#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j1k s LEU 20 N 0.00 4.37 0.04 1.04 0.20 -1.26 -4.65 118.68 118.42 2j1k s LEU 20 Ca 0.00 2.54 0.01 0.00 0.69 0.00 0.00 54.13 57.37 2j1k s LEU 20 Cb 0.00 -3.58 -0.02 0.00 -0.43 0.00 0.00 46.19 42.16 2j1k s LEU 20 CO 0.00 -0.84 -0.06 -0.44 -0.29 0.00 0.00 176.35 174.72 2j1k s SER 21 N 1.70 0.67 0.04 3.68 0.01 -0.98 -4.59 113.70 114.24 2j1k s SER 21 Ca 0.71 -0.58 0.04 0.00 1.31 0.00 0.00 55.95 57.44 2j1k s SER 21 Cb -0.41 0.06 -0.04 0.00 0.21 0.00 0.00 66.02 65.84 2j1k s SER 21 CO 0.32 -0.26 -0.07 -0.63 0.41 0.00 0.00 173.24 173.01 2j1k s ILE 22 N -1.62 3.63 -0.05 1.44 1.01 -1.26 -0.62 121.20 123.73 2j1k s ILE 22 Ca -0.10 -0.93 -0.30 0.00 0.00 0.00 0.00 60.65 59.33 2j1k s ILE 22 Cb -0.09 -2.63 -0.02 0.00 0.01 0.00 0.00 42.46 39.73 2j1k s ILE 22 CO -0.01 0.29 1.03 -0.89 0.00 0.00 0.00 174.94 175.36 2j1k s THR 23 N -1.09 4.70 -0.55 2.92 2.01 -0.85 -4.30 115.64 118.47 2j1k s THR 23 Ca 0.19 1.96 -0.13 0.00 0.31 0.00 0.00 61.69 64.02 2j1k s THR 23 Cb -0.11 -4.26 0.02 0.00 0.01 0.00 0.00 72.50 68.16 2j1k s THR 23 CO 0.11 0.07 0.64 0.35 -0.69 0.00 0.00 174.62 175.09 2j1k n THR 24 N 4.29 -9.21 0.01 -0.82 -2.24 -1.26 -4.78 114.28 100.26 2j1k n THR 24 Ca 0.08 0.38 0.00 0.00 -2.27 0.00 0.00 64.05 62.25 2j1k n THR 24 Cb 0.49 -6.32 0.02 0.00 -2.10 0.00 0.00 70.33 62.42 2j1k n THR 24 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2j1k n PRO 25 N -0.90 0.00 -3.65 -0.78 -0.02 -1.26 -4.44 135.00 123.96 2j1k n PRO 25 Ca 0.02 0.43 -0.11 0.00 -2.02 0.00 0.00 63.50 61.82 2j1k n PRO 25 Cb 0.52 -1.59 -0.07 0.00 -0.02 0.00 0.00 33.50 32.34 2j1k n PRO 25 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2j1k s GLU 26 N -2.88 0.73 0.12 -0.52 2.12 -1.26 -2.62 118.70 114.39 2j1k s GLU 26 Ca -0.00 1.05 -0.14 0.00 0.36 0.00 0.00 54.97 56.23 2j1k s GLU 26 Cb 0.00 0.26 0.03 0.00 0.26 0.00 0.00 34.13 34.68 2j1k s GLU 26 CO 0.01 -0.12 0.36 -1.83 -0.54 0.00 0.00 175.26 173.13 2j1k s GLU 27 N 0.94 1.02 -0.14 4.30 -1.05 -1.14 -5.03 118.70 117.59 2j1k s GLU 27 Ca -0.05 -0.76 0.00 0.00 -0.15 0.00 0.00 54.97 54.02 2j1k s GLU 27 Cb -0.05 0.44 -0.01 0.00 -0.44 0.00 0.00 34.13 34.08 2j1k s GLU 27 CO -0.08 -0.39 -0.15 -1.64 0.95 0.00 0.00 175.26 173.95 2j1k s MET 28 N -3.82 3.28 -0.06 -4.83 -1.94 -1.26 -2.40 119.30 108.28 2j1k s MET 28 Ca 0.03 -0.73 0.03 0.00 -1.71 0.00 0.00 55.69 53.32 2j1k s MET 28 Cb 0.02 -2.62 0.00 0.00 2.01 0.00 0.00 34.83 34.25 2j1k s MET 28 CO -0.12 0.11 -0.16 0.42 -0.01 0.00 0.00 175.02 175.26 2j1k s ILE 29 N 0.60 1.41 -0.10 2.53 1.01 -0.79 -4.97 121.20 120.89 2j1k s ILE 29 Ca -0.08 -0.67 0.02 0.00 0.00 0.00 0.00 60.65 59.92 2j1k s ILE 29 Cb -0.16 -1.24 -0.01 0.00 0.01 0.00 0.00 42.46 41.06 2j1k s ILE 29 CO 0.03 0.41 -0.16 -1.61 0.00 0.00 0.00 174.94 173.61 2j1k s GLU 30 N 0.36 3.06 0.18 2.79 2.02 -1.26 -4.29 118.70 121.56 2j1k s GLU 30 Ca -0.11 -0.74 -0.07 0.00 0.02 0.00 0.00 54.97 54.07 2j1k s GLU 30 Cb -0.14 -2.47 -0.02 0.00 0.10 0.00 0.00 34.13 31.59 2j1k s GLU 30 CO 0.04 0.31 0.25 0.15 0.02 0.00 0.00 175.26 176.03 2j1k s LYS 31 N 0.07 1.18 0.34 1.61 1.02 -1.26 -5.16 119.74 117.54 2j1k s LYS 31 Ca -0.07 -1.30 0.07 0.00 0.02 0.00 0.00 55.97 54.69 2j1k s LYS 31 Cb -0.15 0.35 -0.03 0.00 -0.52 0.00 0.00 37.83 37.49 2j1k s LYS 31 CO 0.05 -0.42 0.31 0.00 -0.92 0.00 0.00 175.35 174.37 2j1k s ALA 32 N -4.02 3.89 0.53 5.17 0.00 -1.26 -5.08 121.76 120.99 2j1k s ALA 32 Ca 0.22 -1.66 -0.21 0.00 0.00 0.00 0.00 51.96 50.31 2j1k s ALA 32 Cb 0.04 -1.19 -0.06 0.00 0.00 0.00 0.00 23.12 21.91 2j1k s ALA 32 CO 0.03 -0.02 1.14 1.63 0.00 0.00 0.00 175.76 178.54 2j1k n LYS 33 N -1.41 1.35 -0.10 0.00 5.02 -1.26 -2.78 118.16 118.97 2j1k n LYS 33 Ca -0.01 0.50 0.00 0.00 -2.02 0.00 0.00 58.31 56.78 2j1k n LYS 33 Cb 0.60 -2.30 0.00 0.00 -0.02 0.00 0.00 35.03 33.31 2j1k n LYS 33 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2j1k n GLY 34 N 1.04 2.74 3.94 0.72 0.00 0.20 -4.83 105.19 109.01 2j1k n GLY 34 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 2j1k n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j1k s GLU 35 N -0.02 1.89 -0.22 1.61 2.02 -1.12 -4.07 118.70 118.80 2j1k s GLU 35 Ca 0.00 -0.47 -0.04 0.00 0.02 0.00 0.00 54.97 54.49 2j1k s GLU 35 Cb 0.00 -2.17 -0.01 0.00 0.10 0.00 0.00 34.13 32.05 2j1k s GLU 35 CO 0.00 -1.42 -0.05 0.99 0.02 0.00 0.00 175.26 174.80 2j1k s THR 36 N -3.29 3.31 -0.28 3.63 2.01 -1.26 -0.97 115.64 118.79 2j1k s THR 36 Ca 0.63 -0.51 -0.15 0.00 0.31 0.00 0.00 61.69 61.97 2j1k s THR 36 Cb -0.09 -2.50 -0.03 0.00 0.01 0.00 0.00 72.50 69.89 2j1k s THR 36 CO 0.45 0.43 0.36 0.00 -0.69 0.00 0.00 174.62 175.17 2j1k s ALA 37 N 1.46 3.55 -0.36 7.40 0.00 0.57 -4.92 121.76 129.46 2j1k s ALA 37 Ca 0.06 -0.91 -0.19 0.00 0.00 0.00 0.00 51.96 50.92 2j1k s ALA 37 Cb -0.14 -2.71 0.00 0.00 0.00 0.00 0.00 23.12 20.27 2j1k s ALA 37 CO -0.04 -0.72 0.57 -0.47 0.00 0.00 0.00 175.76 175.10 2j1k s TYR 38 N 2.04 3.16 -0.43 0.00 5.04 -1.26 -0.32 117.35 125.58 2j1k s TYR 38 Ca 0.14 0.21 -0.13 0.00 -2.44 0.00 0.00 57.07 54.84 2j1k s TYR 38 Cb -0.16 -3.05 0.05 0.00 0.35 0.00 0.00 41.96 39.15 2j1k s TYR 38 CO 0.10 -0.61 0.32 -0.51 -1.34 0.00 0.00 175.55 173.51 2j1k s LEU 39 N 2.56 5.26 -0.05 6.97 1.43 -0.09 -5.01 118.68 129.75 2j1k s LEU 39 Ca 0.21 -1.20 -0.30 0.00 -1.03 0.00 0.00 54.13 51.81 2j1k s LEU 39 Cb -0.15 -2.12 -0.02 0.00 0.03 0.00 0.00 46.19 43.93 2j1k s LEU 39 CO 0.14 -0.54 1.06 -2.16 0.23 0.00 0.00 176.35 175.09 2j1k s PRO 40 N 1.60 4.45 -0.43 1.29 0.04 -1.26 -1.64 135.00 139.05 2j1k s PRO 40 Ca 0.04 1.49 0.04 0.00 0.04 0.00 0.00 61.00 62.61 2j1k s PRO 40 Cb -0.22 -3.50 0.17 0.00 0.04 0.00 0.00 34.50 30.99 2j1k s PRO 40 CO 0.07 -0.27 0.41 0.00 0.04 0.00 0.00 177.00 177.26 2j1k s LYS 42 N 0.31 3.31 0.10 0.00 1.02 -1.26 -0.05 119.74 123.17 2j1k s LYS 42 Ca 0.31 -0.27 0.03 0.00 0.02 0.00 0.00 55.97 56.07 2j1k s LYS 42 Cb 0.01 -3.06 -0.04 0.00 -0.52 0.00 0.00 37.83 34.23 2j1k s LYS 42 CO -0.15 0.73 -0.09 -0.59 -0.92 0.00 0.00 175.35 174.32 2j1k s PHE 43 N -1.09 1.02 -0.20 3.18 -0.12 -0.34 -2.01 117.98 118.42 2j1k s PHE 43 Ca 0.18 -0.72 0.00 0.00 -0.05 0.00 0.00 56.93 56.34 2j1k s PHE 43 Cb -0.12 -0.56 0.02 0.00 -0.63 0.00 0.00 43.02 41.73 2j1k s PHE 43 CO 0.08 -0.03 -0.15 0.99 -0.05 0.00 0.00 175.22 176.06 2j1k s THR 44 N -2.79 2.35 0.45 -4.49 2.01 0.21 -4.56 115.64 108.83 2j1k s THR 44 Ca 0.08 -0.96 -0.08 0.00 0.31 0.00 0.00 61.69 61.04 2j1k s THR 44 Cb -0.01 -2.07 -0.05 0.00 0.01 0.00 0.00 72.50 70.39 2j1k s THR 44 CO -0.01 0.42 0.79 -0.76 -0.69 0.00 0.00 174.62 174.37 2j1k s LEU 45 N 1.30 3.70 0.28 4.42 1.43 -1.26 -2.31 118.68 126.24 2j1k s LEU 45 Ca 0.03 1.03 0.09 0.00 -1.03 0.00 0.00 54.13 54.25 2j1k s LEU 45 Cb -0.14 -3.96 -0.04 0.00 0.03 0.00 0.00 46.19 42.08 2j1k s LEU 45 CO -0.10 -0.51 0.06 -0.55 0.23 0.00 0.00 176.35 175.49 2j1k s SER 46 N -3.69 4.74 0.55 2.29 0.15 -1.26 -4.92 113.70 111.56 2j1k s SER 46 Ca 0.49 -0.60 0.29 0.00 0.70 0.00 0.00 55.95 56.82 2j1k s SER 46 Cb -0.10 -0.92 1.61 0.00 -1.71 0.00 0.00 66.02 64.90 2j1k s SER 46 CO 0.39 -0.07 2.15 1.55 1.20 0.00 0.00 173.24 178.46 2j1k h PRO 47 N 1.74 0.00 0.00 5.44 0.13 -1.99 -2.31 132.00 135.01 2j1k h PRO 47 Ca -0.45 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.61 2j1k h PRO 47 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2j1k h PRO 47 CO 0.61 0.07 -0.32 1.05 -0.23 0.00 0.00 178.00 179.18 2j1k h GLU 48 N 0.00 0.00 -5.60 0.86 9.09 -1.96 -3.41 114.58 113.56 2j1k h GLU 48 Ca -0.00 0.00 -0.38 0.00 0.05 0.00 0.00 59.36 59.03 2j1k h GLU 48 Cb 0.20 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.25 2j1k h GLU 48 CO 0.01 0.32 1.14 -0.51 0.05 0.00 0.00 179.01 180.03 2j1k s ASP 49 N -6.32 5.34 0.00 3.06 1.01 -0.87 -4.28 116.67 114.60 2j1k s ASP 49 Ca 0.02 -1.52 0.19 0.00 0.71 0.00 0.00 52.55 51.95 2j1k s ASP 49 Cb 0.10 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.41 2j1k s ASP 49 CO 0.68 -2.71 0.94 0.00 0.21 0.00 0.00 175.17 174.29 2j1k n GLN 50 N 8.46 1.41 -1.56 8.23 1.13 -0.11 -4.85 117.38 130.09 2j1k n GLN 50 Ca 0.44 -0.79 -0.30 0.00 -1.94 0.00 0.00 57.00 54.41 2j1k n GLN 50 Cb 0.47 -1.37 0.20 0.00 0.11 0.00 0.00 30.24 29.65 2j1k n GLN 50 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2j1k s GLY 51 N -2.24 1.68 0.33 1.08 0.00 0.09 -4.92 107.32 103.34 2j1k s GLY 51 Ca 0.15 -1.01 -0.27 0.00 0.00 0.00 0.00 44.72 43.58 2j1k s GLY 51 CO 0.52 -0.23 1.09 2.56 0.00 0.00 0.00 173.10 177.04 2j1k s PRO 52 N -5.63 4.43 0.03 2.90 0.04 -1.26 -4.49 135.00 131.03 2j1k s PRO 52 Ca 0.71 1.72 -0.30 0.00 0.04 0.00 0.00 61.00 63.17 2j1k s PRO 52 Cb -0.08 -2.93 -0.06 0.00 0.04 0.00 0.00 34.50 31.47 2j1k s PRO 52 CO 0.54 0.04 1.41 -1.17 0.04 0.00 0.00 177.00 177.87 2j1k s LEU 53 N -1.93 4.33 -0.33 -3.56 2.96 -1.26 -4.43 118.68 114.47 2j1k s LEU 53 Ca 0.50 2.19 -0.01 0.00 -0.22 0.00 0.00 54.13 56.59 2j1k s LEU 53 Cb -0.29 -3.57 0.13 0.00 0.50 0.00 0.00 46.19 42.96 2j1k s LEU 53 CO 0.37 -0.71 0.22 -0.62 -1.32 0.00 0.00 176.35 174.28 2j1k s ASP 54 N 1.73 2.76 0.02 3.68 -1.08 -0.36 -4.27 116.67 119.16 2j1k s ASP 54 Ca 0.65 -1.63 0.02 0.00 -0.52 0.00 0.00 52.55 51.07 2j1k s ASP 54 Cb -0.33 -0.14 -0.04 0.00 -1.46 0.00 0.00 42.92 40.95 2j1k s ASP 54 CO 0.28 -0.36 0.01 -0.63 0.52 0.00 0.00 175.17 174.99 2j1k s ILE 55 N 1.63 4.21 -0.10 4.11 1.01 -0.55 -1.39 121.20 130.11 2j1k s ILE 55 Ca 0.14 -0.66 -0.08 0.00 0.00 0.00 0.00 60.65 60.05 2j1k s ILE 55 Cb -0.18 -2.91 0.03 0.00 0.01 0.00 0.00 42.46 39.41 2j1k s ILE 55 CO -0.17 0.32 0.26 -0.70 0.00 0.00 0.00 174.94 174.65 2j1k s GLU 56 N -1.75 0.27 -0.13 2.79 2.12 -0.22 -1.09 118.70 120.69 2j1k s GLU 56 Ca 0.21 0.44 -0.01 0.00 0.36 0.00 0.00 54.97 55.97 2j1k s GLU 56 Cb -0.12 0.04 -0.02 0.00 0.26 0.00 0.00 34.13 34.29 2j1k s GLU 56 CO 0.13 -0.09 -0.10 -1.58 -0.54 0.00 0.00 175.26 173.08 2j1k s TRP 57 N 0.61 2.88 0.27 5.30 0.52 -0.45 -0.33 118.94 127.74 2j1k s TRP 57 Ca -0.04 -0.49 0.12 0.00 0.02 0.00 0.00 56.10 55.71 2j1k s TRP 57 Cb -0.05 -1.87 -0.05 0.00 -1.15 0.00 0.00 33.47 30.35 2j1k s TRP 57 CO -0.04 -0.12 -0.20 -0.51 0.02 0.00 0.00 176.95 176.10 2j1k s LEU 58 N 0.27 2.57 -0.07 2.99 1.02 0.11 -1.66 118.68 123.91 2j1k s LEU 58 Ca -0.07 -1.01 0.01 0.00 0.02 0.00 0.00 54.13 53.08 2j1k s LEU 58 Cb -0.15 -1.11 0.02 0.00 0.02 0.00 0.00 46.19 44.97 2j1k s LEU 58 CO 0.05 0.05 -0.08 -0.51 0.02 0.00 0.00 176.35 175.87 2j1k s ILE 59 N -2.40 0.90 -0.69 -0.59 2.07 0.95 -0.67 121.20 120.77 2j1k s ILE 59 Ca 0.29 -0.30 -0.07 0.00 -1.41 0.00 0.00 60.65 59.16 2j1k s ILE 59 Cb -0.05 -0.88 0.18 0.00 0.13 0.00 0.00 42.46 41.83 2j1k s ILE 59 CO 0.14 0.32 0.55 -0.44 -1.91 0.00 0.00 174.94 173.60 2j1k s SER 60 N 1.08 5.75 0.35 4.50 0.01 0.10 -1.21 113.70 124.28 2j1k s SER 60 Ca -0.07 -2.80 -0.26 0.00 1.31 0.00 0.00 55.95 54.12 2j1k s SER 60 Cb -0.14 -1.97 -0.09 0.00 0.21 0.00 0.00 66.02 64.02 2j1k s SER 60 CO -0.01 -0.44 1.10 -2.16 0.41 0.00 0.00 173.24 172.14 2j1k s PRO 61 N 0.02 4.32 0.44 12.44 0.04 -1.26 -1.61 135.00 149.39 2j1k s PRO 61 Ca 0.17 1.72 0.29 0.00 0.04 0.00 0.00 61.00 63.21 2j1k s PRO 61 Cb -0.17 -2.83 0.97 0.00 0.04 0.00 0.00 34.50 32.51 2j1k s PRO 61 CO -0.05 -0.05 1.82 0.00 0.04 0.00 0.00 177.00 178.76 2j1k h ALA 62 N 3.04 1.00 -0.04 8.56 0.00 -1.74 -3.31 119.26 126.77 2j1k h ALA 62 Ca -0.48 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.45 2j1k h ALA 62 Cb 1.22 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 2j1k h ALA 62 CO 0.64 0.00 -0.04 0.22 0.00 0.00 0.00 179.25 180.07 2j1k h ASP 63 N 0.00 -0.13 -4.60 0.00 3.58 -1.83 -3.47 116.42 109.97 2j1k h ASP 63 Ca 0.00 0.03 -0.42 0.00 0.42 0.00 0.00 57.03 57.06 2j1k h ASP 63 Cb 0.65 0.07 -0.14 0.00 1.72 0.00 0.00 39.33 41.63 2j1k h ASP 63 CO 0.00 -0.06 -0.56 0.54 -2.88 0.00 0.00 179.24 176.28 2j1k s ASN 64 N -5.15 1.59 0.15 2.28 2.20 -1.25 -5.09 114.94 109.68 2j1k s ASN 64 Ca -0.13 -1.54 -0.10 0.00 -0.94 0.00 0.00 52.86 50.14 2j1k s ASN 64 Cb 0.08 0.36 -0.01 0.00 -2.00 0.00 0.00 41.25 39.68 2j1k s ASN 64 CO 0.67 -0.87 1.51 1.56 -2.94 0.00 0.00 177.10 177.03 2j1k h GLN 65 N 2.20 0.95 -7.02 3.55 1.08 -1.91 -3.43 115.11 110.54 2j1k h GLN 65 Ca -0.34 -0.46 -0.54 0.00 -1.45 0.00 0.00 58.65 55.86 2j1k h GLN 65 Cb 1.25 -0.00 0.12 0.00 -0.05 0.00 0.00 27.48 28.80 2j1k h GLN 65 CO 0.53 1.12 0.63 -1.59 -0.95 0.00 0.00 178.83 178.58 2j1k s LYS 66 N -4.50 3.45 0.18 1.46 -2.85 -1.26 -5.02 119.74 111.19 2j1k s LYS 66 Ca -0.11 2.26 0.10 0.00 -1.00 0.00 0.00 55.97 57.22 2j1k s LYS 66 Cb 0.12 -2.45 -0.04 0.00 -2.06 0.00 0.00 37.83 33.39 2j1k s LYS 66 CO 0.88 -0.96 -0.22 0.54 0.10 0.00 0.00 175.35 175.69 2j1k s VAL 67 N -1.28 2.10 -1.22 1.79 0.11 -1.26 -4.23 120.40 116.40 2j1k s VAL 67 Ca 0.66 -1.95 -0.13 0.00 -2.93 0.00 0.00 61.98 57.63 2j1k s VAL 67 Cb -0.41 -1.97 -0.01 0.00 -1.53 0.00 0.00 36.38 32.46 2j1k s VAL 67 CO 0.50 -0.19 0.69 0.47 -3.33 0.00 0.00 175.10 173.24 2j1k n ASP 68 N 0.34 -3.61 -4.72 3.54 8.00 -1.19 -4.93 116.55 113.98 2j1k n ASP 68 Ca -0.13 -0.99 -0.36 0.00 0.71 0.00 0.00 54.79 54.02 2j1k n ASP 68 Cb 0.56 -3.41 -0.07 0.00 -0.02 0.00 0.00 41.12 38.18 2j1k n ASP 68 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2j1k s GLN 69 N -6.10 4.23 0.30 -1.24 -1.52 -0.35 -4.80 119.66 110.19 2j1k s GLN 69 Ca 0.30 0.03 -0.29 0.00 -1.95 0.00 0.00 55.36 53.45 2j1k s GLN 69 Cb -0.11 -3.44 -0.12 0.00 -0.22 0.00 0.00 33.01 29.12 2j1k s GLN 69 CO 0.86 0.22 1.39 1.33 -0.25 0.00 0.00 175.29 178.84 2j1k n VAL 70 N 3.67 1.51 -0.02 1.09 0.24 -1.26 -0.03 118.33 123.52 2j1k n VAL 70 Ca -0.12 -0.38 -0.02 0.00 -2.04 0.00 0.00 64.34 61.77 2j1k n VAL 70 Cb 0.52 -1.63 -0.03 0.00 -1.47 0.00 0.00 33.84 31.23 2j1k n VAL 70 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 2j1k n ILE 71 N 1.12 0.31 -3.60 1.34 -5.35 -0.66 -3.63 119.36 108.89 2j1k n ILE 71 Ca 0.07 -0.18 -0.10 0.00 -0.27 0.00 0.00 62.75 62.27 2j1k n ILE 71 Cb 0.35 -0.85 -0.06 0.00 -1.74 0.00 0.00 39.64 37.33 2j1k n ILE 71 CO 0.00 0.00 0.00 -0.51 -1.76 0.00 0.00 176.55 174.28 2j1k s ILE 72 N -2.11 0.00 0.03 7.28 2.07 -1.23 -4.42 121.20 122.82 2j1k s ILE 72 Ca -0.03 0.00 -0.05 0.00 -1.41 0.00 0.00 60.65 59.15 2j1k s ILE 72 Cb 0.01 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.59 2j1k s ILE 72 CO 0.18 0.00 0.10 -1.48 -1.91 0.00 0.00 174.94 171.82 2j1k s LEU 73 N -0.55 1.79 -0.11 8.50 0.05 -0.09 -1.34 118.68 126.93 2j1k s LEU 73 Ca 0.00 -0.49 0.02 0.00 0.05 0.00 0.00 54.13 53.72 2j1k s LEU 73 Cb -0.02 0.59 -0.01 0.00 -2.05 0.00 0.00 46.19 44.70 2j1k s LEU 73 CO -0.02 -0.48 -0.18 -0.47 -0.55 0.00 0.00 176.35 174.65 2j1k s TYR 74 N -2.39 2.68 -0.28 3.48 5.04 -0.25 -0.99 117.35 124.64 2j1k s TYR 74 Ca -0.07 -0.75 -0.18 0.00 -2.44 0.00 0.00 57.07 53.63 2j1k s TYR 74 Cb -0.02 -1.76 0.11 0.00 0.35 0.00 0.00 41.96 40.64 2j1k s TYR 74 CO -0.04 -0.25 0.83 0.45 -1.34 0.00 0.00 175.55 175.20 2j1k s SER 75 N 0.21 -0.72 -1.21 4.32 0.15 -0.74 -1.48 113.70 114.23 2j1k s SER 75 Ca -0.11 1.19 -0.05 0.00 0.70 0.00 0.00 55.95 57.67 2j1k s SER 75 Cb -0.16 1.28 0.01 0.00 -1.71 0.00 0.00 66.02 65.43 2j1k s SER 75 CO 0.06 -0.19 1.04 0.61 1.20 0.00 0.00 173.24 175.96 2j1k n GLY 76 N 3.73 -0.39 3.90 9.45 0.00 -1.26 -2.62 105.19 118.00 2j1k n GLY 76 Ca -0.18 0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 2j1k n GLY 76 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2j1k n ASP 77 N -2.79 -2.35 -3.68 1.61 8.00 -1.26 -4.98 116.55 111.09 2j1k n ASP 77 Ca -0.09 -0.88 -0.11 0.00 0.71 0.00 0.00 54.79 54.42 2j1k n ASP 77 Cb 0.59 -3.56 -0.09 0.00 -0.02 0.00 0.00 41.12 38.03 2j1k n ASP 77 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2j1k s LYS 78 N -6.46 0.55 -0.09 -1.24 2.36 -1.08 -5.15 119.74 108.63 2j1k s LYS 78 Ca 0.31 0.85 -0.17 0.00 -2.55 0.00 0.00 55.97 54.40 2j1k s LYS 78 Cb -0.16 0.15 -0.05 0.00 -1.05 0.00 0.00 37.83 36.72 2j1k s LYS 78 CO 0.85 -0.12 0.46 0.42 1.55 0.00 0.00 175.35 178.51 2j1k s ILE 79 N 0.96 5.14 -0.12 5.43 1.01 -1.26 -1.80 121.20 130.56 2j1k s ILE 79 Ca -0.05 0.92 0.02 0.00 0.00 0.00 0.00 60.65 61.53 2j1k s ILE 79 Cb -0.06 -3.79 0.01 0.00 0.01 0.00 0.00 42.46 38.64 2j1k s ILE 79 CO -0.08 0.39 -0.16 -0.31 0.00 0.00 0.00 174.94 174.77 2j1k s TYR 80 N 0.20 2.14 0.00 3.97 2.02 -0.16 -5.02 117.35 120.50 2j1k s TYR 80 Ca 0.25 -1.05 0.02 0.00 -0.37 0.00 0.00 57.07 55.92 2j1k s TYR 80 Cb -0.15 -1.52 0.03 0.00 -0.40 0.00 0.00 41.96 39.91 2j1k s TYR 80 CO 0.11 -0.53 1.01 -0.40 -1.57 0.00 0.00 175.55 174.16 2j1k n ASP 81 N 4.25 0.07 -3.57 2.29 5.75 -1.26 -0.92 116.55 123.16 2j1k n ASP 81 Ca -0.19 -1.99 -0.27 0.00 -0.01 0.00 0.00 54.79 52.33 2j1k n ASP 81 Cb 0.51 -0.20 -0.09 0.00 -1.03 0.00 0.00 41.12 40.30 2j1k n ASP 81 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 2j1k n ASP 82 N 0.03 3.37 0.00 -1.12 2.03 -1.26 -4.78 116.55 114.83 2j1k n ASP 82 Ca 0.00 -3.34 0.00 0.00 0.52 0.00 0.00 54.79 51.98 2j1k n ASP 82 Cb 0.73 -0.70 0.00 0.00 -0.72 0.00 0.00 41.12 40.43 2j1k n ASP 82 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 2j1k n TYR 83 N 1.25 0.00 -3.57 -0.67 4.01 -1.26 -5.00 117.16 111.91 2j1k n TYR 83 Ca 0.26 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.60 2j1k n TYR 83 Cb 0.39 0.02 -0.10 0.00 -0.31 0.00 0.00 39.34 39.34 2j1k n TYR 83 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 2j1k s TYR 84 N -1.93 3.27 0.34 -0.72 5.04 -1.24 -4.97 117.35 117.15 2j1k s TYR 84 Ca 0.00 -1.14 0.04 0.00 -2.44 0.00 0.00 57.07 53.53 2j1k s TYR 84 Cb 0.00 -2.69 0.66 0.00 0.35 0.00 0.00 41.96 40.29 2j1k s TYR 84 CO 0.00 -0.73 1.95 -1.35 -1.34 0.00 0.00 175.55 174.08 2j1k h PRO 85 N 8.47 0.82 0.00 4.97 0.11 -1.94 -2.15 132.00 142.29 2j1k h PRO 85 Ca -0.25 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.77 2j1k h PRO 85 Cb 1.10 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 2j1k h PRO 85 CO 0.72 0.55 -0.22 -0.44 -0.21 0.00 0.00 178.00 178.40 2j1k h ASP 86 N 0.85 0.00 -0.32 -2.05 3.32 -2.02 -2.68 116.42 113.52 2j1k h ASP 86 Ca 0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.37 2j1k h ASP 86 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 2j1k h ASP 86 CO -0.10 0.22 0.00 0.18 -1.72 0.00 0.00 179.24 177.81 2j1k n LEU 87 N -3.91 2.74 -4.57 1.55 4.77 -0.81 -4.99 117.00 111.78 2j1k n LEU 87 Ca -0.02 -1.19 -0.63 0.00 -0.03 0.00 0.00 56.01 54.15 2j1k n LEU 87 Cb 0.30 -0.20 -0.10 0.00 -2.33 0.00 0.00 43.42 41.09 2j1k n LEU 87 CO 0.34 0.59 1.40 1.17 -1.33 0.00 0.00 177.39 179.56 2j1k n LYS 88 N 1.03 0.23 -0.97 3.23 3.00 -1.01 -0.21 118.16 123.45 2j1k n LYS 88 Ca 0.18 0.08 0.00 0.00 -0.00 0.00 0.00 58.31 58.57 2j1k n LYS 88 Cb 0.49 -1.65 0.00 0.00 0.00 0.00 0.00 35.03 33.87 2j1k n LYS 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2j1k n GLY 89 N 5.27 0.61 0.12 3.14 0.00 -1.26 -4.87 105.19 108.21 2j1k n GLY 89 Ca 0.38 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.42 2j1k n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j1k n ARG 90 N -2.25 -0.13 -4.48 1.61 1.74 0.70 -4.96 116.66 108.88 2j1k n ARG 90 Ca 0.00 -0.64 -0.34 0.00 -0.77 0.00 0.00 57.85 56.10 2j1k n ARG 90 Cb 0.04 -1.03 -0.13 0.00 -1.02 0.00 0.00 32.46 30.31 2j1k n ARG 90 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2j1k s VAL 91 N -0.33 3.40 -0.06 1.55 -7.23 -1.24 -1.58 120.40 114.91 2j1k s VAL 91 Ca 0.04 -0.52 -0.05 0.00 -1.81 0.00 0.00 61.98 59.63 2j1k s VAL 91 Cb 0.03 -2.47 0.02 0.00 0.56 0.00 0.00 36.38 34.51 2j1k s VAL 91 CO 0.04 0.49 0.16 -1.00 -0.31 0.00 0.00 175.10 174.49 2j1k s HIS 92 N 0.57 -0.18 0.17 2.82 3.76 -1.02 -4.97 115.29 116.43 2j1k s HIS 92 Ca -0.05 0.46 -0.31 0.00 -0.15 0.00 0.00 55.06 55.00 2j1k s HIS 92 Cb -0.15 0.04 -0.09 0.00 1.11 0.00 0.00 32.58 33.49 2j1k s HIS 92 CO 0.03 -0.11 1.43 -0.06 -0.85 0.00 0.00 174.74 175.18 2j1k s PHE 93 N 0.33 3.16 0.05 1.40 0.08 -1.26 -0.37 117.98 121.37 2j1k s PHE 93 Ca -0.02 0.94 -0.01 0.00 0.12 0.00 0.00 56.93 57.96 2j1k s PHE 93 Cb -0.03 -3.75 -0.26 0.00 -0.57 0.00 0.00 43.02 38.40 2j1k s PHE 93 CO -0.01 -2.60 1.03 1.79 -0.10 0.00 0.00 175.22 175.33 2j1k h THR 94 N 3.95 1.37 -3.90 0.64 1.35 -1.54 -3.47 112.91 111.31 2j1k h THR 94 Ca -0.44 -3.01 -0.47 0.00 -0.55 0.00 0.00 66.41 61.95 2j1k h THR 94 Cb 1.21 2.82 -0.02 0.00 -1.73 0.00 0.00 68.15 70.44 2j1k h THR 94 CO 0.84 0.85 0.35 -0.55 -0.25 0.00 0.00 175.52 176.76 2j1k s SER 95 N -6.93 7.29 0.16 5.36 0.15 -1.26 -4.97 113.70 113.49 2j1k s SER 95 Ca -0.05 1.84 0.08 0.00 0.70 0.00 0.00 55.95 58.53 2j1k s SER 95 Cb 0.08 -2.58 -0.09 0.00 -1.71 0.00 0.00 66.02 61.72 2j1k s SER 95 CO 0.86 -0.11 1.35 -0.55 1.20 0.00 0.00 173.24 175.99 2j1k h ASN 96 N 3.06 0.00 -4.05 5.45 7.08 -1.93 -3.39 115.58 121.80 2j1k h ASN 96 Ca -0.47 0.00 -0.63 0.00 -3.08 0.00 0.00 56.30 52.12 2j1k h ASN 96 Cb 1.19 0.00 -0.41 0.00 -2.08 0.00 0.00 38.32 37.02 2j1k h ASN 96 CO 0.65 0.89 -0.65 -0.62 -2.08 0.00 0.00 177.43 175.62 2j1k s ASP 97 N -6.70 4.22 0.20 6.14 2.15 -1.26 -4.95 116.67 116.46 2j1k s ASP 97 Ca 0.01 -3.05 -0.08 0.00 0.43 0.00 0.00 52.55 49.86 2j1k s ASP 97 Cb 0.10 -1.52 0.11 0.00 -0.30 0.00 0.00 42.92 41.32 2j1k s ASP 97 CO 0.80 -0.22 1.68 -0.07 -0.17 0.00 0.00 175.17 177.19 2j1k h LEU 98 N 6.40 1.05 -1.34 -1.34 4.07 -1.78 -3.17 115.31 119.19 2j1k h LEU 98 Ca -0.04 -0.27 0.41 0.00 0.08 0.00 0.00 57.88 58.06 2j1k h LEU 98 Cb 0.88 -0.28 -0.13 0.00 1.08 0.00 0.00 40.66 42.21 2j1k h LEU 98 CO 0.65 1.06 0.79 0.11 -1.08 0.00 0.00 178.44 179.97 2j1k h LYS 99 N 1.00 0.12 0.47 1.13 6.56 -1.92 -1.06 116.57 122.88 2j1k h LYS 99 Ca 0.19 -0.01 -0.02 0.00 -1.06 0.00 0.00 60.65 59.75 2j1k h LYS 99 Cb 0.49 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 32.13 2j1k h LYS 99 CO 0.02 0.08 -0.23 0.77 -2.06 0.00 0.00 179.45 178.04 2j1k h SER 100 N 0.13 -0.53 0.00 0.86 0.02 -1.98 -3.47 113.55 108.58 2j1k h SER 100 Ca 0.79 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.74 2j1k h SER 100 Cb 2.38 0.14 0.00 0.00 0.14 0.00 0.00 62.40 65.06 2j1k h SER 100 CO -0.44 -0.35 0.00 0.61 -1.14 0.00 0.00 176.83 175.51 2j1k n GLY 101 N -1.24 0.00 2.57 -3.77 0.00 -0.41 -4.86 105.19 97.48 2j1k n GLY 101 Ca -0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 2j1k n GLY 101 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2j1k s ASP 102 N 0.00 3.36 -0.32 1.61 -1.08 -1.17 -1.20 116.67 117.87 2j1k s ASP 102 Ca 0.00 -2.03 0.10 0.00 -0.52 0.00 0.00 52.55 50.10 2j1k s ASP 102 Cb 0.00 -0.59 0.76 0.00 -1.46 0.00 0.00 42.92 41.63 2j1k s ASP 102 CO 0.00 -0.34 1.81 0.00 0.52 0.00 0.00 175.17 177.16 2j1k n ALA 103 N 4.28 4.52 -1.77 3.66 0.00 0.93 -4.38 120.51 127.75 2j1k n ALA 103 Ca 0.06 -2.31 -0.36 0.00 0.00 0.00 0.00 53.44 50.83 2j1k n ALA 103 Cb 0.38 -1.23 -0.01 0.00 0.00 0.00 0.00 19.45 18.59 2j1k n ALA 103 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2j1k s SER 104 N -1.02 6.00 0.33 0.00 0.01 -1.17 -4.56 113.70 113.29 2j1k s SER 104 Ca 0.55 2.23 0.05 0.00 1.31 0.00 0.00 55.95 60.09 2j1k s SER 104 Cb 0.44 -2.59 -0.06 0.00 0.21 0.00 0.00 66.02 64.01 2j1k s SER 104 CO 0.14 -1.03 0.03 0.27 0.41 0.00 0.00 173.24 173.06 2j1k s ILE 105 N -1.66 1.35 -0.08 1.44 -4.36 -0.65 -1.35 121.20 115.89 2j1k s ILE 105 Ca 0.67 -2.02 0.02 0.00 -0.26 0.00 0.00 60.65 59.07 2j1k s ILE 105 Cb -0.26 -2.75 0.01 0.00 1.25 0.00 0.00 42.46 40.71 2j1k s ILE 105 CO 0.31 -0.06 -0.14 0.21 0.24 0.00 0.00 174.94 175.50 2j1k s ASN 106 N -3.50 2.11 -0.44 4.36 3.04 0.50 -0.92 114.94 120.10 2j1k s ASN 106 Ca 0.35 -0.36 -0.06 0.00 0.04 0.00 0.00 52.86 52.83 2j1k s ASN 106 Cb 0.08 -0.96 0.11 0.00 -1.54 0.00 0.00 41.25 38.95 2j1k s ASN 106 CO 0.15 0.03 0.28 -0.69 -3.04 0.00 0.00 177.10 173.83 2j1k s VAL 107 N 0.78 3.81 0.20 -5.21 1.01 0.57 -2.44 120.40 119.11 2j1k s VAL 107 Ca -0.12 -1.89 -0.11 0.00 0.00 0.00 0.00 61.98 59.86 2j1k s VAL 107 Cb -0.16 -3.54 -0.07 0.00 0.00 0.00 0.00 36.38 32.61 2j1k s VAL 107 CO 0.02 -0.73 0.55 0.42 0.00 0.00 0.00 175.10 175.36 2j1k s THR 108 N 1.27 4.91 -1.00 3.92 -4.23 -0.62 -0.31 115.64 119.58 2j1k s THR 108 Ca 0.07 0.60 -0.06 0.00 -1.18 0.00 0.00 61.69 61.11 2j1k s THR 108 Cb -0.25 -3.66 -0.05 0.00 1.34 0.00 0.00 72.50 69.89 2j1k s THR 108 CO -0.02 0.05 0.86 -3.20 -0.54 0.00 0.00 174.62 171.76 2j1k n ASN 109 N 0.22 -6.70 -4.73 3.99 5.15 -0.70 -4.84 115.26 107.64 2j1k n ASN 109 Ca -0.02 -0.62 -0.33 0.00 -0.60 0.00 0.00 54.58 53.01 2j1k n ASN 109 Cb 0.52 -4.97 0.10 0.00 -0.53 0.00 0.00 39.78 34.90 2j1k n ASN 109 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2j1k s LEU 110 N -5.24 3.18 0.29 1.20 1.43 -0.14 -4.55 118.68 114.85 2j1k s LEU 110 Ca 0.36 2.14 0.02 0.00 -1.03 0.00 0.00 54.13 55.63 2j1k s LEU 110 Cb -0.06 -4.56 -0.05 0.00 0.03 0.00 0.00 46.19 41.55 2j1k s LEU 110 CO 0.76 -2.27 0.12 -1.10 0.23 0.00 0.00 176.35 174.09 2j1k s GLN 111 N -4.29 1.54 0.35 1.70 -0.21 -1.26 -0.63 119.66 116.87 2j1k s GLN 111 Ca 0.69 -1.87 0.27 0.00 0.02 0.00 0.00 55.36 54.47 2j1k s GLN 111 Cb -0.24 -0.29 0.94 0.00 1.00 0.00 0.00 33.01 34.42 2j1k s GLN 111 CO 0.49 -0.36 1.78 -0.07 -2.12 0.00 0.00 175.29 175.02 2j1k h LEU 112 N 2.25 0.00 -1.28 2.90 3.38 -1.98 -2.75 115.31 117.83 2j1k h LEU 112 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2j1k h LEU 112 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2j1k h LEU 112 CO 0.58 0.00 0.00 0.77 0.09 0.00 0.00 178.44 179.88 2j1k h SER 113 N 0.00 0.00 -0.00 -0.43 4.64 -2.02 -3.12 113.55 112.62 2j1k h SER 113 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2j1k h SER 113 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2j1k h SER 113 CO 0.00 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.43 2j1k n ASP 114 N -3.03 0.13 -4.67 4.97 8.00 -1.04 -4.68 116.55 116.24 2j1k n ASP 114 Ca 0.01 -1.16 -0.42 0.00 0.71 0.00 0.00 54.79 53.93 2j1k n ASP 114 Cb 0.32 -0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.39 2j1k n ASP 114 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2j1k s ILE 115 N -1.99 3.33 -2.99 0.53 1.01 -1.18 -4.85 121.20 115.04 2j1k s ILE 115 Ca 0.42 0.59 0.00 0.00 0.00 0.00 0.00 60.65 61.65 2j1k s ILE 115 Cb 0.19 -3.38 0.00 0.00 0.01 0.00 0.00 42.46 39.29 2j1k s ILE 115 CO 0.33 -0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.85 2j1k n GLY 116 N 4.08 -2.07 3.68 6.18 0.00 -1.26 -2.03 105.19 113.76 2j1k n GLY 116 Ca 0.17 -1.18 -0.37 0.00 0.00 0.00 0.00 46.02 44.63 2j1k n GLY 116 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2j1k s THR 117 N -2.15 5.28 -0.29 2.61 2.01 -0.64 -1.73 115.64 120.73 2j1k s THR 117 Ca 0.00 0.50 -0.06 0.00 0.31 0.00 0.00 61.69 62.44 2j1k s THR 117 Cb 0.00 -3.63 0.02 0.00 0.01 0.00 0.00 72.50 68.90 2j1k s THR 117 CO 0.00 0.32 0.05 -0.31 -0.69 0.00 0.00 174.62 173.99 2j1k s TYR 118 N 1.00 3.15 -0.21 4.92 2.02 0.26 -0.73 117.35 127.77 2j1k s TYR 118 Ca 0.15 -1.19 -0.08 0.00 -0.37 0.00 0.00 57.07 55.58 2j1k s TYR 118 Cb -0.14 -2.21 -0.04 0.00 -0.40 0.00 0.00 41.96 39.17 2j1k s TYR 118 CO 0.06 -0.64 0.08 -1.14 -1.57 0.00 0.00 175.55 172.34 2j1k s GLN 119 N 1.44 3.90 -0.36 -0.62 0.74 0.15 -0.87 119.66 124.05 2j1k s GLN 119 Ca 0.01 -0.37 -0.12 0.00 0.05 0.00 0.00 55.36 54.93 2j1k s GLN 119 Cb -0.18 -3.31 0.01 0.00 1.10 0.00 0.00 33.01 30.63 2j1k s GLN 119 CO 0.01 0.10 0.23 0.00 -0.55 0.00 0.00 175.29 175.08 2j1k s LYS 121 N 1.63 3.23 -0.10 0.00 1.02 0.55 -0.85 119.74 125.22 2j1k s LYS 121 Ca 0.04 -0.76 -0.03 0.00 0.02 0.00 0.00 55.97 55.24 2j1k s LYS 121 Cb -0.18 -3.37 -0.03 0.00 -0.52 0.00 0.00 37.83 33.73 2j1k s LYS 121 CO 0.08 -0.38 -0.00 0.08 -0.92 0.00 0.00 175.35 174.21 2j1k s VAL 122 N 1.53 4.28 -0.02 3.17 1.01 0.11 -1.05 120.40 129.43 2j1k s VAL 122 Ca 0.04 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 61.79 2j1k s VAL 122 Cb -0.17 -2.82 0.00 0.00 0.00 0.00 0.00 36.38 33.40 2j1k s VAL 122 CO 0.03 0.58 -0.08 -0.54 0.00 0.00 0.00 175.10 175.09 2j1k s LYS 123 N -0.60 0.84 -0.34 2.72 1.02 -0.48 -1.15 119.74 121.76 2j1k s LYS 123 Ca 0.10 -0.26 0.03 0.00 0.02 0.00 0.00 55.97 55.85 2j1k s LYS 123 Cb -0.12 -0.80 0.16 0.00 -0.52 0.00 0.00 37.83 36.55 2j1k s LYS 123 CO 0.02 0.10 0.40 0.21 -0.92 0.00 0.00 175.35 175.16 2j1k s LYS 124 N 0.20 0.54 0.25 1.68 2.20 0.32 -1.22 119.74 123.71 2j1k s LYS 124 Ca -0.03 -0.39 -0.30 0.00 -0.36 0.00 0.00 55.97 54.89 2j1k s LYS 124 Cb -0.08 -0.50 -0.14 0.00 -1.51 0.00 0.00 37.83 35.59 2j1k s LYS 124 CO 0.00 -1.12 1.14 0.00 -0.36 0.00 0.00 175.35 175.01 2j1k n ALA 125 N 4.76 -0.12 1.52 3.13 0.00 -1.26 -0.32 120.51 128.23 2j1k n ALA 125 Ca 0.06 0.42 0.13 0.00 0.00 0.00 0.00 53.44 54.04 2j1k n ALA 125 Cb 0.48 -2.07 0.74 0.00 0.00 0.00 0.00 19.45 18.60 2j1k n ALA 125 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2j1k n PRO 126 N 1.26 0.70 -2.16 0.00 -0.04 -1.26 -0.73 135.00 132.76 2j1k n PRO 126 Ca 0.11 0.01 -0.41 0.00 -0.04 0.00 0.00 63.50 63.18 2j1k n PRO 126 Cb 0.30 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.23 2j1k n PRO 126 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2j1k s GLY 127 N -2.16 2.64 -0.13 0.55 0.00 0.57 -5.03 107.32 103.76 2j1k s GLY 127 Ca 0.35 1.19 -0.09 0.00 0.00 0.00 0.00 44.72 46.17 2j1k s GLY 127 CO 0.33 2.03 0.33 0.14 0.00 0.00 0.00 173.10 175.93 2j1k s VAL 128 N -0.40 -0.02 0.13 1.40 1.01 -1.26 -0.52 120.40 120.74 2j1k s VAL 128 Ca 0.54 0.07 -0.16 0.00 0.00 0.00 0.00 61.98 62.43 2j1k s VAL 128 Cb -0.38 -0.49 0.03 0.00 0.00 0.00 0.00 36.38 35.54 2j1k s VAL 128 CO 0.44 0.03 0.40 0.00 0.00 0.00 0.00 175.10 175.97 2j1k s ALA 129 N 0.86 -0.89 0.18 5.51 0.00 -0.30 -4.81 121.76 122.31 2j1k s ALA 129 Ca -0.06 -0.10 -0.10 0.00 0.00 0.00 0.00 51.96 51.71 2j1k s ALA 129 Cb -0.06 0.71 -0.01 0.00 0.00 0.00 0.00 23.12 23.76 2j1k s ALA 129 CO -0.06 -0.66 0.32 0.54 0.00 0.00 0.00 175.76 175.90 2j1k s ASN 130 N -2.82 0.00 -0.14 0.00 4.22 -1.26 -0.71 114.94 114.24 2j1k s ASN 130 Ca 0.04 -0.86 -0.11 0.00 -2.14 0.00 0.00 52.86 49.80 2j1k s ASN 130 Cb 0.02 0.46 0.04 0.00 1.28 0.00 0.00 41.25 43.05 2j1k s ASN 130 CO -0.11 -0.93 0.35 -0.75 -2.04 0.00 0.00 177.10 173.62 2j1k s LYS 131 N -3.97 0.38 -0.11 3.55 2.20 -0.03 -4.85 119.74 116.91 2j1k s LYS 131 Ca 0.18 0.55 -0.02 0.00 -0.36 0.00 0.00 55.97 56.32 2j1k s LYS 131 Cb 0.03 0.11 -0.03 0.00 -1.51 0.00 0.00 37.83 36.42 2j1k s LYS 131 CO 0.01 -0.09 -0.02 0.15 -0.36 0.00 0.00 175.35 175.04 2j1k s LYS 132 N 0.58 3.19 -0.11 4.03 1.02 -1.08 -0.14 119.74 127.24 2j1k s LYS 132 Ca -0.03 -0.46 0.02 0.00 0.02 0.00 0.00 55.97 55.52 2j1k s LYS 132 Cb -0.05 -2.81 0.01 0.00 -0.52 0.00 0.00 37.83 34.46 2j1k s LYS 132 CO -0.04 0.54 -0.17 0.42 -0.92 0.00 0.00 175.35 175.18 2j1k s ILE 133 N -0.45 1.63 -0.38 2.17 1.01 -0.05 -2.91 121.20 122.23 2j1k s ILE 133 Ca 0.08 -0.73 -0.16 0.00 0.00 0.00 0.00 60.65 59.83 2j1k s ILE 133 Cb -0.12 -1.47 0.00 0.00 0.01 0.00 0.00 42.46 40.89 2j1k s ILE 133 CO 0.02 0.47 0.38 -1.00 0.00 0.00 0.00 174.94 174.81 2j1k s HIS 134 N 0.84 3.20 -2.87 3.97 3.76 -1.01 -0.57 115.29 122.61 2j1k s HIS 134 Ca -0.09 -0.24 0.23 0.00 -0.15 0.00 0.00 55.06 54.81 2j1k s HIS 134 Cb -0.15 -2.74 0.18 0.00 1.11 0.00 0.00 32.58 30.98 2j1k s HIS 134 CO 0.00 -0.56 1.23 -0.11 -0.85 0.00 0.00 174.74 174.45