#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 4.45 0.03 1.04 0.20 -1.26 -4.43 118.68 118.71 2j1k s LEU 20 Ca 0.00 1.95 -0.12 0.00 0.69 0.00 0.00 54.13 56.64 2j1k s LEU 20 Cb 0.00 -3.59 0.01 0.00 -0.43 0.00 0.00 46.19 42.18 2j1k s LEU 20 CO 0.00 -0.23 0.26 -0.94 -0.29 0.00 0.00 176.35 175.15 2j1k s SER 21 N 0.28 -0.07 -0.05 3.68 1.04 -1.06 -4.62 113.70 112.89 2j1k s SER 21 Ca 0.51 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.74 2j1k s SER 21 Cb -0.27 0.32 -0.03 0.00 0.10 0.00 0.00 66.02 66.14 2j1k s SER 21 CO 0.32 -0.55 -0.03 -0.63 0.98 0.00 0.00 173.24 173.32 2j1k s ILE 22 N -2.26 3.98 -0.13 -1.02 1.01 -1.26 -0.89 121.20 120.62 2j1k s ILE 22 Ca -0.07 -0.47 -0.29 0.00 0.00 0.00 0.00 60.65 59.82 2j1k s ILE 22 Cb -0.02 -2.69 -0.02 0.00 0.01 0.00 0.00 42.46 39.74 2j1k s ILE 22 CO -0.02 0.53 1.27 -0.89 0.00 0.00 0.00 174.94 175.83 2j1k s THR 23 N -0.91 4.24 -0.29 2.92 2.01 -0.21 -4.17 115.64 119.23 2j1k s THR 23 Ca 0.15 1.51 -0.02 0.00 0.31 0.00 0.00 61.69 63.64 2j1k s THR 23 Cb -0.11 -3.98 0.01 0.00 0.01 0.00 0.00 72.50 68.43 2j1k s THR 23 CO 0.04 -0.10 0.05 0.41 -0.69 0.00 0.00 174.62 174.33 2j1k n THR 24 N 5.20-12.31 1.78 -0.82 -1.04 -1.26 -4.73 114.28 101.10 2j1k n THR 24 Ca 0.13 2.05 0.10 0.00 -2.04 0.00 0.00 64.05 64.30 2j1k n THR 24 Cb 0.45 -6.89 0.61 0.00 -1.82 0.00 0.00 70.33 62.67 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 0.90 0.89 -3.70 -2.82 -0.05 -1.26 -4.73 135.00 124.23 2j1k n PRO 25 Ca -0.08 0.00 -0.13 0.00 -0.05 0.00 0.00 63.50 63.24 2j1k n PRO 25 Cb 0.13 -1.36 -0.09 0.00 -0.05 0.00 0.00 33.50 32.12 2j1k n PRO 25 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 175.50 173.45 2j1k s GLU 26 N -2.00 0.55 0.02 0.54 2.12 -1.26 -1.59 118.70 117.09 2j1k s GLU 26 Ca 0.31 0.73 -0.04 0.00 0.36 0.00 0.00 54.97 56.33 2j1k s GLU 26 Cb 0.14 0.22 -0.01 0.00 0.26 0.00 0.00 34.13 34.74 2j1k s GLU 26 CO 0.24 -0.09 0.05 -1.21 -0.54 0.00 0.00 175.26 173.71 2j1k s GLU 27 N 0.52 0.47 -0.11 4.30 2.02 -0.69 -5.00 118.70 120.20 2j1k s GLU 27 Ca -0.02 -0.65 -0.01 0.00 0.02 0.00 0.00 54.97 54.31 2j1k s GLU 27 Cb -0.04 0.18 -0.03 0.00 0.10 0.00 0.00 34.13 34.34 2j1k s GLU 27 CO -0.03 -0.10 -0.06 -1.64 0.02 0.00 0.00 175.26 173.46 2j1k s MET 28 N -1.99 3.17 -0.07 1.61 -1.94 -1.26 -0.72 119.30 118.10 2j1k s MET 28 Ca -0.10 -0.54 -0.00 0.00 -1.71 0.00 0.00 55.69 53.33 2j1k s MET 28 Cb -0.05 -2.73 0.03 0.00 2.01 0.00 0.00 34.83 34.08 2j1k s MET 28 CO -0.02 0.47 -0.02 0.42 -0.01 0.00 0.00 175.02 175.86 2j1k s ILE 29 N -0.27 0.47 -0.18 2.53 1.01 -0.40 -4.94 121.20 119.42 2j1k s ILE 29 Ca 0.04 0.01 -0.11 0.00 0.00 0.00 0.00 60.65 60.60 2j1k s ILE 29 Cb -0.13 -0.58 -0.05 0.00 0.01 0.00 0.00 42.46 41.72 2j1k s ILE 29 CO 0.02 0.26 0.18 -1.61 0.00 0.00 0.00 174.94 173.79 2j1k s GLU 30 N 1.60 4.12 0.14 2.79 2.02 -1.26 -4.38 118.70 123.74 2j1k s GLU 30 Ca -0.00 -0.12 -0.03 0.00 0.02 0.00 0.00 54.97 54.84 2j1k s GLU 30 Cb -0.13 -3.39 -0.03 0.00 0.10 0.00 0.00 34.13 30.67 2j1k s GLU 30 CO -0.04 0.34 0.11 0.15 0.02 0.00 0.00 175.26 175.84 2j1k s LYS 31 N 0.21 1.00 0.33 1.61 -0.14 -1.26 -5.13 119.74 116.36 2j1k s LYS 31 Ca 0.11 -1.40 0.07 0.00 -1.36 0.00 0.00 55.97 53.40 2j1k s LYS 31 Cb -0.12 0.27 -0.03 0.00 -1.68 0.00 0.00 37.83 36.28 2j1k s LYS 31 CO 0.00 -0.31 0.30 0.00 -0.76 0.00 0.00 175.35 174.58 2j1k s ALA 32 N -4.04 3.84 0.24 5.17 0.00 -1.26 -5.07 121.76 120.65 2j1k s ALA 32 Ca 0.24 -1.63 -0.31 0.00 0.00 0.00 0.00 51.96 50.25 2j1k s ALA 32 Cb 0.07 -1.20 -0.12 0.00 0.00 0.00 0.00 23.12 21.86 2j1k s ALA 32 CO 0.02 0.02 1.64 1.63 0.00 0.00 0.00 175.76 179.07 2j1k n LYS 33 N -1.38 2.65 0.00 0.00 5.02 -1.26 -2.49 118.16 120.71 2j1k n LYS 33 Ca -0.02 0.95 0.00 0.00 -2.02 0.00 0.00 58.31 57.22 2j1k n LYS 33 Cb 0.60 -2.75 0.00 0.00 -0.02 0.00 0.00 35.03 32.85 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 3.03 2.15 3.79 0.72 0.00 -0.36 -4.90 105.19 109.63 2j1k n GLY 34 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.47 0.63 -0.15 1.61 2.02 -1.04 -4.09 118.70 117.22 2j1k s GLU 35 Ca 0.00 0.06 -0.02 0.00 0.02 0.00 0.00 54.97 55.02 2j1k s GLU 35 Cb 0.00 -1.80 -0.02 0.00 0.10 0.00 0.00 34.13 32.41 2j1k s GLU 35 CO 0.00 -2.50 -0.07 0.95 0.02 0.00 0.00 175.26 173.66 2j1k s THR 36 N -3.38 3.59 -0.38 3.63 -4.23 -1.26 -1.30 115.64 112.31 2j1k s THR 36 Ca 0.67 -0.47 -0.16 0.00 -1.18 0.00 0.00 61.69 60.56 2j1k s THR 36 Cb -0.11 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.18 2j1k s THR 36 CO 0.53 0.51 0.37 0.00 -0.54 0.00 0.00 174.62 175.49 2j1k s ALA 37 N 0.35 3.47 -0.52 3.99 0.00 -0.56 -4.90 121.76 123.59 2j1k s ALA 37 Ca -0.07 -1.38 -0.27 0.00 0.00 0.00 0.00 51.96 50.25 2j1k s ALA 37 Cb -0.15 -2.90 0.03 0.00 0.00 0.00 0.00 23.12 20.11 2j1k s ALA 37 CO 0.04 -1.28 1.04 -0.47 0.00 0.00 0.00 175.76 175.09 2j1k s TYR 38 N 2.00 2.78 -0.50 0.00 5.04 -1.26 -1.53 117.35 123.88 2j1k s TYR 38 Ca 0.11 0.35 -0.17 0.00 -2.44 0.00 0.00 57.07 54.92 2j1k s TYR 38 Cb -0.17 -4.23 0.08 0.00 0.35 0.00 0.00 41.96 37.98 2j1k s TYR 38 CO 0.12 -1.33 0.50 -0.51 -1.34 0.00 0.00 175.55 172.99 2j1k s LEU 39 N 4.26 5.47 0.32 6.97 1.43 -0.06 -4.99 118.68 132.07 2j1k s LEU 39 Ca 0.39 -1.26 -0.27 0.00 -1.03 0.00 0.00 54.13 51.96 2j1k s LEU 39 Cb -0.09 -2.27 -0.10 0.00 0.03 0.00 0.00 46.19 43.76 2j1k s LEU 39 CO 0.25 -0.78 0.96 -2.84 0.23 0.00 0.00 176.35 174.18 2j1k s PRO 40 N 2.01 4.59 -0.40 1.29 0.02 -1.26 -1.60 135.00 139.64 2j1k s PRO 40 Ca 0.08 1.39 0.05 0.00 0.02 0.00 0.00 61.00 62.53 2j1k s PRO 40 Cb -0.23 -2.86 0.17 0.00 0.02 0.00 0.00 34.50 31.60 2j1k s PRO 40 CO 0.08 0.27 0.46 0.00 -0.33 0.00 0.00 177.00 177.48 2j1k s LYS 42 N 1.20 4.02 0.09 0.00 2.47 -1.26 -0.32 119.74 125.94 2j1k s LYS 42 Ca 0.21 -0.31 0.08 0.00 -1.56 0.00 0.00 55.97 54.39 2j1k s LYS 42 Cb -0.09 -3.35 -0.03 0.00 -1.46 0.00 0.00 37.83 32.90 2j1k s LYS 42 CO -0.06 0.19 -0.21 -0.59 0.16 0.00 0.00 175.35 174.84 2j1k s PHE 43 N 0.65 1.77 -0.06 4.03 -0.12 -0.00 -1.04 117.98 123.21 2j1k s PHE 43 Ca 0.05 -0.41 0.02 0.00 -0.05 0.00 0.00 56.93 56.54 2j1k s PHE 43 Cb -0.13 -0.98 -0.03 0.00 -0.63 0.00 0.00 43.02 41.25 2j1k s PHE 43 CO 0.01 0.18 -0.10 0.99 -0.05 0.00 0.00 175.22 176.26 2j1k s THR 44 N -1.11 3.47 0.07 -4.49 2.01 -0.07 -4.50 115.64 111.02 2j1k s THR 44 Ca 0.06 -0.57 0.03 0.00 0.31 0.00 0.00 61.69 61.53 2j1k s THR 44 Cb -0.10 -2.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.98 2j1k s THR 44 CO 0.04 0.60 0.05 -0.76 -0.69 0.00 0.00 174.62 173.85 2j1k s LEU 45 N -0.77 3.68 0.42 4.42 1.43 -1.26 -2.55 118.68 124.06 2j1k s LEU 45 Ca 0.12 -0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.17 2j1k s LEU 45 Cb -0.11 -2.35 -0.01 0.00 0.03 0.00 0.00 46.19 43.75 2j1k s LEU 45 CO 0.01 0.18 0.63 -0.44 0.23 0.00 0.00 176.35 176.97 2j1k s SER 46 N -2.28 5.92 0.44 2.29 0.01 -1.26 -4.93 113.70 113.89 2j1k s SER 46 Ca 0.27 0.27 0.14 0.00 1.31 0.00 0.00 55.95 57.95 2j1k s SER 46 Cb -0.12 -1.59 0.97 0.00 0.21 0.00 0.00 66.02 65.49 2j1k s SER 46 CO 0.20 -0.61 1.97 1.55 0.41 0.00 0.00 173.24 176.76 2j1k h PRO 47 N 0.50 0.00 0.00 12.44 0.13 -2.00 -2.86 132.00 140.20 2j1k h PRO 47 Ca -0.47 -0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 2j1k h PRO 47 Cb 1.25 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 2j1k h PRO 47 CO 0.58 0.21 -0.15 1.05 -0.23 0.00 0.00 178.00 179.45 2j1k h GLU 48 N 0.00 0.00 -5.41 0.86 4.11 -1.96 -3.40 114.58 108.78 2j1k h GLU 48 Ca -0.00 0.00 -0.46 0.00 0.07 0.00 0.00 59.36 58.97 2j1k h GLU 48 Cb 0.36 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 2j1k h GLU 48 CO 0.03 0.15 1.55 -0.25 0.07 0.00 0.00 179.01 180.56 2j1k n ASP 49 N -3.37 3.51 -0.25 3.06 8.00 -1.08 -4.31 116.55 122.11 2j1k n ASP 49 Ca -0.00 -2.76 0.11 0.00 0.71 0.00 0.00 54.79 52.85 2j1k n ASP 49 Cb 0.36 -1.68 0.06 0.00 -0.02 0.00 0.00 41.12 39.84 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 8.10 0.65 -1.30 -1.24 6.02 -0.47 -4.82 117.38 124.31 2j1k n GLN 50 Ca 0.47 -0.50 -0.29 0.00 -0.01 0.00 0.00 57.00 56.67 2j1k n GLN 50 Cb 0.46 -1.49 0.18 0.00 1.02 0.00 0.00 30.24 30.40 2j1k n GLN 50 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2j1k s GLY 51 N -2.70 1.58 0.39 1.08 0.00 0.25 -4.90 107.32 103.03 2j1k s GLY 51 Ca 0.16 -0.59 -0.25 0.00 0.00 0.00 0.00 44.72 44.04 2j1k s GLY 51 CO 0.66 0.07 1.07 2.56 0.00 0.00 0.00 173.10 177.47 2j1k s PRO 52 N -5.20 4.19 -0.12 2.90 0.04 -1.26 -4.38 135.00 131.16 2j1k s PRO 52 Ca 0.67 1.58 -0.29 0.00 0.04 0.00 0.00 61.00 62.99 2j1k s PRO 52 Cb -0.15 -2.61 -0.02 0.00 0.04 0.00 0.00 34.50 31.76 2j1k s PRO 52 CO 0.56 -0.13 1.18 -1.17 0.04 0.00 0.00 177.00 177.47 2j1k s LEU 53 N -2.52 4.22 -0.18 -3.56 2.96 -1.26 -4.34 118.68 114.00 2j1k s LEU 53 Ca 0.57 1.68 -0.02 0.00 -0.22 0.00 0.00 54.13 56.13 2j1k s LEU 53 Cb -0.24 -3.55 0.06 0.00 0.50 0.00 0.00 46.19 42.96 2j1k s LEU 53 CO 0.30 -0.64 0.02 -0.62 -1.32 0.00 0.00 176.35 174.09 2j1k s ASP 54 N 1.57 2.78 -0.00 3.68 -1.08 -0.50 -4.35 116.67 118.78 2j1k s ASP 54 Ca 0.53 -0.74 0.04 0.00 -0.52 0.00 0.00 52.55 51.86 2j1k s ASP 54 Cb -0.22 -0.62 -0.03 0.00 -1.46 0.00 0.00 42.92 40.60 2j1k s ASP 54 CO 0.17 -0.28 -0.11 -0.63 0.52 0.00 0.00 175.17 174.84 2j1k s ILE 55 N 1.84 3.36 -0.01 4.11 -1.09 0.16 -1.44 121.20 128.13 2j1k s ILE 55 Ca -0.00 -0.84 -0.03 0.00 -2.23 0.00 0.00 60.65 57.54 2j1k s ILE 55 Cb -0.16 -2.42 0.00 0.00 -1.58 0.00 0.00 42.46 38.29 2j1k s ILE 55 CO -0.08 0.43 0.07 -1.83 -1.23 0.00 0.00 174.94 172.30 2j1k s GLU 56 N -1.27 0.24 -0.12 2.79 -1.05 -0.50 -0.42 118.70 118.36 2j1k s GLU 56 Ca 0.15 -0.17 -0.02 0.00 -0.15 0.00 0.00 54.97 54.78 2j1k s GLU 56 Cb -0.11 0.10 -0.03 0.00 -0.44 0.00 0.00 34.13 33.65 2j1k s GLU 56 CO 0.05 -0.04 -0.03 -1.58 0.95 0.00 0.00 175.26 174.61 2j1k s TRP 57 N -0.63 3.04 0.18 4.83 0.52 -0.31 -0.57 118.94 126.01 2j1k s TRP 57 Ca -0.07 -0.10 0.10 0.00 0.02 0.00 0.00 56.10 56.04 2j1k s TRP 57 Cb -0.04 -1.87 -0.04 0.00 -1.15 0.00 0.00 33.47 30.37 2j1k s TRP 57 CO 0.00 0.17 -0.20 -0.51 0.02 0.00 0.00 176.95 176.43 2j1k s LEU 58 N -0.18 2.45 -0.07 2.99 1.43 0.87 -1.12 118.68 125.05 2j1k s LEU 58 Ca 0.04 -0.88 0.04 0.00 -1.03 0.00 0.00 54.13 52.30 2j1k s LEU 58 Cb -0.13 -0.95 -0.00 0.00 0.03 0.00 0.00 46.19 45.14 2j1k s LEU 58 CO 0.02 0.02 -0.21 -0.51 0.23 0.00 0.00 176.35 175.90 2j1k s ILE 59 N -1.97 1.79 -0.72 -0.59 1.10 0.17 -0.45 121.20 120.54 2j1k s ILE 59 Ca 0.18 -0.89 -0.01 0.00 -0.51 0.00 0.00 60.65 59.43 2j1k s ILE 59 Cb -0.06 -1.55 0.18 0.00 0.15 0.00 0.00 42.46 41.18 2j1k s ILE 59 CO 0.08 0.50 0.54 -0.44 -2.11 0.00 0.00 174.94 173.52 2j1k s SER 60 N 0.22 5.33 0.47 4.50 0.01 0.33 -0.93 113.70 123.63 2j1k s SER 60 Ca -0.12 -3.30 -0.22 0.00 1.31 0.00 0.00 55.95 53.62 2j1k s SER 60 Cb -0.15 -1.82 -0.07 0.00 0.21 0.00 0.00 66.02 64.18 2j1k s SER 60 CO 0.06 -0.25 1.14 -2.16 0.41 0.00 0.00 173.24 172.43 2j1k s PRO 61 N -0.71 3.75 0.26 12.44 0.04 -1.26 -2.09 135.00 147.43 2j1k s PRO 61 Ca 0.22 1.70 0.02 0.00 0.04 0.00 0.00 61.00 62.98 2j1k s PRO 61 Cb -0.14 -2.35 0.34 0.00 0.04 0.00 0.00 34.50 32.39 2j1k s PRO 61 CO -0.08 -0.54 1.66 0.00 0.04 0.00 0.00 177.00 178.08 2j1k h ALA 62 N 1.95 0.99 -0.35 8.56 0.00 -1.69 -3.34 119.26 125.39 2j1k h ALA 62 Ca -0.49 -0.41 0.04 0.00 0.00 0.00 0.00 54.91 54.04 2j1k h ALA 62 Cb 1.24 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 2j1k h ALA 62 CO 0.60 0.61 -0.36 -0.44 0.00 0.00 0.00 179.25 179.66 2j1k h ASP 63 N 0.36 -1.22 -1.01 0.00 5.19 -1.84 -3.46 116.42 114.43 2j1k h ASP 63 Ca 0.04 0.17 -0.59 0.00 -0.62 0.00 0.00 57.03 56.02 2j1k h ASP 63 Cb 0.83 0.51 -0.08 0.00 0.18 0.00 0.00 39.33 40.77 2j1k h ASP 63 CO 0.07 -0.23 -0.44 0.20 -3.12 0.00 0.00 179.24 175.72 2j1k s ASN 64 N -4.28 4.44 0.00 6.45 -0.87 -1.25 -5.03 114.94 114.40 2j1k s ASN 64 Ca -0.09 -1.24 0.31 0.00 -1.57 0.00 0.00 52.86 50.27 2j1k s ASN 64 Cb 0.06 0.01 1.75 0.00 -0.02 0.00 0.00 41.25 43.04 2j1k s ASN 64 CO 0.39 -0.79 2.15 0.00 -2.57 0.00 0.00 177.10 176.28 2j1k n GLN 65 N -1.42 0.83 -2.00 -0.60 6.02 -1.26 -4.75 117.38 114.21 2j1k n GLN 65 Ca -0.05 -0.03 -0.38 0.00 -0.01 0.00 0.00 57.00 56.54 2j1k n GLN 65 Cb 0.65 -1.50 0.02 0.00 1.02 0.00 0.00 30.24 30.43 2j1k n GLN 65 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2j1k s LYS 66 N -2.19 3.35 0.02 -1.09 1.02 -1.26 -5.05 119.74 114.54 2j1k s LYS 66 Ca 0.41 2.00 0.01 0.00 0.02 0.00 0.00 55.97 58.42 2j1k s LYS 66 Cb 0.21 -2.27 -0.01 0.00 -0.52 0.00 0.00 37.83 35.24 2j1k s LYS 66 CO 0.40 -0.95 -0.05 0.08 -0.92 0.00 0.00 175.35 173.91 2j1k s VAL 67 N -1.43 0.33 -1.08 3.17 1.01 -1.26 -4.17 120.40 116.96 2j1k s VAL 67 Ca 0.69 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.80 2j1k s VAL 67 Cb -0.35 -0.38 -0.00 0.00 0.00 0.00 0.00 36.38 35.65 2j1k s VAL 67 CO 0.41 -0.23 0.76 0.47 0.00 0.00 0.00 175.10 176.50 2j1k n ASP 68 N 2.08 -5.36 -4.53 3.32 8.00 -1.09 -4.95 116.55 114.04 2j1k n ASP 68 Ca -0.19 -0.97 -0.38 0.00 0.71 0.00 0.00 54.79 53.96 2j1k n ASP 68 Cb 0.56 -3.16 -0.11 0.00 -0.02 0.00 0.00 41.12 38.38 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 -5.81 3.74 0.23 -1.24 -1.52 -0.11 -4.81 119.66 110.15 2j1k s GLN 69 Ca 0.40 -0.45 -0.31 0.00 -1.95 0.00 0.00 55.36 53.05 2j1k s GLN 69 Cb -0.15 -3.57 -0.14 0.00 -0.22 0.00 0.00 33.01 28.92 2j1k s GLN 69 CO 0.87 -0.24 1.30 1.33 -0.25 0.00 0.00 175.29 178.29 2j1k n VAL 70 N 5.02 1.11 -0.04 1.09 0.24 -1.26 -0.65 118.33 123.83 2j1k n VAL 70 Ca -0.14 -0.28 -0.04 0.00 -2.04 0.00 0.00 64.34 61.84 2j1k n VAL 70 Cb 0.51 -1.27 -0.07 0.00 -1.47 0.00 0.00 33.84 31.55 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 1.53 0.58 -3.58 1.34 -5.35 -0.27 -3.96 119.36 109.65 2j1k n ILE 71 Ca 0.12 -0.35 -0.15 0.00 -0.27 0.00 0.00 62.75 62.10 2j1k n ILE 71 Cb 0.30 -0.78 -0.06 0.00 -1.74 0.00 0.00 39.64 37.35 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 -2.21 0.00 0.08 7.28 2.07 -1.22 -4.54 121.20 122.67 2j1k s ILE 72 Ca -0.05 0.00 0.06 0.00 -1.41 0.00 0.00 60.65 59.25 2j1k s ILE 72 Cb 0.03 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.59 2j1k s ILE 72 CO 0.34 0.00 -0.15 -0.76 -1.91 0.00 0.00 174.94 172.46 2j1k s LEU 73 N -0.48 2.29 -0.20 8.50 1.43 0.04 -1.16 118.68 129.09 2j1k s LEU 73 Ca -0.05 -0.64 0.00 0.00 -1.03 0.00 0.00 54.13 52.42 2j1k s LEU 73 Cb -0.02 -0.56 0.05 0.00 0.03 0.00 0.00 46.19 45.68 2j1k s LEU 73 CO 0.04 -0.07 -0.07 -0.47 0.23 0.00 0.00 176.35 176.02 2j1k s TYR 74 N -1.33 2.08 -0.01 0.29 5.04 0.44 -1.33 117.35 122.53 2j1k s TYR 74 Ca -0.00 -1.41 -0.15 0.00 -2.44 0.00 0.00 57.07 53.07 2j1k s TYR 74 Cb -0.10 -1.47 0.02 0.00 0.35 0.00 0.00 41.96 40.76 2j1k s TYR 74 CO 0.03 -0.70 0.31 -1.54 -1.34 0.00 0.00 175.55 172.31 2j1k s SER 75 N 1.51 -0.20 -1.45 4.32 1.04 -0.85 -0.67 113.70 117.40 2j1k s SER 75 Ca -0.02 0.09 -0.01 0.00 0.48 0.00 0.00 55.95 56.50 2j1k s SER 75 Cb -0.17 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.27 2j1k s SER 75 CO -0.07 -0.45 0.09 0.61 0.98 0.00 0.00 173.24 174.40 2j1k n GLY 76 N 1.28 -0.34 3.56 7.32 0.00 -1.26 -2.43 105.19 113.31 2j1k n GLY 76 Ca -0.22 -0.13 -0.23 0.00 0.00 0.00 0.00 46.02 45.45 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 -1.40 -5.52 -3.71 1.61 8.00 -1.26 -5.00 116.55 109.26 2j1k n ASP 77 Ca -0.19 -0.55 -0.12 0.00 0.71 0.00 0.00 54.79 54.64 2j1k n ASP 77 Cb 0.65 -5.04 -0.10 0.00 -0.02 0.00 0.00 41.12 36.60 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 -6.12 0.47 -0.19 -1.24 2.20 -1.02 -5.15 119.74 108.69 2j1k s LYS 78 Ca 0.47 0.71 -0.11 0.00 -0.36 0.00 0.00 55.97 56.68 2j1k s LYS 78 Cb -0.21 0.13 -0.05 0.00 -1.51 0.00 0.00 37.83 36.20 2j1k s LYS 78 CO 0.73 -0.11 0.19 0.42 -0.36 0.00 0.00 175.35 176.22 2j1k s ILE 79 N 0.77 5.37 -0.15 5.43 1.01 -1.26 -2.01 121.20 130.36 2j1k s ILE 79 Ca -0.04 0.32 0.01 0.00 0.00 0.00 0.00 60.65 60.94 2j1k s ILE 79 Cb -0.05 -3.53 0.01 0.00 0.01 0.00 0.00 42.46 38.89 2j1k s ILE 79 CO -0.06 0.42 -0.19 -0.31 0.00 0.00 0.00 174.94 174.80 2j1k s TYR 80 N 0.44 2.73 0.00 3.97 2.02 -0.44 -4.99 117.35 121.09 2j1k s TYR 80 Ca 0.11 -1.27 0.00 0.00 -0.37 0.00 0.00 57.07 55.54 2j1k s TYR 80 Cb -0.12 -1.86 0.00 0.00 -0.40 0.00 0.00 41.96 39.58 2j1k s TYR 80 CO 0.00 -0.59 0.59 -0.40 -1.57 0.00 0.00 175.55 173.59 2j1k n ASP 81 N 4.17 0.49 -2.82 2.29 5.68 -1.26 -0.78 116.55 124.31 2j1k n ASP 81 Ca -0.20 -1.24 -0.33 0.00 -0.50 0.00 0.00 54.79 52.52 2j1k n ASP 81 Cb 0.51 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.48 2j1k n ASP 81 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2j1k n ASP 82 N -0.12 7.04 -0.06 -1.12 2.03 -1.26 -4.51 116.55 118.55 2j1k n ASP 82 Ca 0.00 -3.42 -0.12 0.00 0.52 0.00 0.00 54.79 51.77 2j1k n ASP 82 Cb 0.42 -1.20 -0.04 0.00 -0.72 0.00 0.00 41.12 39.58 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 0.50 0.00 -3.64 -0.67 4.01 -1.26 -4.97 117.16 111.13 2j1k n TYR 83 Ca 0.52 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.86 2j1k n TYR 83 Cb 0.40 -0.43 -0.12 0.00 -0.31 0.00 0.00 39.34 38.89 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 -2.22 3.22 0.19 -0.72 5.04 -1.25 -5.00 117.35 116.61 2j1k s TYR 84 Ca -0.17 -0.94 -0.12 0.00 -2.44 0.00 0.00 57.07 53.41 2j1k s TYR 84 Cb 0.06 -2.39 0.19 0.00 0.35 0.00 0.00 41.96 40.18 2j1k s TYR 84 CO 0.21 -0.61 1.76 -1.35 -1.34 0.00 0.00 175.55 174.23 2j1k h PRO 85 N 8.37 0.43 0.00 4.97 0.11 -1.94 -2.74 132.00 141.20 2j1k h PRO 85 Ca -0.27 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 2j1k h PRO 85 Cb 1.11 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 2j1k h PRO 85 CO 0.64 0.28 -0.04 -0.44 -0.21 0.00 0.00 178.00 178.24 2j1k h ASP 86 N 0.44 0.00 -0.55 -2.05 3.32 -2.02 -2.24 116.42 113.31 2j1k h ASP 86 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 2j1k h ASP 86 Cb 0.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2j1k h ASP 86 CO -0.22 0.04 0.00 0.18 -1.72 0.00 0.00 179.24 177.52 2j1k n LEU 87 N -4.23 4.86 -4.65 1.55 4.77 -1.04 -4.99 117.00 113.27 2j1k n LEU 87 Ca -0.03 -2.66 -0.42 0.00 -0.03 0.00 0.00 56.01 52.87 2j1k n LEU 87 Cb 0.12 -0.59 -0.03 0.00 -2.33 0.00 0.00 43.42 40.59 2j1k n LEU 87 CO 0.32 0.73 1.67 -0.75 -1.33 0.00 0.00 177.39 178.03 2j1k s LYS 88 N -2.23 3.90 0.00 3.23 2.20 -0.85 -1.53 119.74 124.47 2j1k s LYS 88 Ca 0.50 2.49 0.00 0.00 -0.36 0.00 0.00 55.97 58.59 2j1k s LYS 88 Cb 0.35 -4.22 0.00 0.00 -1.51 0.00 0.00 37.83 32.45 2j1k s LYS 88 CO 0.19 -1.23 0.00 0.41 -0.36 0.00 0.00 175.35 174.36 2j1k n GLY 89 N 4.84 0.94 0.27 5.54 0.00 -1.26 -4.88 105.19 110.64 2j1k n GLY 89 Ca 0.22 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.28 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 -2.03 0.98 -5.18 1.61 1.74 -0.58 -4.97 116.66 108.22 2j1k n ARG 90 Ca 0.00 -0.81 -0.30 0.00 -0.77 0.00 0.00 57.85 55.97 2j1k n ARG 90 Cb 0.00 -1.10 -0.16 0.00 -1.02 0.00 0.00 32.46 30.18 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 -0.87 1.91 -0.02 1.55 1.01 -1.23 -0.63 120.40 122.12 2j1k s VAL 91 Ca 0.08 -1.01 -0.29 0.00 0.00 0.00 0.00 61.98 60.76 2j1k s VAL 91 Cb 0.07 -1.60 0.08 0.00 0.00 0.00 0.00 36.38 34.92 2j1k s VAL 91 CO 0.14 0.54 0.70 -1.38 0.00 0.00 0.00 175.10 175.09 2j1k s HIS 92 N -0.32 -0.60 0.11 5.22 -3.43 -1.18 -5.04 115.29 110.05 2j1k s HIS 92 Ca 0.02 0.90 -0.31 0.00 -0.80 0.00 0.00 55.06 54.88 2j1k s HIS 92 Cb -0.11 0.45 -0.07 0.00 -1.43 0.00 0.00 32.58 31.41 2j1k s HIS 92 CO 0.01 -0.63 1.29 -0.06 -2.00 0.00 0.00 174.74 173.35 2j1k s PHE 93 N -1.76 3.34 0.10 0.38 0.08 -1.26 -2.43 117.98 116.43 2j1k s PHE 93 Ca -0.07 1.15 0.05 0.00 0.12 0.00 0.00 56.93 58.18 2j1k s PHE 93 Cb -0.00 -3.55 -0.22 0.00 -0.57 0.00 0.00 43.02 38.67 2j1k s PHE 93 CO 0.04 -1.82 1.22 1.79 -0.10 0.00 0.00 175.22 176.35 2j1k h THR 94 N 4.25 1.63 -3.91 0.64 1.35 -1.61 -3.47 112.91 111.80 2j1k h THR 94 Ca -0.42 -3.33 -0.50 0.00 -0.55 0.00 0.00 66.41 61.61 2j1k h THR 94 Cb 1.21 2.84 0.04 0.00 -1.73 0.00 0.00 68.15 70.51 2j1k h THR 94 CO 0.83 0.94 0.48 -0.55 -0.25 0.00 0.00 175.52 176.97 2j1k s SER 95 N -6.75 6.75 0.00 5.36 0.15 -1.26 -4.95 113.70 113.01 2j1k s SER 95 Ca -0.00 2.28 0.27 0.00 0.70 0.00 0.00 55.95 59.20 2j1k s SER 95 Cb 0.09 -2.61 0.94 0.00 -1.71 0.00 0.00 66.02 62.73 2j1k s SER 95 CO 0.83 -0.51 1.68 -0.46 1.20 0.00 0.00 173.24 175.98 2j1k n ASN 96 N 0.33 0.70 -3.16 5.45 6.94 -1.26 -4.55 115.26 119.70 2j1k n ASN 96 Ca 0.03 -0.63 -0.16 0.00 -0.02 0.00 0.00 54.58 53.81 2j1k n ASN 96 Cb 0.47 0.04 -0.05 0.00 -2.36 0.00 0.00 39.78 37.87 2j1k n ASN 96 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2j1k s ASP 97 N -2.57 0.24 0.22 0.53 -1.08 -1.26 -5.03 116.67 107.72 2j1k s ASP 97 Ca 0.24 -2.20 -0.03 0.00 -0.52 0.00 0.00 52.55 50.04 2j1k s ASP 97 Cb 0.19 0.69 0.19 0.00 -1.46 0.00 0.00 42.92 42.54 2j1k s ASP 97 CO 0.52 -0.15 1.60 0.25 0.52 0.00 0.00 175.17 177.92 2j1k h LEU 98 N 5.76 0.69 -2.26 -1.34 6.46 -1.80 -2.96 115.31 119.86 2j1k h LEU 98 Ca 0.14 -0.28 0.00 0.00 -0.12 0.00 0.00 57.88 57.62 2j1k h LEU 98 Cb 1.02 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 40.76 2j1k h LEU 98 CO 0.20 0.97 0.00 0.07 -0.62 0.00 0.00 178.44 179.05 2j1k h LYS 99 N 0.56 0.00 0.00 1.25 5.09 -1.96 -2.26 116.57 119.25 2j1k h LYS 99 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.80 2j1k h LYS 99 Cb 0.84 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.17 2j1k h LYS 99 CO 0.07 0.00 0.00 0.43 -2.09 0.00 0.00 179.45 177.86 2j1k n SER 100 N -2.75 0.09 0.00 7.07 7.64 -1.12 -4.88 113.62 119.67 2j1k n SER 100 Ca -0.02 0.51 0.00 0.00 1.01 0.00 0.00 58.87 60.37 2j1k n SER 100 Cb 0.08 -0.53 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 2j1k n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2j1k n GLY 101 N 1.16 1.51 2.76 0.23 0.00 -0.86 -4.99 105.19 105.00 2j1k n GLY 101 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.51 3.97 -0.24 1.61 2.15 -1.14 -0.82 116.67 120.69 2j1k s ASP 102 Ca 0.00 -1.58 0.14 0.00 0.43 0.00 0.00 52.55 51.54 2j1k s ASP 102 Cb 0.00 -0.89 0.68 0.00 -0.30 0.00 0.00 42.92 42.41 2j1k s ASP 102 CO 0.00 -0.40 1.63 0.00 -0.17 0.00 0.00 175.17 176.24 2j1k n ALA 103 N 4.83 3.79 -1.62 3.66 0.00 0.57 -4.45 120.51 127.28 2j1k n ALA 103 Ca -0.03 -2.26 -0.35 0.00 0.00 0.00 0.00 53.44 50.80 2j1k n ALA 103 Cb 0.43 -0.99 0.05 0.00 0.00 0.00 0.00 19.45 18.94 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 -1.38 4.89 0.34 0.00 0.01 -1.21 -4.55 113.70 111.79 2j1k s SER 104 Ca 0.50 2.35 0.03 0.00 1.31 0.00 0.00 55.95 60.14 2j1k s SER 104 Cb 0.40 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 64.00 2j1k s SER 104 CO 0.12 -1.80 0.12 0.27 0.41 0.00 0.00 173.24 172.36 2j1k s ILE 105 N -1.77 0.60 0.05 1.44 -4.36 -0.63 -1.58 121.20 114.96 2j1k s ILE 105 Ca 0.76 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 59.16 2j1k s ILE 105 Cb -0.29 -2.53 -0.03 0.00 1.25 0.00 0.00 42.46 40.86 2j1k s ILE 105 CO 0.37 0.00 -0.05 0.54 0.24 0.00 0.00 174.94 176.04 2j1k s ASN 106 N -3.46 0.64 -0.31 4.36 6.03 -1.02 -0.89 114.94 120.29 2j1k s ASN 106 Ca 0.32 -0.70 -0.05 0.00 -1.03 0.00 0.00 52.86 51.41 2j1k s ASN 106 Cb 0.05 0.10 0.03 0.00 -3.03 0.00 0.00 41.25 38.41 2j1k s ASN 106 CO 0.16 -0.36 0.05 -0.69 -2.03 0.00 0.00 177.10 174.23 2j1k s VAL 107 N -2.29 3.48 0.56 3.54 1.01 -0.58 -3.09 120.40 123.02 2j1k s VAL 107 Ca -0.05 -1.10 -0.07 0.00 0.00 0.00 0.00 61.98 60.76 2j1k s VAL 107 Cb -0.04 -2.92 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 2j1k s VAL 107 CO -0.03 -0.06 0.89 0.42 0.00 0.00 0.00 175.10 176.32 2j1k s THR 108 N 1.37 4.30 -1.22 3.92 -4.23 0.20 -1.50 115.64 118.48 2j1k s THR 108 Ca -0.02 0.24 -0.17 0.00 -1.18 0.00 0.00 61.69 60.56 2j1k s THR 108 Cb -0.19 -3.68 -0.00 0.00 1.34 0.00 0.00 72.50 69.97 2j1k s THR 108 CO 0.01 -0.73 0.69 -3.20 -0.54 0.00 0.00 174.62 170.85 2j1k n ASN 109 N -2.51 -3.86 -4.72 3.99 5.15 -1.05 -4.86 115.26 107.39 2j1k n ASN 109 Ca 0.03 -1.04 -0.37 0.00 -0.60 0.00 0.00 54.58 52.60 2j1k n ASN 109 Cb 0.56 -3.15 0.07 0.00 -0.53 0.00 0.00 39.78 36.73 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 -4.32 5.98 -4.22 1.20 4.77 -0.42 -4.64 117.00 115.36 2j1k n LEU 110 Ca -0.15 0.83 -0.16 0.00 -0.03 0.00 0.00 56.01 56.49 2j1k n LEU 110 Cb 0.61 -1.55 -0.08 0.00 -2.33 0.00 0.00 43.42 40.07 2j1k n LEU 110 CO 0.70 -1.03 -0.10 0.00 -1.33 0.00 0.00 177.39 175.63 2j1k s GLN 111 N -3.36 1.61 0.33 3.23 -2.07 -1.26 -1.22 119.66 116.91 2j1k s GLN 111 Ca 0.83 -1.83 0.13 0.00 -1.82 0.00 0.00 55.36 52.67 2j1k s GLN 111 Cb -0.38 0.33 0.55 0.00 -1.09 0.00 0.00 33.01 32.42 2j1k s GLN 111 CO 0.40 -0.59 1.71 -0.07 -1.32 0.00 0.00 175.29 175.42 2j1k h LEU 112 N 2.28 0.00 -1.90 2.60 3.38 -1.99 -2.55 115.31 117.14 2j1k h LEU 112 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2j1k h LEU 112 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2j1k h LEU 112 CO 0.42 0.49 0.00 0.77 0.09 0.00 0.00 178.44 180.20 2j1k h SER 113 N 0.00 0.00 0.13 -0.43 4.64 -2.02 -2.70 113.55 113.17 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 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 2j1k h SER 113 CO 0.06 0.00 -0.01 0.47 -0.87 0.00 0.00 176.83 176.48 2j1k n ASP 114 N -2.99 0.18 -4.73 4.97 8.00 -0.96 -4.70 116.55 116.32 2j1k n ASP 114 Ca -0.01 -0.86 -0.42 0.00 0.71 0.00 0.00 54.79 54.21 2j1k n ASP 114 Cb 0.21 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.23 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 -2.14 2.52 -3.28 0.53 1.01 -1.02 -4.92 121.20 113.90 2j1k s ILE 115 Ca 0.42 0.39 0.00 0.00 0.00 0.00 0.00 60.65 61.46 2j1k s ILE 115 Cb 0.21 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 39.44 2j1k s ILE 115 CO 0.39 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.98 2j1k n GLY 116 N 3.35 -0.97 3.50 6.18 0.00 -1.07 -1.91 105.19 114.26 2j1k n GLY 116 Ca 0.12 -1.02 -0.36 0.00 0.00 0.00 0.00 46.02 44.76 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 -3.00 4.55 -0.16 2.61 2.01 -0.89 -0.99 115.64 119.77 2j1k s THR 117 Ca 0.00 -0.09 -0.06 0.00 0.31 0.00 0.00 61.69 61.84 2j1k s THR 117 Cb 0.00 -3.12 -0.04 0.00 0.01 0.00 0.00 72.50 69.35 2j1k s THR 117 CO 0.00 0.34 0.05 -0.31 -0.69 0.00 0.00 174.62 174.01 2j1k s TYR 118 N 1.48 3.25 -0.10 4.92 2.02 0.69 -0.52 117.35 129.09 2j1k s TYR 118 Ca 0.06 0.09 0.03 0.00 -0.37 0.00 0.00 57.07 56.89 2j1k s TYR 118 Cb -0.15 -2.01 0.00 0.00 -0.40 0.00 0.00 41.96 39.41 2j1k s TYR 118 CO 0.05 0.24 -0.22 -1.14 -1.57 0.00 0.00 175.55 172.91 2j1k s GLN 119 N 0.05 2.80 -0.27 -0.62 0.74 0.41 -0.19 119.66 122.58 2j1k s GLN 119 Ca 0.05 -0.79 -0.10 0.00 0.05 0.00 0.00 55.36 54.57 2j1k s GLN 119 Cb -0.12 -2.16 -0.04 0.00 1.10 0.00 0.00 33.01 31.79 2j1k s GLN 119 CO 0.01 0.13 0.16 0.00 -0.55 0.00 0.00 175.29 175.04 2j1k s LYS 121 N 1.68 3.29 -0.23 0.00 1.02 0.26 -0.93 119.74 124.84 2j1k s LYS 121 Ca 0.07 -0.67 -0.04 0.00 0.02 0.00 0.00 55.97 55.35 2j1k s LYS 121 Cb -0.16 -2.92 -0.00 0.00 -0.52 0.00 0.00 37.83 34.23 2j1k s LYS 121 CO 0.09 -0.20 -0.04 0.08 -0.92 0.00 0.00 175.35 174.35 2j1k s VAL 122 N 1.44 3.31 -0.03 3.17 1.01 -0.01 -1.41 120.40 127.88 2j1k s VAL 122 Ca 0.06 -0.58 0.06 0.00 0.00 0.00 0.00 61.98 61.52 2j1k s VAL 122 Cb -0.14 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.68 2j1k s VAL 122 CO -0.05 0.38 -0.21 -0.54 0.00 0.00 0.00 175.10 174.68 2j1k s LYS 123 N 1.46 2.27 -0.40 2.72 1.02 -0.52 -1.24 119.74 125.04 2j1k s LYS 123 Ca 0.05 -0.84 0.07 0.00 0.02 0.00 0.00 55.97 55.28 2j1k s LYS 123 Cb -0.15 -2.19 0.18 0.00 -0.52 0.00 0.00 37.83 35.16 2j1k s LYS 123 CO -0.03 0.59 0.60 0.21 -0.92 0.00 0.00 175.35 175.79 2j1k s LYS 124 N -0.70 0.79 0.30 1.68 2.20 -0.41 -1.41 119.74 122.20 2j1k s LYS 124 Ca 0.11 -0.31 -0.28 0.00 -0.36 0.00 0.00 55.97 55.13 2j1k s LYS 124 Cb -0.10 0.01 -0.14 0.00 -1.51 0.00 0.00 37.83 36.09 2j1k s LYS 124 CO -0.00 -1.19 1.06 0.00 -0.36 0.00 0.00 175.35 174.86 2j1k n ALA 125 N 4.42 0.06 1.25 3.13 0.00 -1.26 -1.34 120.51 126.77 2j1k n ALA 125 Ca 0.11 0.38 0.12 0.00 0.00 0.00 0.00 53.44 54.05 2j1k n ALA 125 Cb 0.55 -2.06 0.64 0.00 0.00 0.00 0.00 19.45 18.58 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 0.67 0.47 -1.78 0.00 -0.04 -1.26 -0.58 135.00 132.49 2j1k n PRO 126 Ca 0.09 0.04 -0.42 0.00 -0.04 0.00 0.00 63.50 63.17 2j1k n PRO 126 Cb 0.33 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.27 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 -2.39 2.03 -0.03 0.55 0.00 -0.45 -5.03 107.32 101.99 2j1k s GLY 127 Ca 0.27 1.57 -0.03 0.00 0.00 0.00 0.00 44.72 46.53 2j1k s GLY 127 CO 0.34 2.58 0.08 0.14 0.00 0.00 0.00 173.10 176.24 2j1k s VAL 128 N 0.11 0.00 -0.08 1.40 1.01 -1.26 -1.28 120.40 120.30 2j1k s VAL 128 Ca 0.64 -0.01 -0.16 0.00 0.00 0.00 0.00 61.98 62.45 2j1k s VAL 128 Cb -0.48 -0.12 0.04 0.00 0.00 0.00 0.00 36.38 35.81 2j1k s VAL 128 CO 0.46 -0.00 0.39 0.00 0.00 0.00 0.00 175.10 175.95 2j1k s ALA 129 N 0.03 -0.99 0.02 5.51 0.00 -0.37 -4.79 121.76 121.18 2j1k s ALA 129 Ca -0.00 0.78 0.02 0.00 0.00 0.00 0.00 51.96 52.75 2j1k s ALA 129 Cb -0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.85 2j1k s ALA 129 CO 0.00 -0.24 -0.06 0.54 0.00 0.00 0.00 175.76 176.00 2j1k s ASN 130 N -0.67 0.64 -0.05 0.00 2.20 -1.26 -0.83 114.94 114.97 2j1k s ASN 130 Ca -0.08 -0.38 0.05 0.00 -0.94 0.00 0.00 52.86 51.52 2j1k s ASN 130 Cb -0.04 0.01 -0.01 0.00 -2.00 0.00 0.00 41.25 39.22 2j1k s ASN 130 CO 0.03 -0.13 -0.21 -0.75 -2.94 0.00 0.00 177.10 173.11 2j1k s LYS 131 N -1.04 2.09 -0.16 3.55 2.20 -0.11 -4.85 119.74 121.42 2j1k s LYS 131 Ca -0.07 -0.74 -0.06 0.00 -0.36 0.00 0.00 55.97 54.73 2j1k s LYS 131 Cb -0.07 -1.81 -0.04 0.00 -1.51 0.00 0.00 37.83 34.40 2j1k s LYS 131 CO 0.00 0.32 0.05 0.15 -0.36 0.00 0.00 175.35 175.51 2j1k s LYS 132 N -0.09 3.78 -0.13 4.03 1.02 -0.62 -1.08 119.74 126.65 2j1k s LYS 132 Ca -0.03 -0.35 0.01 0.00 0.02 0.00 0.00 55.97 55.63 2j1k s LYS 132 Cb -0.12 -3.13 0.02 0.00 -0.52 0.00 0.00 37.83 34.07 2j1k s LYS 132 CO 0.03 0.37 -0.15 0.42 -0.92 0.00 0.00 175.35 175.09 2j1k s ILE 133 N 0.08 1.57 -0.34 2.17 1.01 0.74 -1.70 121.20 124.73 2j1k s ILE 133 Ca 0.05 -0.66 -0.16 0.00 0.00 0.00 0.00 60.65 59.88 2j1k s ILE 133 Cb -0.12 -1.45 -0.01 0.00 0.01 0.00 0.00 42.46 40.88 2j1k s ILE 133 CO 0.01 0.46 0.41 -1.00 0.00 0.00 0.00 174.94 174.81 2j1k s HIS 134 N 1.22 3.20 -2.98 3.97 3.76 0.10 -0.22 115.29 124.34 2j1k s HIS 134 Ca -0.01 0.07 0.24 0.00 -0.15 0.00 0.00 55.06 55.21 2j1k s HIS 134 Cb -0.14 -2.74 0.23 0.00 1.11 0.00 0.00 32.58 31.04 2j1k s HIS 134 CO -0.06 -0.45 1.28 -0.11 -0.85 0.00 0.00 174.74 174.56