#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v1g s PRO 16 N 0.00 2.76 0.69 5.56 0.04 -1.26 -5.00 135.00 137.79 1v1g s PRO 16 Ca 0.00 -0.36 -0.17 0.00 0.04 0.00 0.00 61.00 60.52 1v1g s PRO 16 Cb 0.00 -2.39 -0.02 0.00 0.04 0.00 0.00 34.50 32.13 1v1g s PRO 16 CO 0.00 -0.67 0.86 -0.35 0.04 0.00 0.00 177.00 176.89 1v1g n PRO 17 N -2.44 0.56 0.00 0.56 -0.04 -1.26 -2.61 135.00 129.77 1v1g n PRO 17 Ca 0.05 0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.75 1v1g n PRO 17 Cb 0.59 -2.11 0.00 0.00 -0.04 0.00 0.00 33.50 31.93 1v1g n PRO 17 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1v1g n GLY 18 N 1.28 2.27 3.74 0.55 0.00 -1.26 -4.96 105.19 106.80 1v1g n GLY 18 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1v1g n GLY 18 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1v1g n TYR 19 N -1.99 2.75 -3.68 1.61 9.36 -1.07 -5.01 117.16 119.13 1v1g n TYR 19 Ca 0.00 0.39 -0.24 0.00 3.32 0.00 0.00 57.90 61.37 1v1g n TYR 19 Cb 0.00 -2.53 -0.17 0.00 -0.63 0.00 0.00 39.34 36.00 1v1g n TYR 19 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 1v1g s GLU 20 N -1.29 0.21 -0.22 2.98 2.12 -1.26 -5.07 118.70 116.17 1v1g s GLU 20 Ca 0.59 0.07 -0.38 0.00 0.36 0.00 0.00 54.97 55.62 1v1g s GLU 20 Cb -0.52 -1.23 -0.14 0.00 0.26 0.00 0.00 34.13 32.50 1v1g s GLU 20 CO 0.56 -0.47 1.84 -3.47 -0.54 0.00 0.00 175.26 173.18 1v1g n ASP 21 N 5.23 2.75 0.26 -1.70 -0.08 -1.26 -4.85 116.55 116.91 1v1g n ASP 21 Ca -0.06 0.98 0.11 0.00 -1.51 0.00 0.00 54.79 54.31 1v1g n ASP 21 Cb 0.49 -1.23 0.71 0.00 2.34 0.00 0.00 41.12 43.43 1v1g n ASP 21 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1v1g h PRO 22 N 8.38 0.00 -0.82 -0.67 0.13 -1.97 0.66 132.00 137.71 1v1g h PRO 22 Ca -0.46 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.81 1v1g h PRO 22 Cb 1.30 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.37 1v1g h PRO 22 CO 0.96 0.07 0.54 1.49 -0.23 0.00 0.00 178.00 180.83 1v1g h GLU 23 N 0.00 0.60 0.73 0.86 4.81 -1.91 0.30 114.58 119.97 1v1g h GLU 23 Ca -0.00 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 1v1g h GLU 23 Cb 0.15 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 29.40 1v1g h GLU 23 CO 0.01 0.40 -0.35 1.25 -0.73 0.00 0.00 179.01 179.59 1v1g h LEU 24 N 0.62 -0.83 -0.78 1.64 5.85 -1.22 -1.69 115.31 118.90 1v1g h LEU 24 Ca 0.40 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 59.11 1v1g h LEU 24 Cb 0.69 0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.89 1v1g h LEU 24 CO -0.16 -0.54 0.41 -0.07 -0.34 0.00 0.00 178.44 177.74 1v1g h LEU 25 N -1.07 1.00 -1.05 2.25 3.38 -1.58 -2.22 115.31 116.03 1v1g h LEU 25 Ca -0.10 -0.11 0.25 0.00 0.09 0.00 0.00 57.88 58.00 1v1g h LEU 25 Cb 0.77 -0.26 -0.12 0.00 0.09 0.00 0.00 40.66 41.14 1v1g h LEU 25 CO 0.16 0.83 0.61 0.00 0.09 0.00 0.00 178.44 180.13 1v1g h ALA 26 N 1.21 1.85 -0.00 1.53 0.00 -0.85 -2.03 119.26 120.97 1v1g h ALA 26 Ca 0.27 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1v1g h ALA 26 Cb 0.07 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1v1g h ALA 26 CO -0.04 -0.31 -0.22 -1.13 0.00 0.00 0.00 179.25 177.55 1v1g n SER 27 N -4.85 0.57 0.00 0.00 3.41 -0.64 -3.69 113.62 108.41 1v1g n SER 27 Ca 0.27 -0.46 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 1v1g n SER 27 Cb 0.76 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.71 1v1g n SER 27 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1v1g n VAL 28 N -1.06 0.47 -4.14 -3.33 0.24 -0.81 -5.03 118.33 104.67 1v1g n VAL 28 Ca 0.11 -0.71 -0.09 0.00 -2.04 0.00 0.00 64.34 61.61 1v1g n VAL 28 Cb 0.32 0.79 -0.10 0.00 -1.47 0.00 0.00 33.84 33.38 1v1g n VAL 28 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1v1g s THR 29 N -0.47 0.48 -0.48 3.34 -4.23 -0.89 -5.03 115.64 108.36 1v1g s THR 29 Ca 0.00 -1.89 0.10 0.00 -1.18 0.00 0.00 61.69 58.72 1v1g s THR 29 Cb 0.00 -1.66 0.10 0.00 1.34 0.00 0.00 72.50 72.28 1v1g s THR 29 CO 0.00 -0.89 1.26 -2.65 -0.54 0.00 0.00 174.62 171.81 1v1g n PRO 30 N 0.01 0.07 -1.66 3.99 -0.02 -1.26 -4.80 135.00 131.33 1v1g n PRO 30 Ca -0.12 0.53 -0.29 0.00 -2.02 0.00 0.00 63.50 61.59 1v1g n PRO 30 Cb 0.61 -1.80 0.10 0.00 -0.02 0.00 0.00 33.50 32.39 1v1g n PRO 30 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1v1g s PHE 31 N -3.20 2.84 0.37 6.00 0.40 -1.26 -5.06 117.98 118.08 1v1g s PHE 31 Ca -0.01 0.99 0.08 0.00 -0.60 0.00 0.00 56.93 57.39 1v1g s PHE 31 Cb 0.03 -3.24 -0.03 0.00 0.51 0.00 0.00 43.02 40.29 1v1g s PHE 31 CO 0.09 -1.84 0.30 0.95 0.70 0.00 0.00 175.22 175.42 1v1g s THR 32 N -3.29 3.04 0.18 0.64 -4.23 -1.26 -4.62 115.64 106.11 1v1g s THR 32 Ca 0.61 -1.42 -0.19 0.00 -1.18 0.00 0.00 61.69 59.51 1v1g s THR 32 Cb -0.13 -3.07 0.14 0.00 1.34 0.00 0.00 72.50 70.77 1v1g s THR 32 CO 0.53 -0.10 1.61 0.58 -0.54 0.00 0.00 174.62 176.70 1v1g h VAL 33 N 1.21 0.29 -0.85 2.29 2.07 -1.90 0.71 116.25 120.09 1v1g h VAL 33 Ca -0.43 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 1v1g h VAL 33 Cb 1.26 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 1v1g h VAL 33 CO 0.59 0.00 0.46 -0.33 0.02 0.00 0.00 177.57 178.31 1v1g h GLU 34 N -0.13 1.18 -0.36 1.57 3.07 -1.96 0.32 114.58 118.27 1v1g h GLU 34 Ca 0.23 -0.14 -0.10 0.00 -0.50 0.00 0.00 59.36 58.85 1v1g h GLU 34 Cb 0.50 -0.23 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 1v1g h GLU 34 CO -0.59 0.87 -0.20 0.93 -1.40 0.00 0.00 179.01 178.61 1v1g h GLU 35 N 1.19 0.70 0.02 2.33 5.08 -1.51 0.17 114.58 122.55 1v1g h GLU 35 Ca 0.30 -0.27 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1v1g h GLU 35 Cb 0.03 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1v1g h GLU 35 CO -0.05 0.85 -0.01 0.28 -1.00 0.00 0.00 179.01 179.08 1v1g h VAL 36 N 0.62 1.23 -0.70 3.13 2.07 0.25 0.12 116.25 122.97 1v1g h VAL 36 Ca 0.09 -0.77 0.15 0.00 0.82 0.00 0.00 66.70 66.99 1v1g h VAL 36 Cb 0.68 1.74 -0.11 0.00 -1.52 0.00 0.00 31.29 32.09 1v1g h VAL 36 CO 0.05 0.20 0.13 -0.33 0.02 0.00 0.00 177.57 177.64 1v1g h GLU 37 N -0.36 0.22 -0.21 1.57 5.08 -0.39 -1.09 114.58 119.40 1v1g h GLU 37 Ca -0.00 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1v1g h GLU 37 Cb 0.34 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 1v1g h GLU 37 CO 0.00 0.15 -0.00 0.00 -1.00 0.00 0.00 179.01 178.16 1v1g h ALA 38 N 1.60 0.18 0.00 3.43 0.00 -0.28 -1.70 119.26 122.48 1v1g h ALA 38 Ca 0.39 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 1v1g h ALA 38 Cb 0.66 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1v1g h ALA 38 CO -0.51 -0.43 -0.02 -0.07 0.00 0.00 0.00 179.25 178.21 1v1g h LEU 39 N 0.06 0.00 -0.50 0.00 3.38 0.30 -1.88 115.31 116.67 1v1g h LEU 39 Ca 0.10 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 1v1g h LEU 39 Cb 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1v1g h LEU 39 CO -0.16 0.02 -0.11 0.22 0.09 0.00 0.00 178.44 178.50 1v1g h TYR 40 N 0.00 1.07 -0.13 1.13 3.20 -0.28 0.11 116.97 122.07 1v1g h TYR 40 Ca -0.00 -0.23 0.03 0.00 3.14 0.00 0.00 58.73 61.67 1v1g h TYR 40 Cb 0.23 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.21 1v1g h TYR 40 CO 0.00 1.02 -0.05 0.93 -1.64 0.00 0.00 178.16 178.42 1v1g h GLU 41 N 0.81 -0.02 -0.56 1.82 4.39 -1.23 0.11 114.58 119.90 1v1g h GLU 41 Ca 0.13 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.79 1v1g h GLU 41 Cb 0.67 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.30 1v1g h GLU 41 CO 0.05 -0.02 0.18 1.25 -1.16 0.00 0.00 179.01 179.32 1v1g h LEU 42 N -0.02 0.77 -0.37 1.33 5.85 -1.34 -2.51 115.31 119.01 1v1g h LEU 42 Ca 0.07 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 1v1g h LEU 42 Cb 0.13 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1v1g h LEU 42 CO -0.15 0.72 0.14 0.15 -0.34 0.00 0.00 178.44 178.96 1v1g h PHE 43 N 0.81 0.56 -0.33 1.25 3.57 -0.17 -2.47 116.94 120.16 1v1g h PHE 43 Ca 0.19 -0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.72 1v1g h PHE 43 Cb 0.22 -0.17 -0.07 0.00 2.79 0.00 0.00 35.95 38.72 1v1g h PHE 43 CO 0.01 0.51 -0.16 0.87 -2.23 0.00 0.00 178.31 177.31 1v1g h LYS 44 N 0.45 -0.11 -0.22 1.11 1.57 -0.41 0.12 116.57 119.08 1v1g h LYS 44 Ca 0.12 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.93 1v1g h LYS 44 Cb 0.19 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 1v1g h LYS 44 CO -0.01 -0.07 -0.21 0.87 -0.57 0.00 0.00 179.45 179.45 1v1g h LYS 45 N -0.11 -0.10 0.00 3.15 1.79 -1.36 -2.84 116.57 117.09 1v1g h LYS 45 Ca 0.17 0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.64 1v1g h LYS 45 Cb 0.37 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 31.04 1v1g h LYS 45 CO -0.40 -0.07 -0.02 -0.07 -1.08 0.00 0.00 179.45 177.81 1v1g h LEU 46 N -0.10 0.00 -2.13 2.94 3.38 -0.92 -2.67 115.31 115.81 1v1g h LEU 46 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1v1g h LEU 46 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1v1g h LEU 46 CO -0.26 0.02 0.00 -1.54 0.09 0.00 0.00 178.44 176.75 1v1g n SER 47 N -3.17 3.16 0.00 -0.43 3.41 -0.03 -4.31 113.62 112.26 1v1g n SER 47 Ca -0.01 -1.95 0.00 0.00 -0.26 0.00 0.00 58.87 56.65 1v1g n SER 47 Cb 0.23 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1v1g n SER 47 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1v1g n SER 48 N 1.28 3.45 -0.12 4.04 3.41 -1.02 -4.11 113.62 120.54 1v1g n SER 48 Ca 0.19 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.85 1v1g n SER 48 Cb 0.55 0.60 0.10 0.00 -0.26 0.00 0.00 64.21 65.20 1v1g n SER 48 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1v1g n SER 49 N -1.16 -0.06 0.00 4.04 3.41 -1.14 -3.76 113.62 114.95 1v1g n SER 49 Ca 0.00 0.61 0.00 0.00 -0.26 0.00 0.00 58.87 59.22 1v1g n SER 49 Cb 0.08 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 1v1g n SER 49 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1v1g n ILE 50 N -4.37 0.00 -4.31 -1.33 5.41 -1.26 -5.05 119.36 108.46 1v1g n ILE 50 Ca 0.08 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.56 1v1g n ILE 50 Cb 0.26 -1.22 -0.10 0.00 -0.71 0.00 0.00 39.64 37.88 1v1g n ILE 50 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1v1g s ILE 51 N -2.00 3.09 -0.58 1.39 -1.09 -1.25 -5.07 121.20 115.70 1v1g s ILE 51 Ca 0.00 -1.70 0.06 0.00 -2.23 0.00 0.00 60.65 56.78 1v1g s ILE 51 Cb 0.00 -2.53 0.30 0.00 -1.58 0.00 0.00 42.46 38.65 1v1g s ILE 51 CO 0.00 -0.11 0.83 -0.67 -1.23 0.00 0.00 174.94 173.75 1v1g n ASP 52 N 0.06 3.69 -0.46 3.58 -0.08 -1.26 -3.57 116.55 118.51 1v1g n ASP 52 Ca -0.11 -3.48 0.04 0.00 -1.51 0.00 0.00 54.79 49.73 1v1g n ASP 52 Cb 0.55 -0.61 0.12 0.00 2.34 0.00 0.00 41.12 43.52 1v1g n ASP 52 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 1v1g n ASP 53 N 0.33 2.71 -0.82 1.67 5.75 -1.26 -4.98 116.55 119.95 1v1g n ASP 53 Ca 0.30 -2.09 -0.11 0.00 -0.01 0.00 0.00 54.79 52.88 1v1g n ASP 53 Cb 0.43 -0.19 -0.05 0.00 -1.03 0.00 0.00 41.12 40.28 1v1g n ASP 53 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1v1g n GLY 54 N 0.12 1.19 3.21 6.12 0.00 -1.26 -5.03 105.19 109.53 1v1g n GLY 54 Ca 0.09 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.44 1v1g n GLY 54 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1v1g s LEU 55 N -2.43 2.17 -0.60 0.99 1.43 -1.26 -4.59 118.68 114.40 1v1g s LEU 55 Ca 0.00 -0.50 -0.19 0.00 -1.03 0.00 0.00 54.13 52.42 1v1g s LEU 55 Cb 0.00 -0.82 0.11 0.00 0.03 0.00 0.00 46.19 45.50 1v1g s LEU 55 CO 0.00 0.11 0.70 -0.63 0.23 0.00 0.00 176.35 176.76 1v1g s ILE 56 N -0.82 4.83 0.82 -0.59 1.01 -0.54 -4.56 121.20 121.35 1v1g s ILE 56 Ca 0.05 -1.02 -0.11 0.00 0.00 0.00 0.00 60.65 59.57 1v1g s ILE 56 Cb -0.08 -4.49 0.09 0.00 0.01 0.00 0.00 42.46 37.98 1v1g s ILE 56 CO 0.02 -1.13 1.12 -1.00 0.00 0.00 0.00 174.94 173.95 1v1g s HIS 57 N 2.65 2.20 0.22 3.97 3.76 -1.26 -2.22 115.29 124.61 1v1g s HIS 57 Ca 0.11 1.65 -0.03 0.00 -0.15 0.00 0.00 55.06 56.64 1v1g s HIS 57 Cb -0.24 -3.18 0.19 0.00 1.11 0.00 0.00 32.58 30.46 1v1g s HIS 57 CO 0.06 -2.20 1.60 1.57 -0.85 0.00 0.00 174.74 174.92 1v1g h LYS 58 N -1.33 0.66 -0.92 1.40 2.10 -1.97 -0.85 116.57 115.66 1v1g h LYS 58 Ca -0.44 -0.31 0.25 0.00 -2.00 0.00 0.00 60.65 58.16 1v1g h LYS 58 Cb 1.25 -0.01 -0.16 0.00 -0.90 0.00 0.00 32.23 32.41 1v1g h LYS 58 CO 0.48 0.90 0.10 0.93 -2.00 0.00 0.00 179.45 179.86 1v1g h GLU 59 N 0.56 0.07 0.00 0.07 5.08 -1.98 -0.07 114.58 118.31 1v1g h GLU 59 Ca 0.06 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1v1g h GLU 59 Cb 0.84 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1v1g h GLU 59 CO 0.07 0.05 -0.14 0.93 -1.00 0.00 0.00 179.01 178.92 1v1g h GLU 60 N 0.07 0.00 -0.08 2.33 5.08 -1.54 -3.14 114.58 117.30 1v1g h GLU 60 Ca 0.57 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.86 1v1g h GLU 60 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1v1g h GLU 60 CO -0.81 0.00 -0.24 0.35 -1.00 0.00 0.00 179.01 177.31 1v1g h PHE 61 N 0.00 0.40 -0.10 4.33 3.57 0.21 -2.98 116.94 122.36 1v1g h PHE 61 Ca 0.00 -0.16 0.01 0.00 3.53 0.00 0.00 57.97 61.36 1v1g h PHE 61 Cb 0.92 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 1v1g h PHE 61 CO 0.00 0.85 -0.20 1.96 -2.23 0.00 0.00 178.31 178.70 1v1g h GLN 62 N -0.17 -0.17 -0.95 1.11 4.20 -1.24 -1.84 115.11 116.06 1v1g h GLN 62 Ca -0.01 0.01 0.14 0.00 0.06 0.00 0.00 58.65 58.86 1v1g h GLN 62 Cb 0.86 0.04 -0.15 0.00 0.30 0.00 0.00 27.48 28.52 1v1g h GLN 62 CO 0.05 -0.11 -0.37 -0.11 -0.67 0.00 0.00 178.83 177.62 1v1g n LEU 63 N -3.63 -0.63 -0.26 1.46 7.94 -1.19 0.07 117.00 120.76 1v1g n LEU 63 Ca -0.02 1.65 -0.04 0.00 -1.11 0.00 0.00 56.01 56.50 1v1g n LEU 63 Cb 0.13 -0.37 0.12 0.00 0.53 0.00 0.00 43.42 43.82 1v1g n LEU 63 CO 0.01 -1.48 1.09 0.00 -1.11 0.00 0.00 177.39 175.91 1v1g h ALA 64 N 1.28 1.17 -0.20 1.96 0.00 -1.28 0.77 119.26 122.97 1v1g h ALA 64 Ca 0.32 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 1v1g h ALA 64 Cb 0.56 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1v1g h ALA 64 CO -0.94 0.62 -0.45 -0.07 0.00 0.00 0.00 179.25 178.41 1v1g h LEU 65 N 1.10 0.75 0.02 0.00 3.38 -0.45 -2.97 115.31 117.15 1v1g h LEU 65 Ca 0.26 -0.56 0.02 0.00 0.09 0.00 0.00 57.88 57.69 1v1g h LEU 65 Cb 0.14 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1v1g h LEU 65 CO -0.03 1.17 -0.13 0.15 0.09 0.00 0.00 178.44 179.68 1v1g h PHE 66 N 0.36 -0.35 0.00 1.13 -0.00 0.51 -3.19 116.94 115.39 1v1g h PHE 66 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 57.98 1v1g h PHE 66 Cb 1.06 0.15 0.00 0.00 -0.00 0.00 0.00 35.95 37.16 1v1g h PHE 66 CO 0.09 -0.20 0.00 0.54 -0.00 0.00 0.00 178.31 178.74 1v1g n ARG 67 N -5.26 0.00 -1.71 1.11 5.12 0.26 -4.28 116.66 111.89 1v1g n ARG 67 Ca -0.06 0.00 -0.18 0.00 -1.93 0.00 0.00 57.85 55.69 1v1g n ARG 67 Cb 0.18 0.00 -0.10 0.00 -1.16 0.00 0.00 32.46 31.38 1v1g n ARG 67 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1v1g s ASN 68 N -1.75 3.76 0.07 0.55 4.22 -1.12 -4.87 114.94 115.80 1v1g s ASN 68 Ca 0.00 -1.16 -0.36 0.00 -2.14 0.00 0.00 52.86 49.20 1v1g s ASN 68 Cb 0.00 -2.60 -0.19 0.00 1.28 0.00 0.00 41.25 39.75 1v1g s ASN 68 CO 0.00 -4.44 0.98 -2.11 -2.04 0.00 0.00 177.10 169.50 1v1g n ARG 69 N 8.18 0.23 0.00 3.55 1.85 -1.21 -4.60 116.66 124.66 1v1g n ARG 69 Ca 0.42 0.08 0.00 0.00 -1.00 0.00 0.00 57.85 57.35 1v1g n ARG 69 Cb 0.47 -1.48 0.00 0.00 -1.05 0.00 0.00 32.46 30.40 1v1g n ARG 69 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1v1g n ASN 70 N 1.75 0.00 0.00 2.89 2.85 -1.25 -5.07 115.26 116.43 1v1g n ASN 70 Ca 0.19 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.66 1v1g n ASN 70 Cb 0.15 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.17 1v1g n ASN 70 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1v1g n ARG 71 N -0.93 0.00 -3.46 1.20 5.12 -1.26 -5.08 116.66 112.25 1v1g n ARG 71 Ca 0.00 0.00 0.01 0.00 -1.93 0.00 0.00 57.85 55.93 1v1g n ARG 71 Cb 0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.25 1v1g n ARG 71 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 1v1g s ARG 72 N 0.06 0.31 0.10 5.56 6.06 -1.26 -5.08 118.95 124.71 1v1g s ARG 72 Ca 0.00 0.72 -0.01 0.00 -2.50 0.00 0.00 55.73 53.94 1v1g s ARG 72 Cb 0.00 0.37 0.21 0.00 0.06 0.00 0.00 34.95 35.58 1v1g s ARG 72 CO 0.00 -0.10 0.53 -1.71 -2.50 0.00 0.00 175.30 171.53 1v1g n ASN 73 N 4.69 -0.08 -0.09 -2.12 2.85 -1.26 -0.73 115.26 118.52 1v1g n ASN 73 Ca -0.11 0.58 0.13 0.00 -0.11 0.00 0.00 54.58 55.08 1v1g n ASN 73 Cb 0.54 -0.19 0.48 0.00 1.24 0.00 0.00 39.78 41.84 1v1g n ASN 73 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1v1g n LEU 74 N -4.42 0.50 -0.28 1.20 4.77 -1.26 -3.29 117.00 114.22 1v1g n LEU 74 Ca 0.07 0.04 0.03 0.00 -0.03 0.00 0.00 56.01 56.11 1v1g n LEU 74 Cb 0.22 -0.24 0.06 0.00 -2.33 0.00 0.00 43.42 41.13 1v1g n LEU 74 CO -0.03 0.10 0.53 0.49 -1.33 0.00 0.00 177.39 177.15 1v1g n PHE 75 N -1.12 0.19 -0.17 -1.77 3.01 0.09 -4.54 117.46 113.14 1v1g n PHE 75 Ca 0.11 -0.43 -0.04 0.00 1.01 0.00 0.00 57.45 58.10 1v1g n PHE 75 Cb 0.31 -0.03 0.16 0.00 -0.01 0.00 0.00 39.48 39.91 1v1g n PHE 75 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1v1g h ALA 76 N 0.95 1.17 0.00 4.37 0.00 -1.42 0.68 119.26 125.01 1v1g h ALA 76 Ca 0.00 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 1v1g h ALA 76 Cb 0.55 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1v1g h ALA 76 CO 0.00 0.57 -0.30 -0.44 0.00 0.00 0.00 179.25 179.09 1v1g h ASP 77 N 0.90 0.00 0.02 0.00 3.32 -1.81 0.31 116.42 119.16 1v1g h ASP 77 Ca 0.20 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 57.08 1v1g h ASP 77 Cb 0.27 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.83 1v1g h ASP 77 CO -0.01 0.30 -0.68 0.03 -1.72 0.00 0.00 179.24 177.16 1v1g h ARG 78 N 0.00 0.43 -0.46 3.56 2.47 -1.47 -2.58 114.38 116.33 1v1g h ARG 78 Ca -0.00 -0.49 -0.08 0.00 -1.26 0.00 0.00 59.98 58.15 1v1g h ARG 78 Cb 0.72 0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 29.17 1v1g h ARG 78 CO 0.04 1.15 -0.03 0.82 0.56 0.00 0.00 179.97 182.51 1v1g h ILE 79 N -0.09 1.27 -0.66 2.04 2.04 0.44 -2.41 117.51 120.14 1v1g h ILE 79 Ca -0.09 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 64.66 1v1g h ILE 79 Cb 1.41 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 38.51 1v1g h ILE 79 CO 0.13 0.38 0.42 0.15 0.00 0.00 0.00 178.15 179.23 1v1g h PHE 80 N 0.68 0.85 -0.61 1.37 3.57 -0.47 0.55 116.94 122.88 1v1g h PHE 80 Ca 0.13 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 1v1g h PHE 80 Cb 0.54 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 1v1g h PHE 80 CO 0.04 0.56 0.30 0.22 -2.23 0.00 0.00 178.31 177.20 1v1g h ASP 81 N 0.89 0.78 0.45 0.41 1.82 -1.28 -1.66 116.42 117.84 1v1g h ASP 81 Ca 0.24 -0.07 -0.30 0.00 -0.39 0.00 0.00 57.03 56.50 1v1g h ASP 81 Cb -0.06 -0.20 -0.05 0.00 0.68 0.00 0.00 39.33 39.70 1v1g h ASP 81 CO -0.05 0.66 -1.73 -0.37 -1.61 0.00 0.00 179.24 176.14 1v1g h VAL 82 N 0.86 0.83 -1.01 2.25 -1.51 -0.88 -3.13 116.25 113.66 1v1g h VAL 82 Ca 0.21 -2.67 0.24 0.00 -1.23 0.00 0.00 66.70 63.25 1v1g h VAL 82 Cb 0.08 2.44 -0.10 0.00 -2.13 0.00 0.00 31.29 31.58 1v1g h VAL 82 CO -0.03 0.54 0.63 -0.26 -1.23 0.00 0.00 177.57 177.22 1v1g h PHE 83 N 0.01 0.83 0.00 5.19 -1.00 -0.86 -3.17 116.94 117.94 1v1g h PHE 83 Ca -0.30 0.03 -0.50 0.00 2.81 0.00 0.00 57.97 60.01 1v1g h PHE 83 Cb 2.01 -0.24 0.02 0.00 3.61 0.00 0.00 35.95 41.35 1v1g h PHE 83 CO 0.01 0.10 3.03 -3.47 -1.61 0.00 0.00 178.31 176.37 1v1g n ASP 84 N -4.72 6.04 0.08 2.17 4.64 -0.63 -4.71 116.55 119.43 1v1g n ASP 84 Ca 0.25 -2.44 -0.13 0.00 -1.38 0.00 0.00 54.79 51.09 1v1g n ASP 84 Cb 0.77 -1.27 -0.06 0.00 -1.04 0.00 0.00 41.12 39.52 1v1g n ASP 84 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 1v1g h VAL 85 N 3.37 0.25 -2.04 5.18 2.07 -1.78 -3.23 116.25 120.07 1v1g h VAL 85 Ca 0.62 0.00 -0.58 0.00 0.82 0.00 0.00 66.70 67.56 1v1g h VAL 85 Cb 0.24 0.25 -0.10 0.00 -1.52 0.00 0.00 31.29 30.16 1v1g h VAL 85 CO 1.60 0.00 1.09 -1.59 0.02 0.00 0.00 177.57 178.69 1v1g s LYS 86 N -5.97 3.33 -0.76 1.57 -2.85 -1.26 -4.90 119.74 108.90 1v1g s LYS 86 Ca -0.16 -0.72 -0.17 0.00 -1.00 0.00 0.00 55.97 53.92 1v1g s LYS 86 Cb 0.08 -4.60 -0.18 0.00 -2.06 0.00 0.00 37.83 31.08 1v1g s LYS 86 CO 0.64 -2.08 1.98 0.54 0.10 0.00 0.00 175.35 176.53 1v1g n ARG 87 N 8.74 0.19 -0.73 1.78 1.74 -1.22 -4.57 116.66 122.60 1v1g n ARG 87 Ca 0.12 -0.73 0.01 0.00 -0.77 0.00 0.00 57.85 56.48 1v1g n ARG 87 Cb 0.49 -2.63 0.00 0.00 -1.02 0.00 0.00 32.46 29.30 1v1g n ARG 87 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1v1g n ASN 88 N 13.34 0.16 0.00 0.55 6.94 -1.26 -5.04 115.26 129.95 1v1g n ASN 88 Ca 0.40 -1.87 0.00 0.00 -0.02 0.00 0.00 54.58 53.09 1v1g n ASN 88 Cb 0.39 -0.17 0.00 0.00 -2.36 0.00 0.00 39.78 37.64 1v1g n ASN 88 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1v1g n GLY 89 N 0.10 2.13 3.30 4.83 0.00 -1.26 -4.99 105.19 109.30 1v1g n GLY 89 Ca -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1v1g n GLY 89 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1v1g s VAL 90 N -3.06 0.32 -0.23 1.61 -7.23 -1.26 -4.57 120.40 105.98 1v1g s VAL 90 Ca 0.00 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.14 1v1g s VAL 90 Cb 0.00 -2.55 0.01 0.00 0.56 0.00 0.00 36.38 34.40 1v1g s VAL 90 CO 0.00 0.00 -0.06 -0.63 -0.31 0.00 0.00 175.10 174.10 1v1g s ILE 91 N -3.78 3.05 0.48 -0.62 1.01 -0.94 -4.68 121.20 115.71 1v1g s ILE 91 Ca 0.37 -0.77 -0.03 0.00 0.00 0.00 0.00 60.65 60.22 1v1g s ILE 91 Cb 0.06 -2.45 -0.02 0.00 0.01 0.00 0.00 42.46 40.06 1v1g s ILE 91 CO 0.15 0.33 0.75 -1.61 0.00 0.00 0.00 174.94 174.56 1v1g s GLU 92 N 1.40 3.31 0.14 2.79 2.02 -1.26 -1.47 118.70 125.63 1v1g s GLU 92 Ca 0.03 -0.07 -0.27 0.00 0.02 0.00 0.00 54.97 54.68 1v1g s GLU 92 Cb -0.15 -2.44 -0.02 0.00 0.10 0.00 0.00 34.13 31.62 1v1g s GLU 92 CO -0.05 -0.26 1.58 0.35 0.02 0.00 0.00 175.26 176.91 1v1g h PHE 93 N 0.26 -1.16 -0.31 1.61 3.57 -1.95 0.86 116.94 119.81 1v1g h PHE 93 Ca -0.47 0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.04 1v1g h PHE 93 Cb 1.23 0.55 -0.02 0.00 2.79 0.00 0.00 35.95 40.50 1v1g h PHE 93 CO 0.52 -0.45 -0.02 0.78 -2.23 0.00 0.00 178.31 176.91 1v1g h GLY 94 N -0.39 0.53 1.21 2.40 0.00 -1.95 -0.45 103.07 104.41 1v1g h GLY 94 Ca 0.11 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 1v1g h GLY 94 CO -0.48 0.29 0.38 0.83 0.00 0.00 0.00 176.54 177.56 1v1g h GLU 95 N 0.47 1.03 -0.35 4.80 5.08 -1.57 -1.58 114.58 122.47 1v1g h GLU 95 Ca 0.10 -0.13 -0.15 0.00 -1.00 0.00 0.00 59.36 58.19 1v1g h GLU 95 Cb 0.34 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1v1g h GLU 95 CO 0.01 0.78 -0.35 0.35 -1.00 0.00 0.00 179.01 178.80 1v1g h PHE 96 N 1.04 1.03 -0.08 4.33 3.57 0.07 -1.76 116.94 125.13 1v1g h PHE 96 Ca 0.26 -0.31 -0.21 0.00 3.53 0.00 0.00 57.97 61.24 1v1g h PHE 96 Cb 0.07 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.59 1v1g h PHE 96 CO 0.01 1.11 -0.79 0.28 -2.23 0.00 0.00 178.31 176.68 1v1g h VAL 97 N 0.65 1.35 -0.05 1.41 2.07 -1.00 -2.08 116.25 118.59 1v1g h VAL 97 Ca 0.06 -2.15 -0.20 0.00 0.82 0.00 0.00 66.70 65.23 1v1g h VAL 97 Cb 0.94 2.14 -0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1v1g h VAL 97 CO 0.09 0.66 -0.81 0.03 0.02 0.00 0.00 177.57 177.55 1v1g h ARG 98 N 0.35 0.42 -0.09 1.57 3.08 -1.29 0.76 114.38 119.18 1v1g h ARG 98 Ca -0.05 -0.38 -0.06 0.00 0.07 0.00 0.00 59.98 59.56 1v1g h ARG 98 Cb 1.40 0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.54 1v1g h ARG 98 CO 0.15 1.03 -0.19 0.77 -1.07 0.00 0.00 179.97 180.66 1v1g h SER 99 N 0.27 0.32 -0.88 7.04 0.02 -1.36 -3.02 113.55 115.93 1v1g h SER 99 Ca -0.05 -0.57 0.07 0.00 -0.84 0.00 0.00 61.79 60.41 1v1g h SER 99 Cb 1.41 -0.09 -0.07 0.00 0.14 0.00 0.00 62.40 63.79 1v1g h SER 99 CO 0.14 0.83 0.55 0.25 -1.14 0.00 0.00 176.83 177.45 1v1g h LEU 100 N -0.18 0.84 -2.14 5.07 6.46 -1.36 -2.21 115.31 121.78 1v1g h LEU 100 Ca 0.00 0.03 0.07 0.00 -0.12 0.00 0.00 57.88 57.85 1v1g h LEU 100 Cb 0.78 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 40.55 1v1g h LEU 100 CO 0.04 0.52 0.21 1.23 -0.62 0.00 0.00 178.44 179.81 1v1g h GLY 101 N 0.96 0.00 2.00 3.75 0.00 -0.72 0.14 103.07 109.21 1v1g h GLY 101 Ca 0.40 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.69 1v1g h GLY 101 CO -0.20 0.00 -0.17 -2.08 0.00 0.00 0.00 176.54 174.09 1v1g h VAL 102 N 0.00 0.78 -0.00 4.60 2.07 -1.33 -1.90 116.25 120.46 1v1g h VAL 102 Ca 0.11 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.94 1v1g h VAL 102 Cb 0.52 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.71 1v1g h VAL 102 CO -0.00 0.17 -0.14 0.49 0.02 0.00 0.00 177.57 178.11 1v1g n PHE 103 N -3.83 0.00 -1.94 1.57 3.01 0.49 -4.69 117.46 112.07 1v1g n PHE 103 Ca -0.02 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.03 1v1g n PHE 103 Cb 0.27 -0.21 -0.01 0.00 -0.01 0.00 0.00 39.48 39.52 1v1g n PHE 103 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 1v1g s HIS 104 N -2.56 2.82 0.43 1.38 2.46 -0.71 -1.10 115.29 117.99 1v1g s HIS 104 Ca 0.26 1.23 0.21 0.00 0.47 0.00 0.00 55.06 57.23 1v1g s HIS 104 Cb 0.20 -3.87 1.16 0.00 -0.13 0.00 0.00 32.58 29.94 1v1g s HIS 104 CO 0.50 -2.55 1.81 -1.35 -2.47 0.00 0.00 174.74 170.68 1v1g h PRO 105 N 3.43 0.33 -0.01 2.88 0.11 -1.89 -1.50 132.00 135.35 1v1g h PRO 105 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1v1g h PRO 105 Cb 1.23 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1v1g h PRO 105 CO 0.67 0.22 -0.21 0.43 -0.21 0.00 0.00 178.00 178.89 1v1g n SER 106 N -4.52 0.84 -4.68 -2.05 7.64 -1.26 -4.92 113.62 104.67 1v1g n SER 106 Ca 0.23 -0.78 -0.44 0.00 1.01 0.00 0.00 58.87 58.90 1v1g n SER 106 Cb 0.86 0.07 -0.02 0.00 -1.01 0.00 0.00 64.21 64.11 1v1g n SER 106 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1v1g n ALA 107 N -0.76 1.22 -1.70 -0.43 0.00 -0.57 -4.88 120.51 113.38 1v1g n ALA 107 Ca 0.13 0.39 -0.43 0.00 0.00 0.00 0.00 53.44 53.52 1v1g n ALA 107 Cb 0.33 -2.27 -0.02 0.00 0.00 0.00 0.00 19.45 17.49 1v1g n ALA 107 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1v1g n PRO 108 N 1.45 2.28 0.10 0.00 -0.02 -1.26 -4.88 135.00 132.67 1v1g n PRO 108 Ca 0.09 0.81 0.18 0.00 -2.02 0.00 0.00 63.50 62.56 1v1g n PRO 108 Cb 0.33 -2.50 0.73 0.00 -0.02 0.00 0.00 33.50 32.05 1v1g n PRO 108 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1v1g h VAL 109 N 3.05 0.66 -0.16 -1.45 3.04 -1.96 -2.19 116.25 117.25 1v1g h VAL 109 Ca -0.46 0.00 0.05 0.00 -1.01 0.00 0.00 66.70 65.28 1v1g h VAL 109 Cb 1.26 0.79 -0.05 0.00 -2.01 0.00 0.00 31.29 31.28 1v1g h VAL 109 CO 0.74 0.00 -0.17 -0.74 -1.01 0.00 0.00 177.57 176.40 1v1g h HIS 110 N 0.00 -0.42 -0.40 3.17 -0.00 -1.99 0.03 115.15 115.54 1v1g h HIS 110 Ca 0.17 0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 60.51 1v1g h HIS 110 Cb 0.75 0.21 -0.02 0.00 -0.00 0.00 0.00 27.41 28.35 1v1g h HIS 110 CO 0.00 -0.24 0.03 0.93 -0.00 0.00 0.00 177.93 178.65 1v1g h GLU 111 N -0.19 0.61 -0.44 5.26 4.39 -1.77 -0.89 114.58 121.55 1v1g h GLU 111 Ca 0.10 -0.13 -0.12 0.00 0.34 0.00 0.00 59.36 59.55 1v1g h GLU 111 Cb 0.35 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 1v1g h GLU 111 CO -0.27 0.61 -0.20 0.87 -1.16 0.00 0.00 179.01 178.86 1v1g h LYS 112 N 0.59 0.91 -0.36 2.33 1.57 -1.33 -0.10 116.57 120.18 1v1g h LYS 112 Ca 0.13 -0.39 -0.05 0.00 -1.87 0.00 0.00 60.65 58.46 1v1g h LYS 112 Cb 0.32 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1v1g h LYS 112 CO 0.01 1.04 0.02 0.28 -0.57 0.00 0.00 179.45 180.23 1v1g h VAL 113 N 0.74 1.25 -0.10 0.50 2.07 -0.70 -1.15 116.25 118.87 1v1g h VAL 113 Ca 0.10 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 1v1g h VAL 113 Cb 0.76 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.68 1v1g h VAL 113 CO 0.06 0.31 0.03 0.50 0.02 0.00 0.00 177.57 178.49 1v1g h LYS 114 N 0.45 0.15 -0.15 1.57 3.64 -1.14 -1.66 116.57 119.44 1v1g h LYS 114 Ca 0.11 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1v1g h LYS 114 Cb 0.42 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1v1g h LYS 114 CO 0.01 0.30 0.09 0.35 -2.27 0.00 0.00 179.45 177.93 1v1g h PHE 115 N -0.03 0.18 -0.68 1.91 3.57 -1.01 -1.80 116.94 119.08 1v1g h PHE 115 Ca 0.03 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.61 1v1g h PHE 115 Cb 0.21 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.85 1v1g h PHE 115 CO -0.01 0.11 0.45 0.00 -2.23 0.00 0.00 178.31 176.63 1v1g h ALA 116 N 1.06 1.78 -0.33 2.41 0.00 -1.11 -1.14 119.26 121.94 1v1g h ALA 116 Ca 0.06 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1v1g h ALA 116 Cb -0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1v1g h ALA 116 CO -0.02 0.11 -0.02 0.35 0.00 0.00 0.00 179.25 179.67 1v1g h PHE 117 N 0.66 0.65 -0.77 0.00 3.57 -0.59 -2.42 116.94 118.05 1v1g h PHE 117 Ca 0.30 -0.12 -0.03 0.00 3.53 0.00 0.00 57.97 61.65 1v1g h PHE 117 Cb 0.31 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 38.85 1v1g h PHE 117 CO -0.00 0.73 0.37 0.87 -2.23 0.00 0.00 178.31 178.05 1v1g h LYS 118 N 0.39 1.10 -0.98 1.11 1.57 -0.73 -2.18 116.57 116.85 1v1g h LYS 118 Ca 0.09 -0.16 0.11 0.00 -1.87 0.00 0.00 60.65 58.83 1v1g h LYS 118 Cb 0.48 -0.20 -0.08 0.00 0.08 0.00 0.00 32.23 32.51 1v1g h LYS 118 CO 0.02 0.85 0.62 1.25 -0.57 0.00 0.00 179.45 181.62 1v1g h LEU 119 N 1.08 0.89 0.00 2.94 5.85 -1.06 -3.10 115.31 121.91 1v1g h LEU 119 Ca 0.26 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.92 1v1g h LEU 119 Cb 0.11 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1v1g h LEU 119 CO -0.03 0.49 -1.26 -1.22 -0.34 0.00 0.00 178.44 176.07 1v1g n TYR 120 N -4.59 0.97 -0.95 1.25 0.53 -0.93 -4.39 117.16 109.06 1v1g n TYR 120 Ca 0.18 0.31 -0.41 0.00 -1.02 0.00 0.00 57.90 56.95 1v1g n TYR 120 Cb 0.35 -1.03 -0.09 0.00 -1.03 0.00 0.00 39.34 37.53 1v1g n TYR 120 CO 0.00 0.00 0.00 -3.47 -1.02 0.00 0.00 176.86 172.37 1v1g n ASP 121 N -2.80 1.80 0.23 7.72 -0.08 -0.85 -4.77 116.55 117.81 1v1g n ASP 121 Ca -0.06 -2.59 -0.15 0.00 -1.51 0.00 0.00 54.79 50.48 1v1g n ASP 121 Cb 0.72 -0.92 -0.08 0.00 2.34 0.00 0.00 41.12 43.19 1v1g n ASP 121 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1v1g h LEU 122 N 16.49 -0.78 -9.58 -2.67 3.38 -1.82 -3.28 115.31 117.05 1v1g h LEU 122 Ca 0.31 0.06 -0.52 0.00 0.09 0.00 0.00 57.88 57.82 1v1g h LEU 122 Cb 0.72 0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 1v1g h LEU 122 CO 1.89 -0.45 0.34 -0.13 0.09 0.00 0.00 178.44 180.19 1v1g s ARG 123 N -6.05 4.69 -1.38 1.13 0.52 -1.26 -4.98 118.95 111.63 1v1g s ARG 123 Ca -0.17 1.41 -0.15 0.00 -0.52 0.00 0.00 55.73 56.31 1v1g s ARG 123 Cb 0.06 -3.36 0.07 0.00 0.52 0.00 0.00 34.95 32.23 1v1g s ARG 123 CO 0.63 0.25 2.01 0.00 0.02 0.00 0.00 175.30 178.22 1v1g n GLN 124 N 2.65 3.06 -0.12 3.54 10.64 -1.24 -4.70 117.38 131.20 1v1g n GLN 124 Ca 0.01 -2.95 0.07 0.00 -1.83 0.00 0.00 57.00 52.30 1v1g n GLN 124 Cb 0.49 -3.30 0.13 0.00 -0.86 0.00 0.00 30.24 26.70 1v1g n GLN 124 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1v1g n THR 125 N 5.27 0.55 -0.87 -0.39 -2.24 -1.26 -4.97 114.28 110.36 1v1g n THR 125 Ca 0.49 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1v1g n THR 125 Cb 0.41 0.86 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 1v1g n THR 125 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1v1g n GLY 126 N 0.80 0.86 3.20 3.38 0.00 -1.26 -5.01 105.19 107.15 1v1g n GLY 126 Ca 0.12 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 1v1g n GLY 126 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1v1g s PHE 127 N -3.40 1.14 -0.23 1.61 0.40 -1.26 -4.68 117.98 111.56 1v1g s PHE 127 Ca 0.00 -1.35 -0.05 0.00 -0.60 0.00 0.00 56.93 54.93 1v1g s PHE 127 Cb 0.00 -0.57 -0.02 0.00 0.51 0.00 0.00 43.02 42.94 1v1g s PHE 127 CO 0.00 -0.60 0.01 0.42 0.70 0.00 0.00 175.22 175.75 1v1g s ILE 128 N -4.12 3.82 0.21 0.64 1.01 0.16 -4.52 121.20 118.39 1v1g s ILE 128 Ca 0.37 -0.34 -0.00 0.00 0.00 0.00 0.00 60.65 60.67 1v1g s ILE 128 Cb 0.07 -2.76 -0.04 0.00 0.01 0.00 0.00 42.46 39.74 1v1g s ILE 128 CO 0.11 0.39 0.39 -1.61 0.00 0.00 0.00 174.94 174.22 1v1g s GLU 129 N 1.47 3.51 0.28 2.79 8.01 -1.26 0.12 118.70 133.63 1v1g s GLU 129 Ca 0.05 -0.37 -0.01 0.00 0.01 0.00 0.00 54.97 54.65 1v1g s GLU 129 Cb -0.15 -2.84 0.64 0.00 -4.31 0.00 0.00 34.13 27.47 1v1g s GLU 129 CO 0.00 0.40 1.61 -0.09 0.01 0.00 0.00 175.26 177.18 1v1g h ARG 130 N 1.92 0.07 0.00 1.61 2.43 -2.00 0.20 114.38 118.63 1v1g h ARG 130 Ca -0.48 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1v1g h ARG 130 Cb 1.19 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1v1g h ARG 130 CO 0.67 0.05 0.00 1.49 -1.51 0.00 0.00 179.97 180.67 1v1g h GLU 131 N 0.08 0.00 0.15 0.20 4.57 -1.97 -1.62 114.58 115.99 1v1g h GLU 131 Ca 0.53 0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 58.38 1v1g h GLU 131 Cb 1.04 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.63 1v1g h GLU 131 CO -0.79 0.00 -1.69 0.93 -1.18 0.00 0.00 179.01 176.28 1v1g h GLU 132 N 0.00 0.32 -0.57 1.92 5.08 -0.95 -2.70 114.58 117.68 1v1g h GLU 132 Ca 0.00 -0.54 0.08 0.00 -1.00 0.00 0.00 59.36 57.91 1v1g h GLU 132 Cb 0.40 0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 1v1g h GLU 132 CO 0.00 1.20 0.38 1.25 -1.00 0.00 0.00 179.01 180.84 1v1g h LEU 133 N 0.09 0.38 0.25 1.33 5.85 -1.01 -0.99 115.31 121.20 1v1g h LEU 133 Ca -0.31 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 1v1g h LEU 133 Cb 2.06 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 43.02 1v1g h LEU 133 CO 0.16 0.23 -0.12 0.50 -0.34 0.00 0.00 178.44 178.88 1v1g h LYS 134 N 0.42 -0.32 -0.19 1.25 3.64 -1.32 -0.44 116.57 119.62 1v1g h LYS 134 Ca 0.26 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.71 1v1g h LYS 134 Cb 0.46 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1v1g h LYS 134 CO -0.07 0.03 0.18 0.93 -2.27 0.00 0.00 179.45 178.25 1v1g h GLU 135 N -0.92 0.00 0.14 1.90 4.39 -1.38 0.35 114.58 119.07 1v1g h GLU 135 Ca -0.03 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1v1g h GLU 135 Cb 0.50 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1v1g h GLU 135 CO 0.06 0.00 -0.07 1.98 -1.16 0.00 0.00 179.01 179.82 1v1g h MET 136 N 0.00 -0.18 -0.98 2.33 4.05 -0.87 -2.18 114.93 117.09 1v1g h MET 136 Ca 0.09 0.01 0.29 0.00 -0.28 0.00 0.00 59.70 59.81 1v1g h MET 136 Cb 0.44 0.04 -0.18 0.00 -0.80 0.00 0.00 31.60 31.11 1v1g h MET 136 CO -0.00 -0.12 0.11 0.28 0.23 0.00 0.00 176.91 177.41 1v1g h VAL 137 N -0.27 0.05 0.15 -5.77 2.07 -0.88 0.11 116.25 111.71 1v1g h VAL 137 Ca -0.02 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1v1g h VAL 137 Cb 0.15 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 29.94 1v1g h VAL 137 CO 0.03 0.00 -0.07 0.58 0.02 0.00 0.00 177.57 178.13 1v1g h VAL 138 N 0.03 0.86 -0.64 2.57 2.07 -0.94 -1.25 116.25 118.96 1v1g h VAL 138 Ca 0.62 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 68.08 1v1g h VAL 138 Cb 1.34 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 1v1g h VAL 138 CO -0.88 0.01 0.32 0.00 0.02 0.00 0.00 177.57 177.04 1v1g h ALA 139 N 0.63 1.36 -0.19 1.67 0.00 -0.48 -0.94 119.26 121.32 1v1g h ALA 139 Ca -0.02 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1v1g h ALA 139 Cb 0.17 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1v1g h ALA 139 CO 0.03 0.51 -0.09 -0.07 0.00 0.00 0.00 179.25 179.63 1v1g h LEU 140 N 0.89 0.41 -0.25 0.00 3.38 -0.95 -2.16 115.31 116.62 1v1g h LEU 140 Ca 0.22 -0.41 0.06 0.00 0.09 0.00 0.00 57.88 57.84 1v1g h LEU 140 Cb 0.07 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.65 1v1g h LEU 140 CO -0.03 0.73 -0.15 -0.07 0.09 0.00 0.00 178.44 179.01 1v1g h LEU 141 N 0.08 -0.49 -2.06 1.67 3.38 -0.78 -1.15 115.31 115.96 1v1g h LEU 141 Ca 0.04 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1v1g h LEU 141 Cb 0.57 0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1v1g h LEU 141 CO 0.03 -0.19 -0.09 -0.74 0.09 0.00 0.00 178.44 177.54 1v1g h HIS 142 N -0.13 0.00 -0.70 1.13 2.76 -1.15 -1.15 115.15 115.91 1v1g h HIS 142 Ca 0.14 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.24 1v1g h HIS 142 Cb 0.34 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.27 1v1g h HIS 142 CO -0.33 0.09 0.15 1.49 -1.30 0.00 0.00 177.93 178.03 1v1g h GLU 143 N 0.00 1.14 -0.77 5.26 4.81 -0.53 -2.55 114.58 121.94 1v1g h GLU 143 Ca -0.00 -0.28 -0.09 0.00 -0.13 0.00 0.00 59.36 58.85 1v1g h GLU 143 Cb 0.21 -0.14 -0.06 0.00 0.63 0.00 0.00 28.75 29.39 1v1g h GLU 143 CO 0.01 1.01 0.12 -1.13 -0.73 0.00 0.00 179.01 178.29 1v1g n SER 144 N -4.23 4.29 -1.52 1.04 3.41 -0.51 -4.90 113.62 111.19 1v1g n SER 144 Ca 0.05 -2.81 -0.13 0.00 -0.26 0.00 0.00 58.87 55.71 1v1g n SER 144 Cb 0.27 -0.67 -0.01 0.00 -0.26 0.00 0.00 64.21 63.55 1v1g n SER 144 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1v1g n GLU 145 N 0.17 -1.07 -3.96 4.33 1.02 -0.92 -4.99 120.64 115.22 1v1g n GLU 145 Ca 0.26 0.65 -0.34 0.00 -0.02 0.00 0.00 57.16 57.71 1v1g n GLU 145 Cb 1.06 -4.89 -0.14 0.00 -0.02 0.00 0.00 31.44 27.44 1v1g n GLU 145 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1v1g s LEU 146 N -3.84 3.28 -0.26 -4.62 1.43 -0.72 -4.99 118.68 108.96 1v1g s LEU 146 Ca 0.00 -0.96 0.02 0.00 -1.03 0.00 0.00 54.13 52.17 1v1g s LEU 146 Cb -0.00 -1.66 0.06 0.00 0.03 0.00 0.00 46.19 44.62 1v1g s LEU 146 CO 0.00 -0.15 -0.08 0.54 0.23 0.00 0.00 176.35 176.89 1v1g s VAL 147 N 1.30 1.95 0.21 -1.59 0.11 -1.26 -3.21 120.40 117.91 1v1g s VAL 147 Ca -0.01 -1.54 0.07 0.00 -2.93 0.00 0.00 61.98 57.57 1v1g s VAL 147 Cb -0.17 -2.14 -0.04 0.00 -1.53 0.00 0.00 36.38 32.50 1v1g s VAL 147 CO -0.04 -0.09 0.09 -0.76 -3.33 0.00 0.00 175.10 170.97 1v1g s LEU 148 N 1.19 3.55 0.61 2.54 1.43 -1.26 -5.08 118.68 121.67 1v1g s LEU 148 Ca -0.07 -0.34 -0.18 0.00 -1.03 0.00 0.00 54.13 52.52 1v1g s LEU 148 Cb -0.20 -2.13 -0.07 0.00 0.03 0.00 0.00 46.19 43.82 1v1g s LEU 148 CO -0.06 0.03 0.55 -1.54 0.23 0.00 0.00 176.35 175.57 1v1g n SER 149 N -0.61 -0.98 0.21 2.29 3.41 -1.26 -4.79 113.62 111.89 1v1g n SER 149 Ca -0.08 0.70 0.04 0.00 -0.26 0.00 0.00 58.87 59.27 1v1g n SER 149 Cb 0.56 -1.20 0.44 0.00 -0.26 0.00 0.00 64.21 63.76 1v1g n SER 149 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1v1g h GLU 150 N 0.09 0.00 0.00 4.33 4.57 -1.98 -0.73 114.58 120.85 1v1g h GLU 150 Ca -0.46 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 57.57 1v1g h GLU 150 Cb 1.38 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.95 1v1g h GLU 150 CO 0.46 0.29 -1.19 0.38 -1.18 0.00 0.00 179.01 177.77 1v1g h ASP 151 N 0.00 0.00 -0.51 1.04 3.04 -1.99 -1.64 116.42 116.35 1v1g h ASP 151 Ca -0.00 0.00 0.02 0.00 -3.24 0.00 0.00 57.03 53.80 1v1g h ASP 151 Cb 0.53 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.78 1v1g h ASP 151 CO 0.04 0.56 0.31 0.24 -2.04 0.00 0.00 179.24 178.35 1v1g h MET 152 N 0.00 0.61 0.07 4.15 2.86 -1.79 -3.00 114.93 117.84 1v1g h MET 152 Ca -0.12 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.48 1v1g h MET 152 Cb 1.53 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 33.05 1v1g h MET 152 CO 0.05 0.41 -0.03 0.82 1.06 0.00 0.00 176.91 179.21 1v1g h ILE 153 N 0.63 1.10 0.00 -1.22 2.04 -1.09 -2.04 117.51 116.92 1v1g h ILE 153 Ca 0.20 -0.58 -0.04 0.00 1.00 0.00 0.00 64.86 65.44 1v1g h ILE 153 Cb -0.01 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1v1g h ILE 153 CO -0.07 0.14 -0.18 -0.33 0.00 0.00 0.00 178.15 177.71 1v1g h GLU 154 N -0.35 0.00 -0.11 2.37 4.39 -1.37 0.37 114.58 119.88 1v1g h GLU 154 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1v1g h GLU 154 Cb 0.31 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 1v1g h GLU 154 CO 0.02 0.18 0.06 0.28 -1.16 0.00 0.00 179.01 178.39 1v1g h VAL 155 N 0.00 1.02 0.12 3.13 2.07 -1.39 0.38 116.25 121.59 1v1g h VAL 155 Ca -0.00 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1v1g h VAL 155 Cb 0.51 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1v1g h VAL 155 CO 0.02 0.02 -0.06 0.24 0.02 0.00 0.00 177.57 177.82 1v1g h MET 156 N 0.14 -0.17 -0.51 1.57 2.86 -0.61 -1.25 114.93 116.96 1v1g h MET 156 Ca 0.04 0.01 -0.07 0.00 -2.06 0.00 0.00 59.70 57.63 1v1g h MET 156 Cb -0.01 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 1v1g h MET 156 CO -0.02 -0.11 0.05 0.28 1.06 0.00 0.00 176.91 178.17 1v1g h VAL 157 N -0.17 1.24 -0.39 -2.22 2.07 -0.93 -0.84 116.25 115.01 1v1g h VAL 157 Ca -0.02 -0.95 -0.04 0.00 0.82 0.00 0.00 66.70 66.51 1v1g h VAL 157 Cb 0.14 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1v1g h VAL 157 CO 0.02 0.34 0.07 -0.78 0.02 0.00 0.00 177.57 177.25 1v1g h ASP 158 N 0.78 0.61 -0.19 0.57 3.58 -0.11 0.13 116.42 121.79 1v1g h ASP 158 Ca 0.16 -0.25 -0.01 0.00 0.42 0.00 0.00 57.03 57.35 1v1g h ASP 158 Cb 0.40 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.28 1v1g h ASP 158 CO 0.01 0.70 0.08 0.50 -2.88 0.00 0.00 179.24 177.65 1v1g h LYS 159 N 0.49 0.28 -0.55 0.28 3.64 -0.88 -2.03 116.57 117.80 1v1g h LYS 159 Ca 0.12 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.35 1v1g h LYS 159 Cb 0.35 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1v1g h LYS 159 CO 0.01 0.34 -0.07 0.00 -2.27 0.00 0.00 179.45 177.46 1v1g h ALA 160 N 0.92 0.74 -0.56 5.00 0.00 -1.17 -1.84 119.26 122.36 1v1g h ALA 160 Ca 0.06 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1v1g h ALA 160 Cb 0.17 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1v1g h ALA 160 CO -0.01 0.63 0.14 0.35 0.00 0.00 0.00 179.25 180.36 1v1g h PHE 161 N 0.89 0.94 0.00 0.00 3.57 -0.64 -0.38 116.94 121.31 1v1g h PHE 161 Ca 0.15 -0.11 -0.08 0.00 3.53 0.00 0.00 57.97 61.46 1v1g h PHE 161 Cb 0.63 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 1v1g h PHE 161 CO 0.04 0.81 -0.37 -0.39 -2.23 0.00 0.00 178.31 176.17 1v1g h VAL 162 N 0.80 0.80 -0.39 1.41 -1.51 -1.32 -1.19 116.25 114.86 1v1g h VAL 162 Ca 0.18 -1.61 -0.01 0.00 -1.23 0.00 0.00 66.70 64.02 1v1g h VAL 162 Cb 0.34 2.02 -0.02 0.00 -2.13 0.00 0.00 31.29 31.50 1v1g h VAL 162 CO 0.00 0.37 0.19 -0.61 -1.23 0.00 0.00 177.57 176.29 1v1g h GLN 163 N 0.00 0.55 0.04 5.19 5.75 -1.07 -3.29 115.11 122.29 1v1g h GLN 163 Ca -0.00 -0.08 -0.25 0.00 -0.15 0.00 0.00 58.65 58.17 1v1g h GLN 163 Cb 0.99 -0.10 0.01 0.00 1.07 0.00 0.00 27.48 29.45 1v1g h GLN 163 CO 0.05 0.48 -1.05 0.00 -2.65 0.00 0.00 178.83 175.66 1v1g h ALA 164 N 1.04 0.25 -0.03 3.38 0.00 -0.91 -3.37 119.26 119.63 1v1g h ALA 164 Ca 0.13 -0.75 -0.68 0.00 0.00 0.00 0.00 54.91 53.61 1v1g h ALA 164 Cb 0.11 0.01 0.02 0.00 0.00 0.00 0.00 17.79 17.92 1v1g h ALA 164 CO -0.02 0.82 3.73 -3.47 0.00 0.00 0.00 179.25 180.31 1v1g n ASP 165 N -3.71 8.19 0.03 0.00 2.03 -0.46 -4.73 116.55 117.89 1v1g n ASP 165 Ca -0.08 -2.62 -0.03 0.00 0.52 0.00 0.00 54.79 52.58 1v1g n ASP 165 Cb 0.89 -1.56 -0.02 0.00 -0.72 0.00 0.00 41.12 39.71 1v1g n ASP 165 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1v1g h ARG 166 N 5.10 -0.14 -6.00 -0.67 2.47 -1.79 -3.27 114.38 110.09 1v1g h ARG 166 Ca 0.84 0.01 -0.51 0.00 -1.26 0.00 0.00 59.98 59.05 1v1g h ARG 166 Cb 0.32 0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 28.65 1v1g h ARG 166 CO 1.79 -0.09 1.38 -1.59 0.56 0.00 0.00 179.97 182.01 1v1g s LYS 167 N -3.46 2.72 -0.59 0.04 -2.85 -1.26 -4.83 119.74 109.52 1v1g s LYS 167 Ca -0.03 0.94 -0.27 0.00 -1.00 0.00 0.00 55.97 55.62 1v1g s LYS 167 Cb 0.01 -4.37 -0.03 0.00 -2.06 0.00 0.00 37.83 31.38 1v1g s LYS 167 CO 0.10 -2.60 1.92 1.21 0.10 0.00 0.00 175.35 176.08 1v1g s ASN 168 N 8.23 5.20 0.00 0.03 3.84 -1.23 -4.63 114.94 126.37 1v1g s ASN 168 Ca 0.75 0.46 0.00 0.00 0.21 0.00 0.00 52.86 54.28 1v1g s ASN 168 Cb -0.16 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.02 1v1g s ASN 168 CO 0.25 -2.41 0.71 -0.90 -2.79 0.00 0.00 177.10 171.96 1v1g n ASP 169 N 13.01 -0.52 -0.03 -4.21 5.75 -1.26 -5.05 116.55 124.23 1v1g n ASP 169 Ca 0.22 -1.43 -0.00 0.00 -0.01 0.00 0.00 54.79 53.57 1v1g n ASP 169 Cb 0.52 0.16 -0.00 0.00 -1.03 0.00 0.00 41.12 40.77 1v1g n ASP 169 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1v1g n GLY 170 N 0.00 0.39 3.49 6.12 0.00 -1.26 -4.98 105.19 108.95 1v1g n GLY 170 Ca -0.15 -0.05 -0.15 0.00 0.00 0.00 0.00 46.02 45.67 1v1g n GLY 170 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v1g s LYS 171 N -0.72 0.80 -0.24 1.61 0.00 -1.26 -4.44 119.74 115.49 1v1g s LYS 171 Ca 0.00 0.61 -0.12 0.00 0.00 0.00 0.00 55.97 56.46 1v1g s LYS 171 Cb 0.00 0.38 -0.05 0.00 0.00 0.00 0.00 37.83 38.17 1v1g s LYS 171 CO 0.00 -0.16 0.25 0.42 0.00 0.00 0.00 175.35 175.86 1v1g s ILE 172 N -0.21 5.30 0.59 3.79 1.01 0.12 -4.87 121.20 126.93 1v1g s ILE 172 Ca -0.04 0.35 0.05 0.00 0.00 0.00 0.00 60.65 61.02 1v1g s ILE 172 Cb -0.03 -3.58 0.08 0.00 0.01 0.00 0.00 42.46 38.94 1v1g s ILE 172 CO 0.03 0.29 0.82 1.51 0.00 0.00 0.00 174.94 177.60 1v1g s ASP 173 N 1.18 4.97 0.44 3.58 1.47 -1.26 0.36 116.67 127.40 1v1g s ASP 173 Ca 0.11 -0.53 0.18 0.00 1.18 0.00 0.00 52.55 53.49 1v1g s ASP 173 Cb -0.14 -0.08 1.02 0.00 -0.34 0.00 0.00 42.92 43.38 1v1g s ASP 173 CO 0.07 -1.40 1.94 -0.29 0.68 0.00 0.00 175.17 176.17 1v1g h ILE 174 N 0.01 0.98 -0.12 2.11 2.10 -1.99 -0.79 117.51 119.81 1v1g h ILE 174 Ca -0.35 -0.88 -0.05 0.00 1.08 0.00 0.00 64.86 64.66 1v1g h ILE 174 Cb 1.28 1.50 -0.00 0.00 -1.09 0.00 0.00 36.82 38.51 1v1g h ILE 174 CO 0.42 0.23 -0.13 0.44 -1.08 0.00 0.00 178.15 178.04 1v1g h ASP 175 N 0.00 0.33 -0.08 2.19 5.19 -1.99 -1.60 116.42 120.46 1v1g h ASP 175 Ca -0.00 -0.49 -0.09 0.00 -0.62 0.00 0.00 57.03 55.83 1v1g h ASP 175 Cb 0.48 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 39.89 1v1g h ASP 175 CO 0.03 0.75 -0.22 -0.33 -3.12 0.00 0.00 179.24 176.35 1v1g h GLU 176 N -0.09 0.49 0.13 3.56 5.08 -1.81 -0.90 114.58 121.04 1v1g h GLU 176 Ca 0.02 -0.17 0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1v1g h GLU 176 Cb 0.66 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 1v1g h GLU 176 CO 0.03 0.68 -0.25 2.35 -1.00 0.00 0.00 179.01 180.83 1v1g h TRP 177 N 0.44 -0.66 -0.97 4.33 2.91 -1.14 0.42 115.95 121.27 1v1g h TRP 177 Ca 0.07 0.01 0.17 0.00 1.13 0.00 0.00 58.89 60.27 1v1g h TRP 177 Cb 0.63 0.27 -0.10 0.00 -0.51 0.00 0.00 29.16 29.45 1v1g h TRP 177 CO 0.02 -0.35 0.58 0.87 -1.03 0.00 0.00 178.44 178.53 1v1g h LYS 178 N -0.46 0.74 -0.45 2.65 1.57 -0.99 0.53 116.57 120.16 1v1g h LYS 178 Ca 0.03 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.68 1v1g h LYS 178 Cb 0.48 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 1v1g h LYS 178 CO -0.13 0.49 -0.05 -0.44 -0.57 0.00 0.00 179.45 178.75 1v1g h ASP 179 N 0.76 0.82 -0.26 0.86 5.19 -0.73 -2.65 116.42 120.41 1v1g h ASP 179 Ca 0.55 -0.33 -0.03 0.00 -0.62 0.00 0.00 57.03 56.60 1v1g h ASP 179 Cb 0.80 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 40.08 1v1g h ASP 179 CO -0.37 0.96 0.05 0.15 -3.12 0.00 0.00 179.24 176.91 1v1g h PHE 180 N 0.66 0.44 0.00 4.55 3.57 0.23 -2.62 116.94 123.77 1v1g h PHE 180 Ca 0.12 -0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.51 1v1g h PHE 180 Cb 0.57 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 1v1g h PHE 180 CO 0.04 0.52 -0.24 0.28 -2.23 0.00 0.00 178.31 176.68 1v1g h VAL 181 N 0.24 1.02 0.00 1.41 2.07 -0.12 -0.64 116.25 120.22 1v1g h VAL 181 Ca 0.08 -0.87 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 1v1g h VAL 181 Cb 0.31 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1v1g h VAL 181 CO 0.00 0.24 -0.15 0.77 0.02 0.00 0.00 177.57 178.45 1v1g h SER 182 N 0.00 0.00 0.44 0.57 4.64 -1.09 -0.49 113.55 117.62 1v1g h SER 182 Ca -0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1v1g h SER 182 Cb 0.47 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 1v1g h SER 182 CO 0.03 0.15 -1.62 0.18 -0.87 0.00 0.00 176.83 174.70 1v1g n LEU 183 N -3.42 0.43 -2.91 5.97 4.32 -0.95 -4.50 117.00 115.94 1v1g n LEU 183 Ca -0.01 0.17 -0.23 0.00 -0.02 0.00 0.00 56.01 55.93 1v1g n LEU 183 Cb 0.33 0.05 -0.03 0.00 -1.62 0.00 0.00 43.42 42.16 1v1g n LEU 183 CO 0.31 0.02 0.03 0.59 -1.22 0.00 0.00 177.39 177.12 1v1g n ASN 184 N -2.56 3.31 0.00 -1.43 3.02 -0.29 -4.95 115.26 112.36 1v1g n ASN 184 Ca -0.07 -3.43 0.00 0.00 -0.03 0.00 0.00 54.58 51.05 1v1g n ASN 184 Cb 0.68 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 1v1g n ASN 184 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1v1g n PRO 185 N -0.13 0.00 0.00 3.52 -0.04 -0.27 -1.49 135.00 136.59 1v1g n PRO 185 Ca 0.29 0.34 0.13 0.00 -0.04 0.00 0.00 63.50 64.22 1v1g n PRO 185 Cb 0.54 -1.52 0.42 0.00 -0.04 0.00 0.00 33.50 32.90 1v1g n PRO 185 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1v1g n SER 186 N -1.33 0.28 0.29 3.54 3.41 -1.26 -3.34 113.62 115.21 1v1g n SER 186 Ca 0.00 0.12 0.18 0.00 -0.26 0.00 0.00 58.87 58.91 1v1g n SER 186 Cb 0.02 -0.12 0.79 0.00 -0.26 0.00 0.00 64.21 64.65 1v1g n SER 186 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1v1g h LEU 187 N 0.00 0.00 -3.21 1.04 3.38 -1.61 -2.45 115.31 112.45 1v1g h LEU 187 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1v1g h LEU 187 Cb 0.51 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 1v1g h LEU 187 CO 0.00 0.03 -0.07 2.30 0.09 0.00 0.00 178.44 180.79 1v1g n ILE 188 N -3.17 2.29 0.31 1.22 -5.35 -1.21 -4.72 119.36 108.72 1v1g n ILE 188 Ca -0.01 -2.37 -0.18 0.00 -0.27 0.00 0.00 62.75 59.93 1v1g n ILE 188 Cb 0.26 -0.27 -0.09 0.00 -1.74 0.00 0.00 39.64 37.79 1v1g n ILE 188 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1v1g h LYS 189 N 1.09 -0.92 0.00 6.28 1.63 -1.55 -2.06 116.57 121.04 1v1g h LYS 189 Ca 0.07 0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.94 1v1g h LYS 189 Cb 1.39 0.21 0.00 0.00 -0.60 0.00 0.00 32.23 33.23 1v1g h LYS 189 CO 0.21 -0.61 0.00 0.09 -3.45 0.00 0.00 179.45 175.69 1v1g n ASN 190 N -5.54 0.00 -0.18 4.20 3.02 -1.26 -2.79 115.26 112.71 1v1g n ASN 190 Ca -0.12 -0.42 0.13 0.00 -0.03 0.00 0.00 54.58 54.14 1v1g n ASN 190 Cb 0.43 0.00 0.65 0.00 -0.61 0.00 0.00 39.78 40.25 1v1g n ASN 190 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1v1g n MET 191 N -0.77 1.24 -4.21 3.52 2.81 -0.77 -4.68 117.12 114.25 1v1g n MET 191 Ca 0.04 -0.36 -0.19 0.00 -1.81 0.00 0.00 57.70 55.38 1v1g n MET 191 Cb 0.02 -1.41 -0.16 0.00 -0.71 0.00 0.00 33.22 30.96 1v1g n MET 191 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 1v1g s THR 192 N -1.96 0.56 -0.28 2.03 -1.32 -1.12 -4.11 115.64 109.44 1v1g s THR 192 Ca 0.37 -0.19 0.01 0.00 -1.21 0.00 0.00 61.69 60.67 1v1g s THR 192 Cb 0.18 -0.55 0.05 0.00 -1.51 0.00 0.00 72.50 70.68 1v1g s THR 192 CO 0.29 0.21 -0.06 -0.76 -2.21 0.00 0.00 174.62 172.09 1v1g s LEU 193 N 0.57 3.64 0.11 9.08 1.43 -0.26 -5.01 118.68 128.24 1v1g s LEU 193 Ca -0.08 -1.32 0.25 0.00 -1.03 0.00 0.00 54.13 51.95 1v1g s LEU 193 Cb -0.11 -1.63 0.95 0.00 0.03 0.00 0.00 46.19 45.43 1v1g s LEU 193 CO 0.00 -0.22 1.76 -2.65 0.23 0.00 0.00 176.35 175.48 1v1g n PRO 194 N 4.53 0.12 0.09 1.29 -0.02 -1.26 -2.71 135.00 137.04 1v1g n PRO 194 Ca -0.14 0.19 -0.02 0.00 -2.02 0.00 0.00 63.50 61.51 1v1g n PRO 194 Cb 0.43 -1.66 0.23 0.00 -0.02 0.00 0.00 33.50 32.48 1v1g n PRO 194 CO 0.00 0.00 0.00 0.10 1.98 0.00 0.00 175.50 177.58 1v1g h TYR 195 N 0.00 0.28 0.00 6.00 -0.00 -1.95 -2.88 116.97 118.42 1v1g h TYR 195 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 58.73 58.66 1v1g h TYR 195 Cb 0.51 -0.06 0.00 0.00 0.00 0.00 0.00 36.73 37.18 1v1g h TYR 195 CO 0.00 0.60 0.22 1.28 -0.00 0.00 0.00 178.16 180.26 1v1g n LEU 196 N -4.04 0.00 -0.04 0.10 4.77 -1.10 -3.03 117.00 113.66 1v1g n LEU 196 Ca -0.01 0.25 -0.14 0.00 -0.03 0.00 0.00 56.01 56.08 1v1g n LEU 196 Cb 0.46 -0.25 -0.11 0.00 -2.33 0.00 0.00 43.42 41.19 1v1g n LEU 196 CO 0.42 -0.25 0.50 0.50 -1.33 0.00 0.00 177.39 177.22 1v1g h LYS 197 N 0.00 0.04 -4.51 3.23 3.64 -1.74 -3.41 116.57 113.82 1v1g h LYS 197 Ca 0.00 -0.04 -0.55 0.00 -1.27 0.00 0.00 60.65 58.80 1v1g h LYS 197 Cb 0.43 0.01 -0.35 0.00 -0.41 0.00 0.00 32.23 31.91 1v1g h LYS 197 CO 0.00 0.77 -0.82 0.16 -2.27 0.00 0.00 179.45 177.29 1v1g s ASP 198 N -6.02 2.16 0.72 4.20 1.47 -1.17 -5.11 116.67 112.92 1v1g s ASP 198 Ca -0.17 -0.35 -0.11 0.00 1.18 0.00 0.00 52.55 53.09 1v1g s ASP 198 Cb -0.00 -0.93 0.02 0.00 -0.34 0.00 0.00 42.92 41.67 1v1g s ASP 198 CO 0.69 -0.03 1.09 0.27 0.68 0.00 0.00 175.17 177.88 1v1g s ILE 199 N 1.15 3.46 -0.33 2.11 -4.36 -1.24 -4.92 121.20 117.07 1v1g s ILE 199 Ca -0.05 0.47 0.00 0.00 -0.26 0.00 0.00 60.65 60.82 1v1g s ILE 199 Cb -0.14 -3.41 0.08 0.00 1.25 0.00 0.00 42.46 40.24 1v1g s ILE 199 CO -0.03 -0.62 0.05 0.54 0.24 0.00 0.00 174.94 175.12 1v1g s ASN 200 N -4.25 4.88 0.15 4.36 2.20 -1.26 -5.09 114.94 115.93 1v1g s ASN 200 Ca 0.59 -1.73 -0.34 0.00 -0.94 0.00 0.00 52.86 50.43 1v1g s ASN 200 Cb -0.12 -1.69 -0.15 0.00 -2.00 0.00 0.00 41.25 37.29 1v1g s ASN 200 CO 0.52 -0.35 1.40 -1.14 -2.94 0.00 0.00 177.10 174.59 1v1g n ARG 201 N 4.48 1.60 0.00 3.55 3.00 -1.26 -5.22 116.66 122.81 1v1g n ARG 201 Ca -0.06 0.58 0.00 0.00 -0.00 0.00 0.00 57.85 58.37 1v1g n ARG 201 Cb 0.42 -2.24 0.00 0.00 0.00 0.00 0.00 32.46 30.64 1v1g n ARG 201 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26