#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 4.33 0.01 -3.43 0.20 -1.26 -4.51 118.68 114.02 2j1k s LEU 20 Ca 0.00 2.46 -0.04 0.00 0.69 0.00 0.00 54.13 57.24 2j1k s LEU 20 Cb 0.00 -3.53 -0.01 0.00 -0.43 0.00 0.00 46.19 42.22 2j1k s LEU 20 CO 0.00 -1.07 0.06 -0.94 -0.29 0.00 0.00 176.35 174.10 2j1k s SER 21 N 4.31 0.12 -0.10 3.68 1.04 -1.05 -4.51 113.70 117.18 2j1k s SER 21 Ca 0.84 -0.32 -0.07 0.00 0.48 0.00 0.00 55.95 56.88 2j1k s SER 21 Cb -0.39 0.15 -0.04 0.00 0.10 0.00 0.00 66.02 65.85 2j1k s SER 21 CO 0.37 -0.32 0.17 -0.63 0.98 0.00 0.00 173.24 173.81 2j1k s ILE 22 N -1.33 5.47 -0.13 -1.02 1.01 -1.26 -1.67 121.20 122.27 2j1k s ILE 22 Ca -0.14 0.23 -0.29 0.00 0.00 0.00 0.00 60.65 60.44 2j1k s ILE 22 Cb -0.08 -3.44 -0.01 0.00 0.01 0.00 0.00 42.46 38.94 2j1k s ILE 22 CO 0.00 0.59 1.11 -0.89 0.00 0.00 0.00 174.94 175.75 2j1k s THR 23 N -1.06 4.54 -0.58 2.92 2.01 -0.18 -4.09 115.64 119.21 2j1k s THR 23 Ca 0.17 1.84 -0.07 0.00 0.31 0.00 0.00 61.69 63.94 2j1k s THR 23 Cb -0.12 -4.19 0.01 0.00 0.01 0.00 0.00 72.50 68.21 2j1k s THR 23 CO 0.06 -0.06 0.63 0.41 -0.69 0.00 0.00 174.62 174.96 2j1k n THR 24 N 4.88-10.21 1.25 -0.82 -1.04 -1.26 -4.67 114.28 102.41 2j1k n THR 24 Ca 0.11 0.26 0.00 0.00 -2.04 0.00 0.00 64.05 62.37 2j1k n THR 24 Cb 0.47 -6.96 0.00 0.00 -1.82 0.00 0.00 70.33 62.02 2j1k n THR 24 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2j1k n PRO 25 N -1.10 0.71 -3.61 -2.82 -0.04 -1.26 -4.56 135.00 122.33 2j1k n PRO 25 Ca 0.05 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.47 2j1k n PRO 25 Cb 0.47 -1.09 -0.06 0.00 -0.04 0.00 0.00 33.50 32.78 2j1k n PRO 25 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2j1k s GLU 26 N -1.75 0.46 0.05 0.54 2.56 -1.25 -2.34 118.70 116.97 2j1k s GLU 26 Ca 0.00 1.22 -0.01 0.00 0.00 0.00 0.00 54.97 56.19 2j1k s GLU 26 Cb 0.00 0.58 -0.04 0.00 2.00 0.00 0.00 34.13 36.67 2j1k s GLU 26 CO 0.00 -0.26 -0.03 -1.21 -0.56 0.00 0.00 175.26 173.19 2j1k s GLU 27 N 2.77 0.59 -0.09 4.30 2.02 -0.89 -5.03 118.70 122.37 2j1k s GLU 27 Ca -0.02 -1.14 0.05 0.00 0.02 0.00 0.00 54.97 53.88 2j1k s GLU 27 Cb -0.12 0.15 -0.00 0.00 0.10 0.00 0.00 34.13 34.25 2j1k s GLU 27 CO -0.16 -0.09 -0.24 1.41 0.02 0.00 0.00 175.26 176.19 2j1k s MET 28 N -3.52 2.88 -0.15 1.61 -2.45 -1.26 -0.79 119.30 115.61 2j1k s MET 28 Ca 0.04 -0.89 0.01 0.00 -1.25 0.00 0.00 55.69 53.60 2j1k s MET 28 Cb 0.05 -2.26 0.02 0.00 1.25 0.00 0.00 34.83 33.89 2j1k s MET 28 CO -0.08 0.25 -0.16 0.42 1.05 0.00 0.00 175.02 176.50 2j1k s ILE 29 N 0.16 1.72 -0.19 10.11 1.01 -0.38 -4.94 121.20 128.68 2j1k s ILE 29 Ca -0.13 -0.74 -0.07 0.00 0.00 0.00 0.00 60.65 59.71 2j1k s ILE 29 Cb -0.16 -1.58 -0.04 0.00 0.01 0.00 0.00 42.46 40.69 2j1k s ILE 29 CO 0.07 0.48 0.06 -1.61 0.00 0.00 0.00 174.94 173.94 2j1k s GLU 30 N 1.29 3.91 0.06 2.79 2.02 -1.26 -0.69 118.70 126.82 2j1k s GLU 30 Ca 0.02 -0.37 0.01 0.00 0.02 0.00 0.00 54.97 54.64 2j1k s GLU 30 Cb -0.13 -3.22 -0.03 0.00 0.10 0.00 0.00 34.13 30.84 2j1k s GLU 30 CO -0.09 0.19 -0.05 0.15 0.02 0.00 0.00 175.26 175.49 2j1k s LYS 31 N 0.59 0.62 0.38 1.61 -0.14 -0.42 -4.99 119.74 117.38 2j1k s LYS 31 Ca 0.03 -1.08 -0.23 0.00 -1.36 0.00 0.00 55.97 53.32 2j1k s LYS 31 Cb -0.13 -0.02 -0.10 0.00 -1.68 0.00 0.00 37.83 35.90 2j1k s LYS 31 CO 0.01 -0.05 0.97 0.00 -0.76 0.00 0.00 175.35 175.53 2j1k s ALA 32 N -3.02 3.11 0.28 5.17 0.00 -1.26 -0.45 121.76 125.58 2j1k s ALA 32 Ca 0.02 0.51 -0.30 0.00 0.00 0.00 0.00 51.96 52.19 2j1k s ALA 32 Cb 0.01 -3.19 -0.13 0.00 0.00 0.00 0.00 23.12 19.82 2j1k s ALA 32 CO -0.05 0.07 1.41 1.17 0.00 0.00 0.00 175.76 178.36 2j1k n LYS 33 N -0.09 2.17 0.00 0.00 0.00 0.14 -1.82 118.16 118.57 2j1k n LYS 33 Ca 0.05 0.77 0.00 0.00 0.00 0.00 0.00 58.31 59.13 2j1k n LYS 33 Cb 0.52 -2.43 0.00 0.00 0.00 0.00 0.00 35.03 33.12 2j1k n LYS 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2j1k n GLY 34 N 1.79 3.06 3.76 3.14 0.00 0.14 -4.90 105.19 112.18 2j1k n GLY 34 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.31 1.00 -0.16 1.61 0.41 -0.76 -3.92 118.70 116.58 2j1k s GLU 35 Ca 0.00 0.35 -0.05 0.00 -0.41 0.00 0.00 54.97 54.86 2j1k s GLU 35 Cb 0.00 -1.82 -0.04 0.00 -1.78 0.00 0.00 34.13 30.50 2j1k s GLU 35 CO 0.00 -2.31 0.02 0.95 -0.49 0.00 0.00 175.26 173.43 2j1k s THR 36 N -3.20 4.44 -0.18 3.63 -4.23 -1.26 -0.63 115.64 114.20 2j1k s THR 36 Ca 0.64 -0.17 -0.21 0.00 -1.18 0.00 0.00 61.69 60.77 2j1k s THR 36 Cb -0.16 -2.96 -0.02 0.00 1.34 0.00 0.00 72.50 70.70 2j1k s THR 36 CO 0.54 0.50 0.65 0.00 -0.54 0.00 0.00 174.62 175.78 2j1k s ALA 37 N 0.13 3.53 -0.47 3.99 0.00 0.79 -4.89 121.76 124.84 2j1k s ALA 37 Ca 0.02 -0.21 -0.20 0.00 0.00 0.00 0.00 51.96 51.57 2j1k s ALA 37 Cb -0.13 -2.99 0.03 0.00 0.00 0.00 0.00 23.12 20.03 2j1k s ALA 37 CO 0.01 -0.52 0.66 -0.47 0.00 0.00 0.00 175.76 175.44 2j1k s TYR 38 N 1.84 3.04 -0.52 0.00 5.04 -1.26 -0.17 117.35 125.32 2j1k s TYR 38 Ca 0.30 -0.20 -0.17 0.00 -2.44 0.00 0.00 57.07 54.57 2j1k s TYR 38 Cb -0.16 -3.44 0.10 0.00 0.35 0.00 0.00 41.96 38.81 2j1k s TYR 38 CO 0.11 -0.95 0.51 -0.51 -1.34 0.00 0.00 175.55 173.37 2j1k s LEU 39 N 2.84 5.74 0.17 6.97 1.43 0.51 -5.00 118.68 131.34 2j1k s LEU 39 Ca 0.21 -1.48 -0.30 0.00 -1.03 0.00 0.00 54.13 51.53 2j1k s LEU 39 Cb -0.15 -2.24 -0.07 0.00 0.03 0.00 0.00 46.19 43.75 2j1k s LEU 39 CO 0.17 -0.82 1.03 -2.84 0.23 0.00 0.00 176.35 174.12 2j1k s PRO 40 N 1.88 4.67 -0.41 1.29 0.02 -1.26 -1.70 135.00 139.48 2j1k s PRO 40 Ca 0.06 1.60 0.04 0.00 0.02 0.00 0.00 61.00 62.72 2j1k s PRO 40 Cb -0.26 -3.31 0.17 0.00 0.02 0.00 0.00 34.50 31.12 2j1k s PRO 40 CO 0.06 0.19 0.41 0.00 -0.33 0.00 0.00 177.00 177.32 2j1k s LYS 42 N 0.66 3.51 0.10 0.00 1.02 -1.26 -0.09 119.74 123.67 2j1k s LYS 42 Ca 0.27 -0.26 0.05 0.00 0.02 0.00 0.00 55.97 56.05 2j1k s LYS 42 Cb -0.05 -3.11 -0.03 0.00 -0.52 0.00 0.00 37.83 34.12 2j1k s LYS 42 CO -0.10 0.60 -0.13 -0.59 -0.92 0.00 0.00 175.35 174.21 2j1k s PHE 43 N -0.56 1.25 -0.07 3.18 -0.12 0.86 -1.01 117.98 121.52 2j1k s PHE 43 Ca 0.11 -0.56 0.05 0.00 -0.05 0.00 0.00 56.93 56.49 2j1k s PHE 43 Cb -0.12 -0.67 -0.01 0.00 -0.63 0.00 0.00 43.02 41.59 2j1k s PHE 43 CO 0.02 0.08 -0.23 0.99 -0.05 0.00 0.00 175.22 176.03 2j1k s THR 44 N -1.98 1.91 0.18 -4.49 2.01 -0.67 -4.46 115.64 108.15 2j1k s THR 44 Ca 0.05 -0.97 0.02 0.00 0.31 0.00 0.00 61.69 61.09 2j1k s THR 44 Cb -0.06 -1.64 -0.04 0.00 0.01 0.00 0.00 72.50 70.78 2j1k s THR 44 CO 0.02 0.53 0.33 -0.76 -0.69 0.00 0.00 174.62 174.06 2j1k s LEU 45 N 0.04 4.29 0.20 4.42 1.43 -1.26 -2.55 118.68 125.25 2j1k s LEU 45 Ca -0.08 0.25 0.01 0.00 -1.03 0.00 0.00 54.13 53.27 2j1k s LEU 45 Cb -0.15 -3.00 -0.04 0.00 0.03 0.00 0.00 46.19 43.03 2j1k s LEU 45 CO 0.05 0.00 0.37 -0.55 0.23 0.00 0.00 176.35 176.45 2j1k s SER 46 N -3.29 6.36 0.56 2.29 0.15 -1.26 -4.85 113.70 113.66 2j1k s SER 46 Ca 0.36 0.31 0.25 0.00 0.70 0.00 0.00 55.95 57.57 2j1k s SER 46 Cb -0.11 -1.97 1.52 0.00 -1.71 0.00 0.00 66.02 63.75 2j1k s SER 46 CO 0.29 -0.04 2.10 1.55 1.20 0.00 0.00 173.24 178.34 2j1k h PRO 47 N 1.86 0.00 0.00 5.44 0.13 -1.99 -2.01 132.00 135.43 2j1k h PRO 47 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2j1k h PRO 47 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2j1k h PRO 47 CO 0.67 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.49 2j1k h GLU 48 N 0.00 0.00 -5.32 0.86 4.11 -1.95 -3.41 114.58 108.87 2j1k h GLU 48 Ca 0.10 0.00 -0.57 0.00 0.07 0.00 0.00 59.36 58.96 2j1k h GLU 48 Cb 0.46 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.67 2j1k h GLU 48 CO -0.00 0.00 1.99 -0.25 0.07 0.00 0.00 179.01 180.82 2j1k n ASP 49 N -2.88 3.93 -0.27 3.06 8.00 -0.76 -4.18 116.55 123.45 2j1k n ASP 49 Ca 0.02 -2.81 0.10 0.00 0.71 0.00 0.00 54.79 52.81 2j1k n ASP 49 Cb 0.35 -1.66 -0.06 0.00 -0.02 0.00 0.00 41.12 39.73 2j1k n ASP 49 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j1k n GLN 50 N 7.88 0.79 -1.25 -1.24 1.13 0.06 -4.77 117.38 119.99 2j1k n GLN 50 Ca 0.48 -0.54 -0.29 0.00 -1.94 0.00 0.00 57.00 54.71 2j1k n GLN 50 Cb 0.45 -1.46 0.20 0.00 0.11 0.00 0.00 30.24 29.53 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 -2.65 1.59 0.38 1.08 0.00 -0.24 -4.91 107.32 102.57 2j1k s GLY 51 Ca 0.13 -0.69 -0.26 0.00 0.00 0.00 0.00 44.72 43.90 2j1k s GLY 51 CO 0.68 0.03 1.18 2.56 0.00 0.00 0.00 173.10 177.56 2j1k s PRO 52 N -5.26 4.16 0.10 2.90 0.04 -1.26 -4.43 135.00 131.25 2j1k s PRO 52 Ca 0.68 1.87 -0.31 0.00 0.04 0.00 0.00 61.00 63.29 2j1k s PRO 52 Cb -0.13 -2.78 -0.07 0.00 0.04 0.00 0.00 34.50 31.56 2j1k s PRO 52 CO 0.56 -0.24 1.31 -1.17 0.04 0.00 0.00 177.00 177.50 2j1k s LEU 53 N -2.30 4.38 -0.30 -3.56 2.96 -1.26 -4.38 118.68 114.22 2j1k s LEU 53 Ca 0.55 2.21 -0.02 0.00 -0.22 0.00 0.00 54.13 56.64 2j1k s LEU 53 Cb -0.32 -3.59 0.12 0.00 0.50 0.00 0.00 46.19 42.90 2j1k s LEU 53 CO 0.40 -0.57 0.20 -0.62 -1.32 0.00 0.00 176.35 174.44 2j1k s ASP 54 N 1.01 2.81 0.07 3.68 2.15 -0.44 -4.26 116.67 121.69 2j1k s ASP 54 Ca 0.62 -1.18 0.08 0.00 0.43 0.00 0.00 52.55 52.49 2j1k s ASP 54 Cb -0.34 -0.04 -0.04 0.00 -0.30 0.00 0.00 42.92 42.21 2j1k s ASP 54 CO 0.30 -0.41 -0.18 -0.63 -0.17 0.00 0.00 175.17 174.09 2j1k s ILE 55 N 2.10 2.82 -0.17 4.11 1.01 0.39 -0.38 121.20 131.09 2j1k s ILE 55 Ca 0.10 -1.31 -0.08 0.00 0.00 0.00 0.00 60.65 59.36 2j1k s ILE 55 Cb -0.16 -2.23 0.07 0.00 0.01 0.00 0.00 42.46 40.15 2j1k s ILE 55 CO -0.32 0.24 0.40 -0.70 0.00 0.00 0.00 174.94 174.55 2j1k s GLU 56 N -1.73 0.35 -0.05 2.79 2.12 -0.51 -1.13 118.70 120.54 2j1k s GLU 56 Ca 0.16 0.83 -0.03 0.00 0.36 0.00 0.00 54.97 56.30 2j1k s GLU 56 Cb -0.11 0.05 -0.04 0.00 0.26 0.00 0.00 34.13 34.30 2j1k s GLU 56 CO 0.07 -0.19 0.09 -1.58 -0.54 0.00 0.00 175.26 173.12 2j1k s TRP 57 N 1.73 3.37 0.12 5.30 0.52 -0.36 -0.38 118.94 129.23 2j1k s TRP 57 Ca -0.07 0.30 0.05 0.00 0.02 0.00 0.00 56.10 56.40 2j1k s TRP 57 Cb -0.10 -1.81 -0.04 0.00 -1.15 0.00 0.00 33.47 30.38 2j1k s TRP 57 CO -0.12 0.59 -0.12 -0.51 0.02 0.00 0.00 176.95 176.81 2j1k s LEU 58 N -1.44 2.43 -0.04 2.99 1.43 0.31 -1.03 118.68 123.33 2j1k s LEU 58 Ca 0.20 -0.84 0.07 0.00 -1.03 0.00 0.00 54.13 52.52 2j1k s LEU 58 Cb -0.12 -0.44 -0.01 0.00 0.03 0.00 0.00 46.19 45.65 2j1k s LEU 58 CO 0.10 -0.21 -0.24 -0.51 0.23 0.00 0.00 176.35 175.72 2j1k s ILE 59 N -2.43 1.95 -0.46 -0.59 2.07 0.24 -0.41 121.20 121.57 2j1k s ILE 59 Ca 0.09 -1.03 -0.02 0.00 -1.41 0.00 0.00 60.65 58.28 2j1k s ILE 59 Cb -0.03 -1.64 0.12 0.00 0.13 0.00 0.00 42.46 41.04 2j1k s ILE 59 CO 0.02 0.55 0.25 -0.44 -1.91 0.00 0.00 174.94 173.40 2j1k s SER 60 N -0.34 5.15 0.42 4.50 0.01 0.14 -1.50 113.70 122.09 2j1k s SER 60 Ca 0.03 -2.28 -0.23 0.00 1.31 0.00 0.00 55.95 54.77 2j1k s SER 60 Cb -0.12 -1.80 -0.08 0.00 0.21 0.00 0.00 66.02 64.23 2j1k s SER 60 CO 0.01 -0.47 1.09 -2.16 0.41 0.00 0.00 173.24 172.12 2j1k s PRO 61 N 0.77 4.00 0.41 12.44 0.05 -1.26 -1.01 135.00 150.39 2j1k s PRO 61 Ca 0.11 1.60 0.19 0.00 0.05 0.00 0.00 61.00 62.95 2j1k s PRO 61 Cb -0.22 -2.47 0.85 0.00 0.05 0.00 0.00 34.50 32.71 2j1k s PRO 61 CO -0.04 -0.30 1.82 0.00 0.05 0.00 0.00 177.00 178.53 2j1k h ALA 62 N 2.29 1.14 -0.41 8.56 0.00 -1.85 -3.47 119.26 125.52 2j1k h ALA 62 Ca -0.49 -0.29 0.08 0.00 0.00 0.00 0.00 54.91 54.22 2j1k h ALA 62 Cb 1.23 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.87 2j1k h ALA 62 CO 0.61 0.40 -0.28 -0.44 0.00 0.00 0.00 179.25 179.55 2j1k h ASP 63 N 0.00 -0.93 -3.68 0.00 5.19 -1.88 -3.51 116.42 111.60 2j1k h ASP 63 Ca -0.00 0.18 -0.19 0.00 -0.62 0.00 0.00 57.03 56.40 2j1k h ASP 63 Cb 0.73 0.46 -0.27 0.00 0.18 0.00 0.00 39.33 40.42 2j1k h ASP 63 CO 0.04 -0.29 -0.50 -0.69 -3.12 0.00 0.00 179.24 174.69 2j1k s VAL 67 N -6.06 -0.01 -1.08 -1.35 1.01 -1.26 -5.24 120.40 106.41 2j1k s VAL 67 Ca -0.15 0.05 -0.18 0.00 0.00 0.00 0.00 61.98 61.70 2j1k s VAL 67 Cb 0.14 -0.30 -0.00 0.00 0.00 0.00 0.00 36.38 36.22 2j1k s VAL 67 CO 0.69 0.02 0.76 0.47 0.00 0.00 0.00 175.10 177.04 2j1k n ASP 68 N 3.33 -5.42 -4.56 3.32 9.92 -1.12 -4.96 116.55 117.06 2j1k n ASP 68 Ca -0.16 -0.96 -0.38 0.00 -0.53 0.00 0.00 54.79 52.75 2j1k n ASP 68 Cb 0.57 -3.25 -0.11 0.00 -0.64 0.00 0.00 41.12 37.69 2j1k n ASP 68 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 2j1k s GLN 69 N -5.74 3.79 0.34 -1.24 -1.52 -0.56 -4.88 119.66 109.84 2j1k s GLN 69 Ca 0.40 -0.43 -0.29 0.00 -1.95 0.00 0.00 55.36 53.09 2j1k s GLN 69 Cb -0.15 -3.66 -0.11 0.00 -0.22 0.00 0.00 33.01 28.87 2j1k s GLN 69 CO 0.86 -0.25 1.51 0.28 -0.25 0.00 0.00 175.29 177.45 2j1k n VAL 70 N 5.05 1.58 -0.04 1.09 0.31 -1.26 -0.60 118.33 124.47 2j1k n VAL 70 Ca -0.14 -0.39 -0.05 0.00 -0.01 0.00 0.00 64.34 63.75 2j1k n VAL 70 Cb 0.51 -1.92 -0.05 0.00 -0.91 0.00 0.00 33.84 31.47 2j1k n VAL 70 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 2j1k n ILE 71 N 1.14 0.51 -3.59 2.52 -5.35 -0.20 -3.98 119.36 110.41 2j1k n ILE 71 Ca 0.05 -0.24 -0.16 0.00 -0.27 0.00 0.00 62.75 62.13 2j1k n ILE 71 Cb 0.38 -0.82 -0.07 0.00 -1.74 0.00 0.00 39.64 37.39 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 -2.18 0.00 0.08 7.28 2.07 -1.23 -4.45 121.20 122.77 2j1k s ILE 72 Ca -0.08 -0.02 0.07 0.00 -1.41 0.00 0.00 60.65 59.20 2j1k s ILE 72 Cb 0.03 -0.96 -0.03 0.00 0.13 0.00 0.00 42.46 41.63 2j1k s ILE 72 CO 0.25 -0.01 -0.17 -0.76 -1.91 0.00 0.00 174.94 172.33 2j1k s LEU 73 N -0.35 2.26 -0.22 8.50 1.43 0.33 -1.23 118.68 129.40 2j1k s LEU 73 Ca -0.05 -0.62 0.01 0.00 -1.03 0.00 0.00 54.13 52.44 2j1k s LEU 73 Cb -0.03 -0.72 0.05 0.00 0.03 0.00 0.00 46.19 45.52 2j1k s LEU 73 CO 0.05 0.01 -0.11 -0.47 0.23 0.00 0.00 176.35 176.06 2j1k s TYR 74 N -1.14 2.69 -0.11 0.29 5.04 -0.28 -1.52 117.35 122.32 2j1k s TYR 74 Ca 0.03 -1.81 -0.10 0.00 -2.44 0.00 0.00 57.07 52.74 2j1k s TYR 74 Cb -0.10 -1.75 0.03 0.00 0.35 0.00 0.00 41.96 40.50 2j1k s TYR 74 CO 0.03 -0.79 0.30 -1.54 -1.34 0.00 0.00 175.55 172.20 2j1k s SER 75 N 1.30 -0.30 -1.10 4.32 1.04 -0.84 -0.46 113.70 117.66 2j1k s SER 75 Ca -0.03 0.57 -0.04 0.00 0.48 0.00 0.00 55.95 56.93 2j1k s SER 75 Cb -0.17 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.54 2j1k s SER 75 CO -0.08 -0.12 0.49 0.61 0.98 0.00 0.00 173.24 175.12 2j1k n GLY 76 N 2.84 -0.17 2.48 7.32 0.00 -1.26 -2.22 105.19 114.18 2j1k n GLY 76 Ca -0.13 -0.11 -0.21 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.35 -5.76 -4.08 1.61 9.92 -1.26 -4.99 116.55 110.63 2j1k n ASP 77 Ca -0.07 0.19 -0.17 0.00 -0.53 0.00 0.00 54.79 54.21 2j1k n ASP 77 Cb 0.58 -4.90 -0.13 0.00 -0.64 0.00 0.00 41.12 36.04 2j1k n ASP 77 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2j1k s LYS 78 N -4.54 0.68 -0.20 -1.24 1.02 -0.94 -5.14 119.74 109.38 2j1k s LYS 78 Ca 0.00 -0.65 -0.07 0.00 0.02 0.00 0.00 55.97 55.27 2j1k s LYS 78 Cb 0.00 -0.60 -0.04 0.00 -0.52 0.00 0.00 37.83 36.67 2j1k s LYS 78 CO 0.00 0.14 0.05 0.42 -0.92 0.00 0.00 175.35 175.04 2j1k s ILE 79 N -0.91 4.57 -0.15 2.17 1.01 -1.26 -1.99 121.20 124.65 2j1k s ILE 79 Ca -0.03 -0.11 0.02 0.00 0.00 0.00 0.00 60.65 60.54 2j1k s ILE 79 Cb -0.08 -3.07 0.01 0.00 0.01 0.00 0.00 42.46 39.34 2j1k s ILE 79 CO 0.01 0.43 -0.20 -0.31 0.00 0.00 0.00 174.94 174.86 2j1k s TYR 80 N 0.68 2.60 -0.01 3.97 2.02 -0.57 -5.00 117.35 121.04 2j1k s TYR 80 Ca 0.03 -1.38 0.03 0.00 -0.37 0.00 0.00 57.07 55.37 2j1k s TYR 80 Cb -0.13 -1.79 0.04 0.00 -0.40 0.00 0.00 41.96 39.68 2j1k s TYR 80 CO 0.02 -0.66 1.02 -0.40 -1.57 0.00 0.00 175.55 173.96 2j1k n ASP 81 N 4.27 0.28 -3.54 2.29 5.68 -1.26 -0.52 116.55 123.76 2j1k n ASP 81 Ca -0.20 -2.12 -0.34 0.00 -0.50 0.00 0.00 54.79 51.62 2j1k n ASP 81 Cb 0.51 -0.23 -0.03 0.00 -1.14 0.00 0.00 41.12 40.23 2j1k n ASP 81 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2j1k n ASP 82 N -0.14 5.37 0.00 -1.12 9.92 -1.26 -4.67 116.55 124.64 2j1k n ASP 82 Ca 0.02 -3.53 0.00 0.00 -0.53 0.00 0.00 54.79 50.75 2j1k n ASP 82 Cb 0.71 -0.92 0.00 0.00 -0.64 0.00 0.00 41.12 40.27 2j1k n ASP 82 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2j1k n TYR 83 N 0.59 0.00 -3.71 1.24 4.01 -1.26 -5.00 117.16 113.03 2j1k n TYR 83 Ca 0.32 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.68 2j1k n TYR 83 Cb 0.35 0.01 -0.11 0.00 -0.31 0.00 0.00 39.34 39.29 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 -1.88 3.50 0.30 -0.72 5.04 -1.26 -4.99 117.35 117.34 2j1k s TYR 84 Ca 0.00 -2.15 0.05 0.00 -2.44 0.00 0.00 57.07 52.54 2j1k s TYR 84 Cb 0.00 -3.18 0.71 0.00 0.35 0.00 0.00 41.96 39.84 2j1k s TYR 84 CO 0.00 -0.95 1.79 -1.35 -1.34 0.00 0.00 175.55 173.70 2j1k h PRO 85 N 8.18 0.79 0.00 4.97 0.11 -1.95 -1.93 132.00 142.17 2j1k h PRO 85 Ca -0.17 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.89 2j1k h PRO 85 Cb 1.06 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.99 2j1k h PRO 85 CO 0.73 0.52 -0.03 -0.44 -0.21 0.00 0.00 178.00 178.57 2j1k h ASP 86 N 0.81 0.00 -0.31 -2.05 3.45 -2.03 -2.13 116.42 114.16 2j1k h ASP 86 Ca 0.56 0.00 0.00 0.00 0.43 0.00 0.00 57.03 58.02 2j1k h ASP 86 Cb 0.81 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.58 2j1k h ASP 86 CO -0.35 0.03 0.00 0.18 -1.57 0.00 0.00 179.24 177.53 2j1k n LEU 87 N -3.24 3.04 -4.51 1.55 4.77 -0.73 -5.00 117.00 112.88 2j1k n LEU 87 Ca -0.02 -1.52 -0.60 0.00 -0.03 0.00 0.00 56.01 53.84 2j1k n LEU 87 Cb 0.19 -0.20 -0.09 0.00 -2.33 0.00 0.00 43.42 40.99 2j1k n LEU 87 CO 0.25 0.67 1.52 1.17 -1.33 0.00 0.00 177.39 179.67 2j1k n LYS 88 N 1.09 0.47 -0.95 3.23 3.00 -0.80 -0.40 118.16 123.81 2j1k n LYS 88 Ca 0.15 0.15 0.00 0.00 -0.00 0.00 0.00 58.31 58.61 2j1k n LYS 88 Cb 0.50 -1.82 0.00 0.00 0.00 0.00 0.00 35.03 33.70 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 5.77 0.89 0.00 3.14 0.00 -1.26 -4.87 105.19 108.85 2j1k n GLY 89 Ca 0.40 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.46 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 -2.18 3.57 -4.52 1.61 1.74 0.47 -4.98 116.66 112.35 2j1k n ARG 90 Ca 0.00 -0.02 -0.34 0.00 -0.77 0.00 0.00 57.85 56.73 2j1k n ARG 90 Cb 0.00 -0.92 -0.12 0.00 -1.02 0.00 0.00 32.46 30.40 2j1k n ARG 90 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2j1k s VAL 91 N -1.88 3.79 -0.12 1.55 1.01 -1.21 -0.78 120.40 122.75 2j1k s VAL 91 Ca 0.01 -0.42 -0.29 0.00 0.00 0.00 0.00 61.98 61.28 2j1k s VAL 91 Cb 0.05 -2.60 0.07 0.00 0.00 0.00 0.00 36.38 33.91 2j1k s VAL 91 CO 0.30 0.55 0.72 -1.38 0.00 0.00 0.00 175.10 175.29 2j1k s HIS 92 N -0.26 -0.67 0.33 5.22 -3.43 -0.94 -5.01 115.29 110.53 2j1k s HIS 92 Ca 0.04 1.32 -0.29 0.00 -0.80 0.00 0.00 55.06 55.33 2j1k s HIS 92 Cb -0.13 0.37 -0.10 0.00 -1.43 0.00 0.00 32.58 31.29 2j1k s HIS 92 CO 0.02 -0.52 1.31 -0.06 -2.00 0.00 0.00 174.74 173.49 2j1k s PHE 93 N -0.72 3.04 -0.08 0.38 0.08 -1.26 -0.44 117.98 118.98 2j1k s PHE 93 Ca -0.07 1.41 0.05 0.00 0.12 0.00 0.00 56.93 58.44 2j1k s PHE 93 Cb -0.02 -3.68 -0.24 0.00 -0.57 0.00 0.00 43.02 38.51 2j1k s PHE 93 CO 0.07 -1.88 0.50 0.25 -0.10 0.00 0.00 175.22 174.06 2j1k n THR 94 N 0.81 1.66 -2.44 0.64 -2.24 -0.73 -4.83 114.28 107.15 2j1k n THR 94 Ca 0.00 -0.74 -0.38 0.00 -2.27 0.00 0.00 64.05 60.66 2j1k n THR 94 Cb 0.42 -1.28 -0.04 0.00 -2.10 0.00 0.00 70.33 67.33 2j1k n THR 94 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2j1k s SER 95 N -6.43 6.86 -0.07 3.42 0.15 -1.26 -4.98 113.70 111.39 2j1k s SER 95 Ca -0.12 2.21 -0.21 0.00 0.70 0.00 0.00 55.95 58.53 2j1k s SER 95 Cb 0.07 -2.61 -0.17 0.00 -1.71 0.00 0.00 66.02 61.61 2j1k s SER 95 CO 0.80 -0.43 0.82 -0.55 1.20 0.00 0.00 173.24 175.08 2j1k h ASN 96 N 2.99 -0.12 -3.34 5.45 7.08 -1.93 -3.39 115.58 122.33 2j1k h ASN 96 Ca -0.48 -0.45 -0.78 0.00 -3.08 0.00 0.00 56.30 51.51 2j1k h ASN 96 Cb 1.22 0.03 -0.25 0.00 -2.08 0.00 0.00 38.32 37.24 2j1k h ASN 96 CO 0.64 0.50 0.55 -0.62 -2.08 0.00 0.00 177.43 176.42 2j1k s ASP 97 N -5.63 7.15 0.43 6.14 2.15 -1.26 -4.88 116.67 120.78 2j1k s ASP 97 Ca -0.13 -3.27 0.20 0.00 0.43 0.00 0.00 52.55 49.78 2j1k s ASP 97 Cb -0.00 -2.25 0.98 0.00 -0.30 0.00 0.00 42.92 41.35 2j1k s ASP 97 CO 0.49 -0.45 1.90 0.25 -0.17 0.00 0.00 175.17 177.19 2j1k h LEU 98 N 7.53 0.00 -1.26 -1.34 6.46 -1.81 -2.86 115.31 122.04 2j1k h LEU 98 Ca 0.19 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.95 2j1k h LEU 98 Cb 0.91 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.84 2j1k h LEU 98 CO 1.01 0.27 0.00 0.11 -0.62 0.00 0.00 178.44 179.21 2j1k h LYS 99 N 0.00 0.00 0.00 1.25 6.56 -1.89 -2.84 116.57 119.65 2j1k h LYS 99 Ca -0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2j1k h LYS 99 Cb 0.59 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.25 2j1k h LYS 99 CO 0.04 0.00 0.00 -1.13 -2.06 0.00 0.00 179.45 176.30 2j1k n SER 100 N -2.98 0.00 0.00 0.86 3.41 -1.08 -4.80 113.62 109.03 2j1k n SER 100 Ca 0.01 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 2j1k n SER 100 Cb 0.31 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 2j1k n SER 100 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2j1k n GLY 101 N 0.44 1.07 2.68 5.00 0.00 -1.16 -4.98 105.19 108.25 2j1k n GLY 101 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.11 3.59 -0.15 1.61 -1.08 -1.08 -0.10 116.67 118.35 2j1k s ASP 102 Ca 0.00 -2.50 0.10 0.00 -0.52 0.00 0.00 52.55 49.63 2j1k s ASP 102 Cb 0.00 -0.94 0.56 0.00 -1.46 0.00 0.00 42.92 41.08 2j1k s ASP 102 CO 0.00 -0.28 1.37 0.00 0.52 0.00 0.00 175.17 176.77 2j1k n ALA 103 N 3.70 3.37 -1.76 3.66 0.00 0.87 -4.52 120.51 125.83 2j1k n ALA 103 Ca 0.08 -1.29 -0.36 0.00 0.00 0.00 0.00 53.44 51.87 2j1k n ALA 103 Cb 0.35 -1.08 0.03 0.00 0.00 0.00 0.00 19.45 18.75 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 -0.58 5.40 0.13 0.00 0.01 -1.18 -4.55 113.70 112.93 2j1k s SER 104 Ca 0.37 2.42 0.09 0.00 1.31 0.00 0.00 55.95 60.14 2j1k s SER 104 Cb 0.28 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.87 2j1k s SER 104 CO 0.12 -1.45 -0.21 0.27 0.41 0.00 0.00 173.24 172.38 2j1k s ILE 105 N -1.55 1.83 0.02 1.44 -4.36 -0.69 -1.77 121.20 116.11 2j1k s ILE 105 Ca 0.74 -1.70 -0.14 0.00 -0.26 0.00 0.00 60.65 59.29 2j1k s ILE 105 Cb -0.31 -1.71 -0.06 0.00 1.25 0.00 0.00 42.46 41.63 2j1k s ILE 105 CO 0.35 -0.13 0.40 0.20 0.24 0.00 0.00 174.94 176.01 2j1k s ASN 106 N -2.19 6.77 -0.29 4.36 0.01 0.42 -0.36 114.94 123.66 2j1k s ASN 106 Ca 0.11 0.93 -0.00 0.00 -0.71 0.00 0.00 52.86 53.18 2j1k s ASN 106 Cb -0.09 -2.24 0.06 0.00 0.41 0.00 0.00 41.25 39.40 2j1k s ASN 106 CO 0.05 0.30 -0.03 -0.69 -1.51 0.00 0.00 177.10 175.22 2j1k s VAL 107 N -1.14 2.70 0.45 1.60 1.01 0.76 -2.22 120.40 123.56 2j1k s VAL 107 Ca 0.25 -1.53 -0.03 0.00 0.00 0.00 0.00 61.98 60.68 2j1k s VAL 107 Cb -0.16 -2.59 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 2j1k s VAL 107 CO 0.14 -0.12 0.71 0.42 0.00 0.00 0.00 175.10 176.25 2j1k s THR 108 N 1.19 4.65 -1.26 3.92 -4.23 0.04 -0.15 115.64 119.79 2j1k s THR 108 Ca -0.05 -0.15 -0.13 0.00 -1.18 0.00 0.00 61.69 60.18 2j1k s THR 108 Cb -0.20 -3.74 -0.00 0.00 1.34 0.00 0.00 72.50 69.90 2j1k s THR 108 CO -0.03 -0.62 0.62 -3.20 -0.54 0.00 0.00 174.62 170.85 2j1k n ASN 109 N -2.13 -3.01 -4.64 3.99 5.15 -1.20 -4.84 115.26 108.58 2j1k n ASN 109 Ca -0.00 -1.03 -0.39 0.00 -0.60 0.00 0.00 54.58 52.55 2j1k n ASN 109 Cb 0.56 -3.11 0.03 0.00 -0.53 0.00 0.00 39.78 36.74 2j1k n ASN 109 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2j1k n LEU 110 N -4.35 3.58 -4.31 1.20 4.77 0.20 -4.60 117.00 113.48 2j1k n LEU 110 Ca -0.19 0.93 -0.16 0.00 -0.03 0.00 0.00 56.01 56.56 2j1k n LEU 110 Cb 0.63 -1.41 -0.10 0.00 -2.33 0.00 0.00 43.42 40.21 2j1k n LEU 110 CO 0.71 -1.45 -0.32 0.00 -1.33 0.00 0.00 177.39 175.00 2j1k s GLN 111 N -2.46 1.31 0.53 3.23 -2.07 -1.26 0.25 119.66 119.18 2j1k s GLN 111 Ca 0.69 -1.66 0.27 0.00 -1.82 0.00 0.00 55.36 52.84 2j1k s GLN 111 Cb -0.47 -0.52 1.50 0.00 -1.09 0.00 0.00 33.01 32.43 2j1k s GLN 111 CO 0.52 -0.13 2.11 -0.07 -1.32 0.00 0.00 175.29 176.40 2j1k h LEU 112 N 2.50 0.00 -0.73 2.60 3.38 -1.96 -1.76 115.31 119.34 2j1k h LEU 112 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2j1k h LEU 112 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2j1k h LEU 112 CO 0.64 0.10 0.00 0.28 0.09 0.00 0.00 178.44 179.55 2j1k h SER 113 N 0.00 0.00 0.22 -0.43 0.02 -1.96 -3.04 113.55 108.36 2j1k h SER 113 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2j1k h SER 113 Cb 0.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.79 2j1k h SER 113 CO 0.01 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.17 2j1k n ASP 114 N -2.41 0.00 -4.71 3.07 8.00 -0.66 -4.84 116.55 115.00 2j1k n ASP 114 Ca 0.02 -0.55 -0.42 0.00 0.71 0.00 0.00 54.79 54.56 2j1k n ASP 114 Cb 0.28 -0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 41.22 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 -2.25 3.04 0.00 0.53 1.01 -1.15 -4.90 121.20 117.48 2j1k s ILE 115 Ca 0.35 0.66 0.00 0.00 0.00 0.00 0.00 60.65 61.66 2j1k s ILE 115 Cb 0.19 -3.42 0.00 0.00 0.01 0.00 0.00 42.46 39.24 2j1k s ILE 115 CO 0.37 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.94 2j1k n GLY 116 N 3.75 0.31 3.72 6.18 0.00 -1.15 -2.53 105.19 115.47 2j1k n GLY 116 Ca 0.14 -1.09 -0.38 0.00 0.00 0.00 0.00 46.02 44.69 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 -2.00 5.20 -0.20 2.61 2.01 -0.18 -1.82 115.64 121.26 2j1k s THR 117 Ca 0.00 0.89 -0.04 0.00 0.31 0.00 0.00 61.69 62.86 2j1k s THR 117 Cb 0.00 -3.79 -0.01 0.00 0.01 0.00 0.00 72.50 68.71 2j1k s THR 117 CO 0.00 0.34 -0.04 -0.31 -0.69 0.00 0.00 174.62 173.91 2j1k s TYR 118 N 0.59 2.96 -0.16 4.92 2.02 0.88 0.28 117.35 128.84 2j1k s TYR 118 Ca 0.25 -0.78 -0.04 0.00 -0.37 0.00 0.00 57.07 56.13 2j1k s TYR 118 Cb -0.15 -2.07 -0.03 0.00 -0.40 0.00 0.00 41.96 39.32 2j1k s TYR 118 CO 0.09 -0.43 -0.03 -1.14 -1.57 0.00 0.00 175.55 172.47 2j1k s GLN 119 N 1.21 3.68 -0.26 -0.62 0.74 0.45 -0.29 119.66 124.58 2j1k s GLN 119 Ca 0.03 -0.51 -0.09 0.00 0.05 0.00 0.00 55.36 54.84 2j1k s GLN 119 Cb -0.14 -2.92 -0.04 0.00 1.10 0.00 0.00 33.01 31.00 2j1k s GLN 119 CO -0.01 0.25 0.11 0.00 -0.55 0.00 0.00 175.29 175.09 2j1k s LYS 121 N 1.57 2.58 -0.19 0.00 1.02 0.49 -0.65 119.74 124.55 2j1k s LYS 121 Ca 0.06 -1.15 -0.03 0.00 0.02 0.00 0.00 55.97 54.88 2j1k s LYS 121 Cb -0.15 -3.04 -0.01 0.00 -0.52 0.00 0.00 37.83 34.11 2j1k s LYS 121 CO 0.06 -0.51 -0.06 0.08 -0.92 0.00 0.00 175.35 174.00 2j1k s VAL 122 N 1.26 3.36 -0.06 3.17 1.01 -0.06 -1.43 120.40 127.64 2j1k s VAL 122 Ca -0.03 -0.51 0.05 0.00 0.00 0.00 0.00 61.98 61.49 2j1k s VAL 122 Cb -0.18 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.69 2j1k s VAL 122 CO -0.03 0.45 -0.22 -0.54 0.00 0.00 0.00 175.10 174.76 2j1k s LYS 123 N 1.13 2.59 -0.36 2.72 1.02 0.49 -1.44 119.74 125.89 2j1k s LYS 123 Ca 0.01 -0.85 0.04 0.00 0.02 0.00 0.00 55.97 55.19 2j1k s LYS 123 Cb -0.15 -2.23 0.16 0.00 -0.52 0.00 0.00 37.83 35.09 2j1k s LYS 123 CO -0.01 0.42 0.42 0.21 -0.92 0.00 0.00 175.35 175.46 2j1k s LYS 124 N -0.23 0.63 0.39 1.68 2.20 -0.51 -1.33 119.74 122.57 2j1k s LYS 124 Ca -0.01 -0.61 -0.26 0.00 -0.36 0.00 0.00 55.97 54.72 2j1k s LYS 124 Cb -0.13 -0.54 -0.11 0.00 -1.51 0.00 0.00 37.83 35.54 2j1k s LYS 124 CO 0.03 -1.17 1.26 0.00 -0.36 0.00 0.00 175.35 175.12 2j1k n ALA 125 N 4.45 1.24 1.29 3.13 0.00 -1.26 -0.90 120.51 128.46 2j1k n ALA 125 Ca 0.09 0.29 0.12 0.00 0.00 0.00 0.00 53.44 53.95 2j1k n ALA 125 Cb 0.48 -2.25 0.65 0.00 0.00 0.00 0.00 19.45 18.32 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 0.22 0.52 -2.07 0.00 -0.04 -1.26 -0.76 135.00 131.61 2j1k n PRO 126 Ca 0.06 0.04 -0.40 0.00 -0.04 0.00 0.00 63.50 63.15 2j1k n PRO 126 Cb 0.38 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.33 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 -2.32 2.98 -0.14 0.55 0.00 -0.08 -5.03 107.32 103.28 2j1k s GLY 127 Ca 0.29 1.28 -0.07 0.00 0.00 0.00 0.00 44.72 46.22 2j1k s GLY 127 CO 0.32 1.92 0.31 0.14 0.00 0.00 0.00 173.10 175.80 2j1k s VAL 128 N -1.17 -0.13 0.01 1.40 1.01 -1.26 -1.42 120.40 118.84 2j1k s VAL 128 Ca 0.51 0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.56 2j1k s VAL 128 Cb -0.40 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.50 2j1k s VAL 128 CO 0.53 0.06 0.16 0.00 0.00 0.00 0.00 175.10 175.86 2j1k s ALA 129 N 1.58 -0.38 0.08 5.51 0.00 -0.52 -4.89 121.76 123.14 2j1k s ALA 129 Ca -0.07 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 51.79 2j1k s ALA 129 Cb -0.10 0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 2j1k s ALA 129 CO -0.10 -0.24 -0.06 0.54 0.00 0.00 0.00 175.76 175.90 2j1k s ASN 130 N -1.49 0.97 0.00 0.00 2.20 -1.26 -0.88 114.94 114.49 2j1k s ASN 130 Ca -0.13 -0.93 0.02 0.00 -0.94 0.00 0.00 52.86 50.88 2j1k s ASN 130 Cb -0.06 0.10 -0.01 0.00 -2.00 0.00 0.00 41.25 39.28 2j1k s ASN 130 CO 0.01 -0.45 -0.07 -0.75 -2.94 0.00 0.00 177.10 172.91 2j1k s LYS 131 N -3.46 0.52 -0.09 3.55 2.20 0.18 -4.86 119.74 117.78 2j1k s LYS 131 Ca 0.07 -0.32 0.02 0.00 -0.36 0.00 0.00 55.97 55.39 2j1k s LYS 131 Cb 0.03 -0.48 -0.02 0.00 -1.51 0.00 0.00 37.83 35.85 2j1k s LYS 131 CO -0.05 0.13 -0.15 0.15 -0.36 0.00 0.00 175.35 175.07 2j1k s LYS 132 N -0.38 2.89 -0.12 4.03 1.02 -0.99 -0.21 119.74 125.98 2j1k s LYS 132 Ca 0.01 -0.71 0.01 0.00 0.02 0.00 0.00 55.97 55.30 2j1k s LYS 132 Cb -0.04 -2.46 0.02 0.00 -0.52 0.00 0.00 37.83 34.83 2j1k s LYS 132 CO -0.00 0.42 -0.16 0.42 -0.92 0.00 0.00 175.35 175.11 2j1k s ILE 133 N -0.20 1.59 -0.51 2.17 1.01 0.60 -2.09 121.20 123.77 2j1k s ILE 133 Ca -0.00 -0.69 -0.20 0.00 0.00 0.00 0.00 60.65 59.76 2j1k s ILE 133 Cb -0.13 -1.46 0.05 0.00 0.01 0.00 0.00 42.46 40.94 2j1k s ILE 133 CO 0.03 0.46 0.70 -1.00 0.00 0.00 0.00 174.94 175.13 2j1k s HIS 134 N 1.08 2.99 -0.22 3.97 3.76 0.03 -0.08 115.29 126.82 2j1k s HIS 134 Ca -0.04 -0.41 -0.16 0.00 -0.15 0.00 0.00 55.06 54.29 2j1k s HIS 134 Cb -0.14 -3.65 -0.04 0.00 1.11 0.00 0.00 32.58 29.86 2j1k s HIS 134 CO -0.04 -1.10 0.43 -1.17 -0.85 0.00 0.00 174.74 172.01 2j1k s LEU 135 N 2.93 4.13 -0.11 0.89 2.96 -0.76 -1.24 118.68 127.48 2j1k s LEU 135 Ca 0.19 0.52 -0.00 0.00 -0.22 0.00 0.00 54.13 54.61 2j1k s LEU 135 Cb -0.18 -2.56 -0.02 0.00 0.50 0.00 0.00 46.19 43.93 2j1k s LEU 135 CO 0.14 -0.13 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.26 2j1k s VAL 136 N 1.57 3.53 -0.26 1.68 1.01 0.14 -2.92 120.40 125.15 2j1k s VAL 136 Ca 0.20 -0.51 -0.05 0.00 0.00 0.00 0.00 61.98 61.62 2j1k s VAL 136 Cb -0.15 -2.48 0.01 0.00 0.00 0.00 0.00 36.38 33.75 2j1k s VAL 136 CO 0.09 0.55 0.01 -0.69 0.00 0.00 0.00 175.10 175.05 2j1k s VAL 137 N -0.16 3.52 0.07 2.92 1.01 -1.26 -1.30 120.40 125.21 2j1k s VAL 137 Ca 0.01 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.30 2j1k s VAL 137 Cb -0.13 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 2j1k s VAL 137 CO 0.03 0.22 0.22 -0.76 0.00 0.00 0.00 175.10 174.81 2j1k s LEU 138 N 1.45 4.33 0.00 3.92 1.43 0.40 -4.83 118.68 125.39 2j1k s LEU 138 Ca 0.03 0.24 0.25 0.00 -1.03 0.00 0.00 54.13 53.62 2j1k s LEU 138 Cb -0.16 -2.93 1.48 0.00 0.03 0.00 0.00 46.19 44.61 2j1k s LEU 138 CO -0.01 0.15 1.84 0.52 0.23 0.00 0.00 176.35 179.09