cb 0.13 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.17 2j12 n LEU 87 CO 0.23 0.27 1.17 1.17 -1.33 0.00 0.00 177.39 178.90 2j12 n LYS 88 N -0.36 1.56 0.00 3.23 3.00 -0.91 -0.65 118.16 124.04 2j12 n LYS 88 Ca 0.06 0.57 0.00 0.00 -0.00 0.00 0.00 58.31 58.93 2j12 n LYS 88 Cb 0.30 -2.28 0.00 0.00 0.00 0.00 0.00 35.03 33.04 2j12 n LYS 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2j12 n GLY 89 N 3.43 2.55 0.16 3.14 0.00 -1.26 -4.83 105.19 108.38 2j12 n GLY 89 Ca 0.21 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.30 2j12 n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j12 n ARG 90 N -2.00 1.84 -5.03 1.61 1.74 0.18 -4.95 116.66 110.05 2j12 n ARG 90 Ca 0.00 -0.36 -0.32 0.00 -0.77 0.00 0.00 57.85 56.40 2j12 n ARG 90 Cb 0.00 -1.24 -0.16 0.00 -1.02 0.00 0.00 32.46 30.04 2j12 n ARG 90 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2j12 s VAL 91 N -2.20 2.52 -0.04 1.55 1.01 -1.20 -1.36 120.40 120.69 2j12 s VAL 91 Ca 0.09 -0.86 -0.08 0.00 0.00 0.00 0.00 61.98 61.13 2j12 s VAL 91 Cb 0.12 -2.00 0.01 0.00 0.00 0.00 0.00 36.38 34.51 2j12 s VAL 91 CO 0.53 0.55 0.18 -1.00 0.00 0.00 0.00 175.10 175.36 2j12 s HIS 92 N 0.19 -0.11 0.28 5.22 3.76 -1.01 -4.99 115.29 118.63 2j12 s HIS 92 Ca -0.11 0.25 -0.30 0.00 -0.15 0.00 0.00 55.06 54.75 2j12 s HIS 92 Cb -0.16 0.03 -0.10 0.00 1.11 0.00 0.00 32.58 33.46 2j12 s HIS 92 CO 0.06 -0.20 1.39 -0.06 -0.85 0.00 0.00 174.74 175.09 2j12 s PHE 93 N -0.59 3.02 -0.11 1.40 0.08 -1.26 -1.10 117.98 119.41 2j12 s PHE 93 Ca -0.07 1.16 0.16 0.00 0.12 0.00 0.00 56.93 58.30 2j12 s PHE 93 Cb -0.04 -3.78 -0.19 0.00 -0.57 0.00 0.00 43.02 38.44 2j12 s PHE 93 CO 0.01 -2.40 0.63 0.25 -0.10 0.00 0.00 175.22 173.61 2j12 n THR 94 N 1.80 1.27 -2.69 0.64 -2.24 -0.80 -4.89 114.28 107.36 2j12 n THR 94 Ca 0.04 -0.74 -0.38 0.00 -2.27 0.00 0.00 64.05 60.71 2j12 n THR 94 Cb 0.41 -0.73 -0.06 0.00 -2.10 0.00 0.00 70.33 67.85 2j12 n THR 94 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2j12 s SER 95 N -5.74 7.24 0.00 3.42 0.15 -1.26 -4.94 113.70 112.58 2j12 s SER 95 Ca -0.05 1.94 0.20 0.00 0.70 0.00 0.00 55.95 58.74 2j12 s SER 95 Cb 0.08 -2.59 0.86 0.00 -1.71 0.00 0.00 66.02 62.66 2j12 s SER 95 CO 0.82 -0.14 1.59 -0.46 1.20 0.00 0.00 173.24 176.26 2j12 n ASN 96 N 0.61 1.07 -2.88 5.45 0.23 -1.26 -4.32 115.26 114.15 2j12 n ASN 96 Ca 0.02 -1.62 -0.12 0.00 -0.53 0.00 0.00 54.58 52.33 2j12 n ASN 96 Cb 0.49 -0.07 0.04 0.00 -2.08 0.00 0.00 39.78 38.16 2j12 n ASN 96 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2j12 n ASP 97 N -0.07 -1.64 -0.29 0.53 2.03 -1.26 -5.02 116.55 110.83 2j12 n ASP 97 Ca 0.15 -3.33 0.01 0.00 0.52 0.00 0.00 54.79 52.15 2j12 n ASP 97 Cb 0.23 1.12 0.14 0.00 -0.72 0.00 0.00 41.12 41.90 2j12 n ASP 97 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 2j12 h LEU 98 N 3.45 0.72 -2.40 -2.67 6.46 -1.75 -2.14 115.31 116.98 2j12 h LEU 98 Ca -0.06 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.73 2j12 h LEU 98 Cb 1.03 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.84 2j12 h LEU 98 CO 0.30 0.44 0.00 0.07 -0.62 0.00 0.00 178.44 178.63 2j12 h LYS 99 N 0.85 0.00 -0.02 1.25 2.10 -1.95 -0.92 116.57 117.87 2j12 h LYS 99 Ca 0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.02 2j12 h LYS 99 Cb 0.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.58 2j12 h LYS 99 CO -0.20 0.00 0.00 -1.13 -2.00 0.00 0.00 179.45 176.12 2j12 n SER 100 N -2.83 0.48 0.00 7.07 3.41 -0.80 -4.84 113.62 116.10 2j12 n SER 100 Ca -0.02 -1.26 0.00 0.00 -0.26 0.00 0.00 58.87 57.32 2j12 n SER 100 Cb 0.08 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 2j12 n SER 100 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2j12 n GLY 101 N 1.00 1.57 2.59 5.00 0.00 -0.46 -4.99 105.19 109.91 2j12 n GLY 101 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 2j12 n GLY 101 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2j12 s ASP 102 N -1.57 3.48 -0.18 1.61 -1.08 -0.57 -1.08 116.67 117.27 2j12 s ASP 102 Ca 0.00 -1.93 0.15 0.00 -0.52 0.00 0.00 52.55 50.24 2j12 s ASP 102 Cb 0.00 -0.62 0.75 0.00 -1.46 0.00 0.00 42.92 41.59 2j12 s ASP 102 CO 0.00 -0.36 1.65 0.00 0.52 0.00 0.00 175.17 176.98 2j12 n ALA 103 N 4.42 3.56 -1.58 3.66 0.00 0.29 -4.29 120.51 126.57 2j12 n ALA 103 Ca 0.04 -1.70 -0.35 0.00 0.00 0.00 0.00 53.44 51.43 2j12 n ALA 103 Cb 0.39 -1.09 0.07 0.00 0.00 0.00 0.00 19.45 18.81 2j12 n ALA 103 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2j12 s SER 104 N -0.78 4.66 0.15 0.00 0.01 -1.24 -4.59 113.70 111.92 2j12 s SER 104 Ca 0.51 2.40 0.06 0.00 1.31 0.00 0.00 55.95 60.23 2j12 s SER 104 Cb 0.37 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.96 2j12 s SER 104 CO 0.18 -1.95 -0.14 0.27 0.41 0.00 0.00 173.24 172.01 2j12 s ILE 105 N -1.75 1.47 0.28 1.44 -4.36 -0.84 -1.91 121.20 115.52 2j12 s ILE 105 Ca 0.77 -1.91 0.10 0.00 -0.26 0.00 0.00 60.65 59.35 2j12 s ILE 105 Cb -0.31 -1.74 -0.05 0.00 1.25 0.00 0.00 42.46 41.61 2j12 s ILE 105 CO 0.40 -0.49 -0.07 0.54 0.24 0.00 0.00 174.94 175.56 2j12 s ASN 106 N -2.79 4.19 -0.17 4.36 2.20 -0.26 -0.30 114.94 122.17 2j12 s ASN 106 Ca 0.14 -0.81 -0.00 0.00 -0.94 0.00 0.00 52.86 51.25 2j12 s ASN 106 Cb -0.03 -0.63 0.04 0.00 -2.00 0.00 0.00 41.25 38.63 2j12 s ASN 106 CO 0.04 -0.02 -0.07 -0.69 -2.94 0.00 0.00 177.10 173.43 2j12 s VAL 107 N -2.41 1.25 0.47 3.54 1.01 -0.40 -2.39 120.40 121.48 2j12 s VAL 107 Ca 0.31 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.56 2j12 s VAL 107 Cb -0.05 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 2j12 s VAL 107 CO 0.18 0.16 0.73 0.42 0.00 0.00 0.00 175.10 176.59 2j12 s THR 108 N 1.57 4.32 -1.14 3.92 -4.23 -0.46 -1.06 115.64 118.56 2j12 s THR 108 Ca 0.01 -0.22 -0.28 0.00 -1.18 0.00 0.00 61.69 60.01 2j12 s THR 108 Cb -0.15 -3.63 0.04 0.00 1.34 0.00 0.00 72.50 70.10 2j12 s THR 108 CO -0.08 -0.52 0.67 -3.20 -0.54 0.00 0.00 174.62 170.95 2j12 n ASN 109 N -2.18 -4.30 -4.67 3.99 4.05 -1.13 -4.81 115.26 106.21 2j12 n ASN 109 Ca 0.01 -1.24 -0.44 0.00 0.45 0.00 0.00 54.58 53.36 2j12 n ASN 109 Cb 0.57 -1.68 -0.02 0.00 1.23 0.00 0.00 39.78 39.88 2j12 n ASN 109 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 2j12 n LEU 110 N -4.60 3.14 -4.60 1.20 4.77 -0.39 -4.64 117.00 111.88 2j12 n LEU 110 Ca -0.15 1.17 -0.25 0.00 -0.03 0.00 0.00 56.01 56.74 2j12 n LEU 110 Cb 0.59 -1.43 -0.08 0.00 -2.33 0.00 0.00 43.42 40.16 2j12 n LEU 110 CO 0.72 -0.56 -0.38 -1.10 -1.33 0.00 0.00 177.39 174.75 2j12 s GLN 111 N -0.96 2.16 0.51 3.23 -0.21 -1.26 -0.69 119.66 122.44 2j12 s GLN 111 Ca 0.63 -1.31 0.18 0.00 0.02 0.00 0.00 55.36 54.89 2j12 s GLN 111 Cb -0.63 -2.17 1.27 0.00 1.00 0.00 0.00 33.01 32.48 2j12 s GLN 111 CO 0.54 0.41 2.08 -0.07 -2.12 0.00 0.00 175.29 176.14 2j12 h LEU 112 N 2.56 0.05 0.00 2.90 3.38 -1.95 -0.77 115.31 121.48 2j12 h LEU 112 Ca -0.46 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2j12 h LEU 112 Cb 1.22 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2j12 h LEU 112 CO 0.57 0.03 0.00 -1.54 0.09 0.00 0.00 178.44 177.59 2j12 n SER 113 N -4.48 0.00 -0.03 -0.43 3.41 -1.26 -2.31 113.62 108.52 2j12 n SER 113 Ca 0.02 0.45 0.14 0.00 -0.26 0.00 0.00 58.87 59.23 2j12 n SER 113 Cb 0.28 -0.47 0.66 0.00 -0.26 0.00 0.00 64.21 64.42 2j12 n SER 113 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2j12 n ASP 114 N -1.47 0.17 -4.70 4.04 8.00 -0.29 -4.86 116.55 117.44 2j12 n ASP 114 Ca 0.04 -0.17 -0.44 0.00 0.71 0.00 0.00 54.79 54.93 2j12 n ASP 114 Cb 0.15 -0.22 -0.03 0.00 -0.02 0.00 0.00 41.12 40.99 2j12 n ASP 114 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2j12 n ILE 115 N -1.24 0.34 -1.96 0.53 5.41 -0.98 -4.89 119.36 116.58 2j12 n ILE 115 Ca 0.13 -0.08 0.00 0.00 1.00 0.00 0.00 62.75 63.79 2j12 n ILE 115 Cb 0.27 -1.74 0.00 0.00 -0.71 0.00 0.00 39.64 37.46 2j12 n ILE 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2j12 n GLY 116 N 3.16 -2.09 3.58 7.39 0.00 -0.98 -4.85 105.19 111.39 2j12 n GLY 116 Ca 0.14 -1.25 -0.36 0.00 0.00 0.00 0.00 46.02 44.56 2j12 n GLY 116 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2j12 s THR 117 N -2.50 4.78 -0.05 2.61 2.01 -1.26 -0.97 115.64 120.26 2j12 s THR 117 Ca 0.00 -0.02 0.01 0.00 0.31 0.00 0.00 61.69 61.98 2j12 s THR 117 Cb 0.00 -3.20 -0.03 0.00 0.01 0.00 0.00 72.50 69.28 2j12 s THR 117 CO 0.00 0.39 -0.04 -0.31 -0.69 0.00 0.00 174.62 173.96 2j12 s TYR 118 N 0.97 2.99 -0.07 4.92 2.02 0.24 -1.75 117.35 126.67 2j12 s TYR 118 Ca 0.05 0.05 0.04 0.00 -0.37 0.00 0.00 57.07 56.84 2j12 s TYR 118 Cb -0.14 -1.70 0.00 0.00 -0.40 0.00 0.00 41.96 39.72 2j12 s TYR 118 CO 0.03 0.39 -0.19 -1.14 -1.57 0.00 0.00 175.55 173.07 2j12 s GLN 119 N -1.06 2.23 -0.21 -0.62 0.74 0.25 -0.47 119.66 120.52 2j12 s GLN 119 Ca 0.15 -0.67 -0.05 0.00 0.05 0.00 0.00 55.36 54.83 2j12 s GLN 119 Cb -0.11 -1.81 -0.02 0.00 1.10 0.00 0.00 33.01 32.17 2j12 s GLN 119 CO 0.04 0.18 0.01 0.00 -0.55 0.00 0.00 175.29 174.97 2j12 s LYS 121 N 1.18 3.26 -0.17 0.00 1.02 0.53 -0.59 119.74 124.98 2j12 s LYS 121 Ca 0.03 -0.70 -0.00 0.00 0.02 0.00 0.00 55.97 55.32 2j12 s LYS 121 Cb -0.14 -2.80 -0.00 0.00 -0.52 0.00 0.00 37.83 34.36 2j12 s LYS 121 CO 0.01 -0.12 -0.14 0.08 -0.92 0.00 0.00 175.35 174.27 2j12 s VAL 122 N 1.19 2.75 -0.01 3.17 1.01 -0.44 -1.11 120.40 126.95 2j12 s VAL 122 Ca 0.02 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.29 2j12 s VAL 122 Cb -0.14 -2.18 -0.01 0.00 0.00 0.00 0.00 36.38 34.06 2j12 s VAL 122 CO -0.04 0.50 -0.10 -0.54 0.00 0.00 0.00 175.10 174.92 2j12 s LYS 123 N 0.93 0.88 -0.42 2.72 1.02 0.02 -1.31 119.74 123.59 2j12 s LYS 123 Ca -0.03 -0.36 0.05 0.00 0.02 0.00 0.00 55.97 55.65 2j12 s LYS 123 Cb -0.15 -0.84 0.17 0.00 -0.52 0.00 0.00 37.83 36.49 2j12 s LYS 123 CO -0.02 0.20 0.51 0.21 -0.92 0.00 0.00 175.35 175.34 2j12 s LYS 124 N -0.16 0.81 0.13 1.68 2.20 -0.00 -0.56 119.74 123.84 2j12 s LYS 124 Ca 0.03 -0.89 -0.34 0.00 -0.36 0.00 0.00 55.97 54.41 2j12 s LYS 124 Cb -0.05 -0.44 -0.17 0.00 -1.51 0.00 0.00 37.83 35.66 2j12 s LYS 124 CO -0.00 -1.24 1.13 0.00 -0.36 0.00 0.00 175.35 174.88 2j12 n ALA 125 N 3.86 -1.39 1.73 3.13 0.00 -1.26 -0.86 120.51 125.73 2j12 n ALA 125 Ca 0.15 0.49 0.10 0.00 0.00 0.00 0.00 53.44 54.17 2j12 n ALA 125 Cb 0.51 -1.97 0.48 0.00 0.00 0.00 0.00 19.45 18.47 2j12 n ALA 125 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2j12 n PRO 126 N 1.80 1.25 -2.47 0.00 -0.04 -1.26 -0.54 135.00 133.75 2j12 n PRO 126 Ca 0.17 -0.38 -0.40 0.00 -0.04 0.00 0.00 63.50 62.85 2j12 n PRO 126 Cb 0.21 -1.32 -0.04 0.00 -0.04 0.00 0.00 33.50 32.31 2j12 n PRO 126 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2j12 s GLY 127 N -1.56 3.00 -0.08 0.55 0.00 -0.04 -5.05 107.32 104.14 2j12 s GLY 127 Ca 0.29 0.88 -0.14 0.00 0.00 0.00 0.00 44.72 45.74 2j12 s GLY 127 CO 0.23 1.45 0.36 -1.34 0.00 0.00 0.00 173.10 173.80 2j12 s VAL 128 N -1.25 0.02 0.04 1.40 -7.23 -1.26 -0.82 120.40 111.30 2j12 s VAL 128 Ca 0.47 -0.20 -0.24 0.00 -1.81 0.00 0.00 61.98 60.20 2j12 s VAL 128 Cb -0.30 -0.58 0.06 0.00 0.56 0.00 0.00 36.38 36.11 2j12 s VAL 128 CO 0.39 -0.11 0.56 0.00 -0.31 0.00 0.00 175.10 175.63 2j12 s ALA 129 N -0.49 -1.45 0.07 1.32 0.00 -0.43 -4.69 121.76 116.10 2j12 s ALA 129 Ca -0.06 0.73 -0.02 0.00 0.00 0.00 0.00 51.96 52.61 2j12 s ALA 129 Cb -0.04 0.36 -0.03 0.00 0.00 0.00 0.00 23.12 23.41 2j12 s ALA 129 CO 0.02 -0.51 0.02 -0.80 0.00 0.00 0.00 175.76 174.50 2j12 s ASN 130 N -1.89 0.40 0.00 0.00 0.01 -1.26 -1.32 114.94 110.88 2j12 s ASN 130 Ca -0.06 -0.99 0.01 0.00 -0.71 0.00 0.00 52.86 51.12 2j12 s ASN 130 Cb -0.01 0.24 -0.01 0.00 0.41 0.00 0.00 41.25 41.88 2j12 s ASN 130 CO -0.01 -0.64 -0.05 -0.75 -1.51 0.00 0.00 177.10 174.14 2j12 s LYS 131 N -3.93 0.36 -0.06 -0.60 2.20 0.24 -4.87 119.74 113.07 2j12 s LYS 131 Ca 0.10 -0.25 0.05 0.00 -0.36 0.00 0.00 55.97 55.50 2j12 s LYS 131 Cb 0.07 -0.31 -0.02 0.00 -1.51 0.00 0.00 37.83 36.07 2j12 s LYS 131 CO -0.08 0.08 -0.21 0.15 -0.36 0.00 0.00 175.35 174.93 2j12 s LYS 132 N -0.36 2.64 -0.11 4.03 1.02 -0.07 -0.84 119.74 126.05 2j12 s LYS 132 Ca -0.01 -0.82 0.03 0.00 0.02 0.00 0.00 55.97 55.19 2j12 s LYS 132 Cb -0.03 -2.28 0.00 0.00 -0.52 0.00 0.00 37.83 35.00 2j12 s LYS 132 CO -0.00 0.42 -0.22 0.42 -0.92 0.00 0.00 175.35 175.05 2j12 s ILE 133 N -0.25 2.00 -0.45 2.17 1.01 0.38 -1.54 121.20 124.52 2j12 s ILE 133 Ca -0.00 -0.97 -0.18 0.00 0.00 0.00 0.00 60.65 59.50 2j12 s ILE 133 Cb -0.13 -1.75 0.04 0.00 0.01 0.00 0.00 42.46 40.63 2j12 s ILE 133 CO 0.03 0.54 0.50 -1.00 0.00 0.00 0.00 174.94 175.01 2j12 s HIS 134 N 0.55 3.14 -0.18 3.97 3.76 0.34 -0.60 115.29 126.28 2j12 s HIS 134 Ca -0.14 -0.44 -0.14 0.00 -0.15 0.00 0.00 55.06 54.19 2j12 s HIS 134 Cb -0.17 -3.12 -0.04 0.00 1.11 0.00 0.00 32.58 30.36 2j12 s HIS 134 CO 0.04 -0.81 0.32 -1.17 -0.85 0.00 0.00 174.74 172.27 2j12 s LEU 135 N 2.27 4.21 -0.12 0.89 2.96 -0.14 -1.25 118.68 127.50 2j12 s LEU 135 Ca 0.13 0.48 0.02 0.00 -0.22 0.00 0.00 54.13 54.54 2j12 s LEU 135 Cb -0.18 -2.40 -0.01 0.00 0.50 0.00 0.00 46.19 44.10 2j12 s LEU 135 CO 0.13 0.04 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.33 2j12 s VAL 136 N 0.77 2.59 -0.17 1.68 1.01 0.20 -2.33 120.40 124.15 2j12 s VAL 136 Ca 0.17 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 2j12 s VAL 136 Cb -0.14 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 2j12 s VAL 136 CO 0.05 0.54 -0.10 -0.69 0.00 0.00 0.00 175.10 174.91 2j12 s VAL 137 N 0.34 3.15 -2.25 2.92 1.01 -1.26 -1.35 120.40 122.96 2j12 s VAL 137 Ca -0.15 -0.60 0.18 0.00 0.00 0.00 0.00 61.98 61.41 2j12 s VAL 137 Cb -0.17 -2.37 0.14 0.00 0.00 0.00 0.00 36.38 33.98 2j12 s VAL 137 CO 0.07 0.49 1.07 0.18 0.00 0.00 0.00 175.10 176.91