#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ttv s HIS 14 N 0.00 1.65 0.19 3.10 -3.43 -1.26 -4.90 115.29 110.64 1ttv s HIS 14 Ca 0.00 0.85 -0.01 0.00 -0.80 0.00 0.00 55.06 55.11 1ttv s HIS 14 Cb 0.00 -3.98 -0.04 0.00 -1.43 0.00 0.00 32.58 27.12 1ttv s HIS 14 CO 0.00 -1.99 0.12 0.96 -2.00 0.00 0.00 174.74 171.82 1ttv s ILE 15 N 10.22 0.05 -0.30 -5.38 -4.36 -1.26 -5.06 121.20 115.11 1ttv s ILE 15 Ca 0.72 -1.99 -0.12 0.00 -0.26 0.00 0.00 60.65 59.01 1ttv s ILE 15 Cb -0.10 -2.43 0.12 0.00 1.25 0.00 0.00 42.46 41.31 1ttv s ILE 15 CO 0.10 -0.08 0.69 -0.94 0.24 0.00 0.00 174.94 174.94 1ttv s SER 16 N -3.15 -1.06 0.00 4.36 1.04 -1.26 -5.02 113.70 108.61 1ttv s SER 16 Ca 0.36 1.50 0.00 0.00 0.48 0.00 0.00 55.95 58.29 1ttv s SER 16 Cb 0.07 2.07 0.00 0.00 0.10 0.00 0.00 66.02 68.26 1ttv s SER 16 CO 0.10 -0.21 0.00 0.41 0.98 0.00 0.00 173.24 174.52 1ttv n THR 17 N 5.17 0.00 -4.26 2.02 -1.04 -1.26 -4.68 114.28 110.23 1ttv n THR 17 Ca -0.13 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.63 1ttv n THR 17 Cb 0.51 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.95 1ttv n THR 17 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1ttv s SER 18 N -1.44 4.65 -0.12 8.00 0.01 -1.26 -5.13 113.70 118.42 1ttv s SER 18 Ca 0.00 -0.54 0.02 0.00 1.31 0.00 0.00 55.95 56.73 1ttv s SER 18 Cb 0.00 -0.92 -0.01 0.00 0.21 0.00 0.00 66.02 65.30 1ttv s SER 18 CO 0.00 0.03 -0.18 1.51 0.41 0.00 0.00 173.24 175.01 1ttv s ASP 19 N -3.42 3.61 0.64 2.44 -4.77 -1.26 -4.94 116.67 108.96 1ttv s ASP 19 Ca 0.30 -0.43 -0.12 0.00 -3.30 0.00 0.00 52.55 49.00 1ttv s ASP 19 Cb -0.07 -1.52 -0.02 0.00 -1.09 0.00 0.00 42.92 40.21 1ttv s ASP 19 CO 0.20 0.16 1.04 -1.10 0.70 0.00 0.00 175.17 176.16 1ttv s GLN 20 N 0.38 3.32 0.40 2.11 1.11 -1.26 -5.09 119.66 120.63 1ttv s GLN 20 Ca -0.14 0.90 0.03 0.00 0.01 0.00 0.00 55.36 56.17 1ttv s GLN 20 Cb -0.17 -2.04 -0.04 0.00 -1.01 0.00 0.00 33.01 29.75 1ttv s GLN 20 CO 0.07 -0.79 0.09 -1.21 0.01 0.00 0.00 175.29 173.45 1ttv s GLU 21 N -4.90 1.88 0.16 2.91 2.02 -1.26 -5.10 118.70 114.41 1ttv s GLU 21 Ca 0.58 -2.12 -0.34 0.00 0.02 0.00 0.00 54.97 53.10 1ttv s GLU 21 Cb -0.13 -0.85 -0.14 0.00 0.10 0.00 0.00 34.13 33.12 1ttv s GLU 21 CO 0.51 -0.36 1.52 0.36 0.02 0.00 0.00 175.26 177.31 1ttv n LYS 22 N -0.89 2.01 -4.06 1.61 -0.00 -1.26 -4.94 118.16 110.63 1ttv n LYS 22 Ca -0.07 0.72 -0.33 0.00 -0.00 0.00 0.00 58.31 58.64 1ttv n LYS 22 Cb 0.66 -2.46 -0.07 0.00 -0.00 0.00 0.00 35.03 33.16 1ttv n LYS 22 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1ttv s LEU 23 N 0.75 3.99 0.27 -5.58 1.43 -1.26 -4.18 118.68 114.10 1ttv s LEU 23 Ca 0.78 0.19 0.09 0.00 -1.03 0.00 0.00 54.13 54.16 1ttv s LEU 23 Cb -0.71 -2.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.14 1ttv s LEU 23 CO 0.40 0.27 0.06 0.68 0.23 0.00 0.00 176.35 178.00 1ttv s VAL 24 N -1.21 3.69 -0.40 -1.59 -7.23 0.20 -2.60 120.40 111.26 1ttv s VAL 24 Ca 0.23 -1.76 0.03 0.00 -1.81 0.00 0.00 61.98 58.68 1ttv s VAL 24 Cb -0.12 -3.01 0.12 0.00 0.56 0.00 0.00 36.38 33.93 1ttv s VAL 24 CO 0.14 -0.35 0.15 -1.58 -0.31 0.00 0.00 175.10 173.15 1ttv s GLN 25 N -3.73 1.42 1.09 4.82 2.00 0.68 -0.55 119.66 125.39 1ttv s GLN 25 Ca 0.32 -1.95 -0.17 0.00 -2.00 0.00 0.00 55.36 51.57 1ttv s GLN 25 Cb -0.07 -2.82 0.11 0.00 0.80 0.00 0.00 33.01 31.04 1ttv s GLN 25 CO 0.22 -1.04 0.19 -2.30 -0.50 0.00 0.00 175.29 171.85 1ttv n PRO 26 N 3.92 -1.44 -1.81 1.67 -0.02 -1.26 -0.64 135.00 135.41 1ttv n PRO 26 Ca 0.04 -0.40 -0.31 0.00 -2.02 0.00 0.00 63.50 60.82 1ttv n PRO 26 Cb 0.38 -1.78 0.02 0.00 -0.02 0.00 0.00 33.50 32.10 1ttv n PRO 26 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1ttv s THR 27 N -2.29 4.41 0.37 3.45 -4.23 -0.71 -4.34 115.64 112.30 1ttv s THR 27 Ca 0.57 0.78 0.16 0.00 -1.18 0.00 0.00 61.69 62.03 1ttv s THR 27 Cb -0.15 -3.73 0.37 0.00 1.34 0.00 0.00 72.50 70.33 1ttv s THR 27 CO 0.66 -1.02 1.74 1.55 -0.54 0.00 0.00 174.62 177.01 1ttv h PRO 28 N -0.45 0.41 0.44 3.99 0.13 -1.93 0.54 132.00 135.13 1ttv h PRO 28 Ca -0.44 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 1ttv h PRO 28 Cb 1.20 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1ttv h PRO 28 CO 0.61 0.27 -0.21 1.25 -0.23 0.00 0.00 178.00 179.70 1ttv h LEU 29 N 0.43 -0.50 -0.99 1.56 5.85 -1.98 -3.09 115.31 116.59 1ttv h LEU 29 Ca 0.64 -0.08 0.12 0.00 0.84 0.00 0.00 57.88 59.40 1ttv h LEU 29 Cb 1.51 0.13 -0.09 0.00 0.37 0.00 0.00 40.66 42.59 1ttv h LEU 29 CO -0.39 -0.08 0.61 0.25 -0.34 0.00 0.00 178.44 178.49 1ttv h LEU 30 N -1.04 0.89 -0.35 2.25 5.85 -1.67 -2.64 115.31 118.61 1ttv h LEU 30 Ca -0.06 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.75 1ttv h LEU 30 Cb 0.55 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.39 1ttv h LEU 30 CO 0.10 0.47 -0.43 -0.07 -0.34 0.00 0.00 178.44 178.16 1ttv h LEU 31 N 0.96 -1.46 -0.96 2.25 3.38 0.05 0.00 115.31 119.54 1ttv h LEU 31 Ca 0.49 0.19 0.21 0.00 0.09 0.00 0.00 57.88 58.86 1ttv h LEU 31 Cb 0.50 0.60 -0.11 0.00 0.09 0.00 0.00 40.66 41.74 1ttv h LEU 31 CO -0.27 -0.30 0.53 0.28 0.09 0.00 0.00 178.44 178.77 1ttv h SER 32 N -0.29 0.61 -0.57 -0.43 0.02 -1.39 0.88 113.55 112.39 1ttv h SER 32 Ca 0.06 0.12 0.10 0.00 -0.84 0.00 0.00 61.79 61.24 1ttv h SER 32 Cb 0.45 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.98 1ttv h SER 32 CO -0.48 0.15 0.38 -0.07 -1.14 0.00 0.00 176.83 175.68 1ttv h LEU 33 N 0.60 0.29 -0.25 5.07 3.38 -0.93 0.44 115.31 123.92 1ttv h LEU 33 Ca 0.58 0.01 -0.20 0.00 0.09 0.00 0.00 57.88 58.36 1ttv h LEU 33 Cb 1.01 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1ttv h LEU 33 CO -0.44 0.17 -0.90 -0.07 0.09 0.00 0.00 178.44 177.29 1ttv h LEU 34 N 0.32 0.17 -1.46 1.67 3.38 0.14 -1.90 115.31 117.64 1ttv h LEU 34 Ca 0.26 -0.14 0.06 0.00 0.09 0.00 0.00 57.88 58.16 1ttv h LEU 34 Cb 0.61 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 1ttv h LEU 34 CO -0.06 0.98 0.44 0.11 0.09 0.00 0.00 178.44 179.99 1ttv h LYS 35 N 0.06 0.64 0.00 1.13 6.56 0.17 0.51 116.57 125.65 1ttv h LYS 35 Ca -0.04 -0.04 -0.08 0.00 -1.06 0.00 0.00 60.65 59.43 1ttv h LYS 35 Cb 1.55 -0.14 -0.01 0.00 -0.57 0.00 0.00 32.23 33.05 1ttv h LYS 35 CO 0.13 0.43 -1.37 0.45 -2.06 0.00 0.00 179.45 177.03 1ttv n SER 36 N -4.48 0.69 0.00 0.86 2.88 -0.76 -3.89 113.62 108.92 1ttv n SER 36 Ca 0.10 0.28 0.15 0.00 -1.33 0.00 0.00 58.87 58.07 1ttv n SER 36 Cb 0.23 0.59 0.89 0.00 -0.75 0.00 0.00 64.21 65.18 1ttv n SER 36 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ttv n ALA 37 N -2.30 2.62 0.00 -1.46 0.00 -0.58 -4.83 120.51 113.96 1ttv n ALA 37 Ca -0.06 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1ttv n ALA 37 Cb 0.69 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1ttv n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ttv n GLY 38 N 0.92 1.22 3.63 0.00 0.00 -0.79 -4.79 105.19 105.37 1ttv n GLY 38 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 1ttv n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ttv s ALA 39 N -2.00 3.11 0.00 4.61 0.00 0.17 -5.00 121.76 122.64 1ttv s ALA 39 Ca 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 50.86 1ttv s ALA 39 Cb 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 23.12 22.02 1ttv s ALA 39 CO 0.00 0.65 0.00 1.04 0.00 0.00 0.00 175.76 177.45 1ttv n GLN 40 N 1.01 0.00 -1.30 0.00 3.00 -1.26 -4.41 117.38 114.42 1ttv n GLN 40 Ca -0.13 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.55 1ttv n GLN 40 Cb 0.52 -0.49 0.24 0.00 0.00 0.00 0.00 30.24 30.52 1ttv n GLN 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.06 175.47 1ttv s LYS 41 N -1.99 -1.13 -0.17 -1.09 0.00 -1.26 -5.01 119.74 109.09 1ttv s LYS 41 Ca 0.00 -0.31 0.19 0.00 0.00 0.00 0.00 55.97 55.85 1ttv s LYS 41 Cb 0.00 -1.63 -0.26 0.00 0.00 0.00 0.00 37.83 35.94 1ttv s LYS 41 CO 0.00 -3.61 0.15 0.39 0.00 0.00 0.00 175.35 172.29 1ttv n GLU 42 N -4.64 0.68 -4.16 1.78 4.71 -1.26 -4.96 120.64 112.80 1ttv n GLU 42 Ca 0.16 -0.03 -0.30 0.00 -0.01 0.00 0.00 57.16 56.98 1ttv n GLU 42 Cb 0.60 -1.53 -0.08 0.00 -1.01 0.00 0.00 31.44 29.42 1ttv n GLU 42 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 1ttv s THR 43 N -2.66 3.91 -0.01 2.62 2.01 -1.26 -4.42 115.64 115.83 1ttv s THR 43 Ca -0.10 -1.01 -0.15 0.00 0.31 0.00 0.00 61.69 60.74 1ttv s THR 43 Cb 0.07 -2.85 0.02 0.00 0.01 0.00 0.00 72.50 69.76 1ttv s THR 43 CO 0.84 0.13 0.31 -0.36 -0.69 0.00 0.00 174.62 174.86 1ttv s PHE 44 N -1.28 -0.18 0.49 4.92 0.40 0.29 -4.96 117.98 117.65 1ttv s PHE 44 Ca 0.25 0.25 -0.19 0.00 -0.60 0.00 0.00 56.93 56.64 1ttv s PHE 44 Cb -0.12 0.10 -0.09 0.00 0.51 0.00 0.00 43.02 43.43 1ttv s PHE 44 CO 0.17 -0.40 1.00 0.95 0.70 0.00 0.00 175.22 177.63 1ttv s THR 45 N -1.42 4.19 0.55 0.64 -4.23 -1.26 0.59 115.64 114.69 1ttv s THR 45 Ca -0.13 1.24 0.46 0.00 -1.18 0.00 0.00 61.69 62.09 1ttv s THR 45 Cb -0.05 -3.56 0.69 0.00 1.34 0.00 0.00 72.50 70.92 1ttv s THR 45 CO 0.04 -0.41 1.63 -0.03 -0.54 0.00 0.00 174.62 175.31 1ttv h MET 46 N 1.40 0.00 0.34 3.99 4.05 -1.93 0.39 114.93 123.18 1ttv h MET 46 Ca -0.48 -0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 58.92 1ttv h MET 46 Cb 1.20 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.00 1ttv h MET 46 CO 0.60 0.00 -0.16 0.87 0.23 0.00 0.00 176.91 178.45 1ttv h LYS 47 N 0.00 -0.44 -0.64 0.39 6.56 -1.92 -2.11 116.57 118.41 1ttv h LYS 47 Ca 0.84 0.03 0.03 0.00 -1.06 0.00 0.00 60.65 60.50 1ttv h LYS 47 Cb 3.36 0.10 -0.04 0.00 -0.57 0.00 0.00 32.23 35.08 1ttv h LYS 47 CO -0.03 -0.24 0.40 0.93 -2.06 0.00 0.00 179.45 178.44 1ttv h GLU 48 N -1.10 0.75 0.10 3.15 5.08 -1.24 0.57 114.58 121.90 1ttv h GLU 48 Ca -0.05 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1ttv h GLU 48 Cb 0.40 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1ttv h GLU 48 CO 0.08 0.50 -0.12 0.28 -1.00 0.00 0.00 179.01 178.75 1ttv h VAL 49 N 0.77 0.00 -0.10 3.13 2.07 -0.44 -0.40 116.25 121.28 1ttv h VAL 49 Ca 0.26 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.81 1ttv h VAL 49 Cb 0.03 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.80 1ttv h VAL 49 CO -0.11 0.00 0.28 0.25 0.02 0.00 0.00 177.57 178.01 1ttv h LEU 50 N -0.23 0.00 0.14 2.57 6.46 -1.31 -2.17 115.31 120.77 1ttv h LEU 50 Ca -0.01 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.74 1ttv h LEU 50 Cb 0.20 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.13 1ttv h LEU 50 CO -0.02 0.00 -0.07 0.22 -0.62 0.00 0.00 178.44 177.95 1ttv h TYR 51 N 0.00 -0.17 -0.89 1.25 3.20 0.14 -3.26 116.97 117.24 1ttv h TYR 51 Ca 0.05 -0.00 0.17 0.00 3.14 0.00 0.00 58.73 62.09 1ttv h TYR 51 Cb 0.61 0.06 -0.07 0.00 1.54 0.00 0.00 36.73 38.87 1ttv h TYR 51 CO 0.00 0.29 0.58 0.45 -1.64 0.00 0.00 178.16 177.84 1ttv h HIS 52 N -0.82 0.70 -0.23 -3.82 -0.00 -0.44 -1.22 115.15 109.33 1ttv h HIS 52 Ca -0.02 0.02 0.06 0.00 -0.00 0.00 0.00 60.37 60.43 1ttv h HIS 52 Cb 0.54 -0.22 -0.06 0.00 -0.00 0.00 0.00 27.41 27.68 1ttv h HIS 52 CO 0.09 0.22 -0.15 -0.07 -0.00 0.00 0.00 177.93 178.02 1ttv h LEU 53 N 0.56 -0.50 -1.50 2.43 -0.00 -1.58 1.24 115.31 115.97 1ttv h LEU 53 Ca 0.46 0.11 0.18 0.00 -0.00 0.00 0.00 57.88 58.63 1ttv h LEU 53 Cb 0.93 0.26 -0.06 0.00 -0.00 0.00 0.00 40.66 41.78 1ttv h LEU 53 CO -0.20 -0.19 0.57 1.23 -0.00 0.00 0.00 178.44 179.84 1ttv h GLY 54 N -0.14 0.87 1.81 0.83 0.00 -1.27 0.51 103.07 105.67 1ttv h GLY 54 Ca 0.13 -0.20 -0.19 0.00 0.00 0.00 0.00 47.33 47.07 1ttv h GLY 54 CO -0.32 0.02 -0.98 1.46 0.00 0.00 0.00 176.54 176.73 1ttv h GLN 55 N 0.44 0.00 0.07 4.80 4.20 -0.75 -3.06 115.11 120.82 1ttv h GLN 55 Ca 0.44 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.15 1ttv h GLN 55 Cb 1.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.81 1ttv h GLN 55 CO -0.17 0.76 -0.03 -0.92 -0.67 0.00 0.00 178.83 177.80 1ttv h TYR 56 N 0.00 -0.09 -0.05 2.96 3.20 0.54 -1.34 116.97 122.19 1ttv h TYR 56 Ca -0.05 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.83 1ttv h TYR 56 Cb 1.68 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 39.96 1ttv h TYR 56 CO 0.00 0.43 -0.05 0.82 -1.64 0.00 0.00 178.16 177.72 1ttv h ILE 57 N -0.67 0.85 -0.91 1.81 2.04 -0.33 0.60 117.51 120.91 1ttv h ILE 57 Ca -0.01 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 1ttv h ILE 57 Cb 0.55 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 1ttv h ILE 57 CO 0.02 0.00 0.55 0.00 0.00 0.00 0.00 178.15 178.71 1ttv h MET 58 N -0.07 1.23 0.55 2.37 -0.00 -1.62 0.64 114.93 118.03 1ttv h MET 58 Ca 0.04 -0.11 -0.03 0.00 -0.00 0.00 0.00 59.70 59.60 1ttv h MET 58 Cb 0.12 -0.26 0.01 0.00 -0.00 0.00 0.00 31.60 31.47 1ttv h MET 58 CO -0.09 0.86 -0.26 0.00 -0.00 0.00 0.00 176.91 177.41 1ttv h ALA 59 N 1.30 -0.74 0.00 -3.00 0.00 -0.75 -3.04 119.26 113.04 1ttv h ALA 59 Ca 0.33 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ttv h ALA 59 Cb -0.06 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ttv h ALA 59 CO -0.06 -0.73 -0.02 0.87 0.00 0.00 0.00 179.25 179.31 1ttv h LYS 60 N -1.12 0.00 -4.49 0.00 6.56 0.26 -3.47 116.57 114.32 1ttv h LYS 60 Ca -0.08 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.48 1ttv h LYS 60 Cb 0.62 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 32.31 1ttv h LYS 60 CO 0.12 0.02 -0.13 0.94 -2.06 0.00 0.00 179.45 178.34 1ttv n GLN 61 N -3.67 -0.96 0.00 3.15 -0.06 0.22 -4.98 117.38 111.08 1ttv n GLN 61 Ca -0.03 0.98 0.07 0.00 -2.00 0.00 0.00 57.00 56.02 1ttv n GLN 61 Cb 0.11 -4.17 -0.00 0.00 -4.06 0.00 0.00 30.24 22.12 1ttv n GLN 61 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 1ttv n LEU 62 N -1.75 1.50 -4.87 1.69 4.77 -0.94 -5.00 117.00 112.40 1ttv n LEU 62 Ca -0.01 -0.77 -0.31 0.00 -0.03 0.00 0.00 56.01 54.89 1ttv n LEU 62 Cb 0.52 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.62 1ttv n LEU 62 CO 0.34 0.29 0.72 -0.72 -1.33 0.00 0.00 177.39 176.69 1ttv s TYR 63 N -1.71 3.59 0.15 -1.77 -0.85 -1.26 -2.49 117.35 113.01 1ttv s TYR 63 Ca 0.12 1.27 -0.14 0.00 -0.52 0.00 0.00 57.07 57.79 1ttv s TYR 63 Cb 0.11 -2.76 -0.07 0.00 0.38 0.00 0.00 41.96 39.63 1ttv s TYR 63 CO 0.35 -0.75 0.56 0.34 -1.52 0.00 0.00 175.55 174.53 1ttv s ASP 64 N -4.19 6.83 0.06 -0.18 -1.08 -0.17 -4.89 116.67 113.06 1ttv s ASP 64 Ca 0.55 1.10 -0.36 0.00 -0.52 0.00 0.00 52.55 53.32 1ttv s ASP 64 Cb -0.11 -2.30 -0.20 0.00 -1.46 0.00 0.00 42.92 38.86 1ttv s ASP 64 CO 0.54 0.09 1.52 -0.33 0.52 0.00 0.00 175.17 177.52 1ttv h GLU 65 N 3.52 -1.18 0.22 4.34 4.39 -1.97 -3.25 114.58 120.65 1ttv h GLU 65 Ca -0.48 0.08 0.01 0.00 0.34 0.00 0.00 59.36 59.31 1ttv h GLU 65 Cb 1.19 0.27 -0.03 0.00 -0.10 0.00 0.00 28.75 30.08 1ttv h GLU 65 CO 0.66 -0.78 -0.33 0.87 -1.16 0.00 0.00 179.01 178.27 1ttv h LYS 66 N -1.26 -0.59 -5.09 2.33 6.56 -2.00 -3.40 116.57 113.13 1ttv h LYS 66 Ca -0.13 0.04 -0.65 0.00 -1.06 0.00 0.00 60.65 58.85 1ttv h LYS 66 Cb 0.94 0.13 -0.26 0.00 -0.57 0.00 0.00 32.23 32.48 1ttv h LYS 66 CO 0.21 -0.39 -0.71 1.14 -2.06 0.00 0.00 179.45 177.64 1ttv s GLN 67 N -6.01 3.46 0.17 3.15 0.00 -1.23 -4.98 119.66 114.23 1ttv s GLN 67 Ca -0.16 -0.60 0.25 0.00 -0.00 0.00 0.00 55.36 54.85 1ttv s GLN 67 Cb 0.07 -2.98 0.56 0.00 0.00 0.00 0.00 33.01 30.66 1ttv s GLN 67 CO 0.64 -0.06 1.54 1.04 0.00 0.00 0.00 175.29 178.45 1ttv n GLN 68 N 4.42 0.29 -0.22 9.60 3.00 -1.23 -2.79 117.38 130.45 1ttv n GLN 68 Ca -0.18 0.16 0.05 0.00 -0.01 0.00 0.00 57.00 57.02 1ttv n GLN 68 Cb 0.51 -1.75 0.16 0.00 0.00 0.00 0.00 30.24 29.16 1ttv n GLN 68 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.06 174.67 1ttv n HIS 69 N -2.21 0.55 -5.13 1.08 1.44 -1.26 -4.72 115.22 104.97 1ttv n HIS 69 Ca 0.04 -0.25 -0.30 0.00 -2.01 0.00 0.00 57.72 55.20 1ttv n HIS 69 Cb 0.44 -0.05 -0.17 0.00 0.12 0.00 0.00 29.99 30.33 1ttv n HIS 69 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1ttv s ILE 70 N -1.58 1.89 -0.30 0.61 -1.09 -1.23 -2.08 121.20 117.42 1ttv s ILE 70 Ca 0.24 -0.95 0.01 0.00 -2.23 0.00 0.00 60.65 57.72 1ttv s ILE 70 Cb 0.13 -1.63 0.09 0.00 -1.58 0.00 0.00 42.46 39.48 1ttv s ILE 70 CO 0.15 0.53 0.05 -0.69 -1.23 0.00 0.00 174.94 173.75 1ttv s VAL 71 N 0.18 1.44 -0.34 2.92 1.01 -1.07 -0.99 120.40 123.55 1ttv s VAL 71 Ca -0.12 -1.66 0.01 0.00 0.00 0.00 0.00 61.98 60.21 1ttv s VAL 71 Cb -0.16 -2.01 0.10 0.00 0.00 0.00 0.00 36.38 34.32 1ttv s VAL 71 CO 0.06 -0.54 0.10 -1.38 0.00 0.00 0.00 175.10 173.34 1ttv s HIS 72 N 1.35 2.48 -0.28 5.22 -3.43 -1.04 -1.63 115.29 117.96 1ttv s HIS 72 Ca 0.07 -2.28 -0.01 0.00 -0.80 0.00 0.00 55.06 52.05 1ttv s HIS 72 Cb -0.18 -2.18 0.09 0.00 -1.43 0.00 0.00 32.58 28.88 1ttv s HIS 72 CO -0.16 -0.89 0.06 0.00 -2.00 0.00 0.00 174.74 171.75 1ttv h SER 74 N 8.05 0.23 -3.48 0.00 0.87 -1.90 -3.34 113.55 113.99 1ttv h SER 74 Ca -0.14 -0.12 -0.77 0.00 -1.23 0.00 0.00 61.79 59.53 1ttv h SER 74 Cb 1.04 -0.06 -0.24 0.00 -0.44 0.00 0.00 62.40 62.70 1ttv h SER 74 CO 0.45 0.28 0.11 0.54 -0.53 0.00 0.00 176.83 177.68 1ttv s ASN 75 N -5.51 6.60 -0.28 6.23 4.22 -1.26 -4.72 114.94 120.22 1ttv s ASN 75 Ca -0.13 -2.37 -0.16 0.00 -2.14 0.00 0.00 52.86 48.06 1ttv s ASN 75 Cb 0.07 -2.24 0.09 0.00 1.28 0.00 0.00 41.25 40.46 1ttv s ASN 75 CO 0.70 -0.72 0.75 -0.62 -2.04 0.00 0.00 177.10 175.18 1ttv s ASP 76 N 2.69 -0.85 0.52 3.54 2.15 -1.25 -5.02 116.67 118.44 1ttv s ASP 76 Ca 0.16 1.37 0.42 0.00 0.43 0.00 0.00 52.55 54.93 1ttv s ASP 76 Cb -0.14 1.35 1.61 0.00 -0.30 0.00 0.00 42.92 45.44 1ttv s ASP 76 CO -0.06 -0.22 1.64 -0.65 -0.17 0.00 0.00 175.17 175.72 1ttv h PRO 77 N 6.79 0.03 -0.13 4.34 0.10 -1.93 0.71 132.00 141.90 1ttv h PRO 77 Ca -0.30 -0.00 -0.04 0.00 0.10 0.00 0.00 66.00 65.76 1ttv h PRO 77 Cb 1.22 -0.01 -0.00 0.00 0.10 0.00 0.00 31.00 32.31 1ttv h PRO 77 CO 0.17 0.02 -0.07 1.25 0.10 0.00 0.00 178.00 179.47 1ttv h LEU 78 N 0.03 0.29 -0.33 2.35 5.85 -1.95 -2.61 115.31 118.94 1ttv h LEU 78 Ca 0.82 -0.42 0.00 0.00 0.84 0.00 0.00 57.88 59.13 1ttv h LEU 78 Cb 3.12 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 44.05 1ttv h LEU 78 CO -0.12 0.65 0.22 1.23 -0.34 0.00 0.00 178.44 180.08 1ttv h GLY 79 N -0.07 0.46 2.00 3.75 0.00 0.19 -0.48 103.07 108.92 1ttv h GLY 79 Ca 0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 1ttv h GLY 79 CO 0.02 0.17 -0.04 1.05 0.00 0.00 0.00 176.54 177.74 1ttv h GLU 80 N 0.44 0.00 0.05 4.80 -0.00 -1.43 0.71 114.58 119.15 1ttv h GLU 80 Ca 0.12 0.00 -0.00 0.00 -0.00 0.00 0.00 59.36 59.48 1ttv h GLU 80 Cb -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.70 1ttv h GLU 80 CO -0.03 0.04 -0.02 1.25 -0.00 0.00 0.00 179.01 180.25 1ttv h LEU 81 N 0.00 -0.05 -1.67 3.06 5.85 -0.90 -3.34 115.31 118.26 1ttv h LEU 81 Ca -0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1ttv h LEU 81 Cb 0.10 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1ttv h LEU 81 CO 0.00 0.36 -0.19 -0.26 -0.34 0.00 0.00 178.44 178.01 1ttv h PHE 82 N -0.86 0.00 0.00 1.25 0.04 -1.04 -3.47 116.94 112.86 1ttv h PHE 82 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 1ttv h PHE 82 Cb 0.05 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.20 1ttv h PHE 82 CO 0.00 0.19 0.00 0.41 -0.60 0.00 0.00 178.31 178.31 1ttv n GLY 83 N -0.66 0.57 3.21 -1.45 0.00 0.25 -5.07 105.19 102.05 1ttv n GLY 83 Ca -0.02 -0.80 -0.12 0.00 0.00 0.00 0.00 46.02 45.08 1ttv n GLY 83 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ttv s VAL 84 N -2.00 0.71 -0.10 1.61 -7.23 -1.03 -5.02 120.40 107.33 1ttv s VAL 84 Ca 0.00 -1.97 0.15 0.00 -1.81 0.00 0.00 61.98 58.35 1ttv s VAL 84 Cb 0.00 -1.94 -0.22 0.00 0.56 0.00 0.00 36.38 34.79 1ttv s VAL 84 CO 0.00 -0.64 0.18 1.67 -0.31 0.00 0.00 175.10 176.00 1ttv n GLN 85 N -0.16 1.10 -3.80 4.82 7.27 -1.26 -4.48 117.38 120.86 1ttv n GLN 85 Ca -0.09 -0.07 -0.12 0.00 0.07 0.00 0.00 57.00 56.79 1ttv n GLN 85 Cb 0.62 -1.39 -0.11 0.00 2.41 0.00 0.00 30.24 31.77 1ttv n GLN 85 CO 0.00 0.00 0.00 -1.83 0.07 0.00 0.00 177.06 175.30 1ttv s GLU 86 N -2.69 0.39 -0.29 3.69 -1.05 -1.26 -1.26 118.70 116.24 1ttv s GLU 86 Ca -0.07 0.10 -0.15 0.00 -0.15 0.00 0.00 54.97 54.70 1ttv s GLU 86 Cb 0.07 0.18 0.10 0.00 -0.44 0.00 0.00 34.13 34.04 1ttv s GLU 86 CO 0.65 -0.07 0.74 -0.59 0.95 0.00 0.00 175.26 176.93 1ttv s PHE 87 N -0.42 -1.04 -0.12 4.83 -0.71 -0.65 -4.98 117.98 114.90 1ttv s PHE 87 Ca -0.05 2.00 -0.26 0.00 -1.04 0.00 0.00 56.93 57.57 1ttv s PHE 87 Cb -0.03 0.62 -0.02 0.00 -1.21 0.00 0.00 43.02 42.38 1ttv s PHE 87 CO 0.01 -0.52 0.84 -1.12 -1.34 0.00 0.00 175.22 173.10 1ttv s SER 88 N 1.91 7.04 0.16 1.98 0.01 -1.26 -2.59 113.70 120.95 1ttv s SER 88 Ca -0.09 1.27 0.18 0.00 1.31 0.00 0.00 55.95 58.63 1ttv s SER 88 Cb -0.06 -2.47 0.79 0.00 0.21 0.00 0.00 66.02 64.49 1ttv s SER 88 CO -0.19 -0.33 1.55 1.33 0.41 0.00 0.00 173.24 176.01 1ttv n VAL 89 N 4.43 1.04 -0.25 3.43 0.24 -0.89 -2.93 118.33 123.41 1ttv n VAL 89 Ca 0.04 0.34 0.19 0.00 -2.04 0.00 0.00 64.34 62.87 1ttv n VAL 89 Cb 0.50 -1.24 0.50 0.00 -1.47 0.00 0.00 33.84 32.13 1ttv n VAL 89 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 1ttv h LYS 90 N 0.00 0.41 -4.80 7.34 3.64 -1.92 -3.19 116.57 118.05 1ttv h LYS 90 Ca 0.00 -0.02 -0.73 0.00 -1.27 0.00 0.00 60.65 58.62 1ttv h LYS 90 Cb 0.23 -0.09 -0.17 0.00 -0.41 0.00 0.00 32.23 31.79 1ttv h LYS 90 CO 0.00 0.27 1.46 0.39 -2.27 0.00 0.00 179.45 179.30 1ttv n GLU 91 N -4.52 3.36 0.23 1.90 1.02 -1.15 -4.80 120.64 116.68 1ttv n GLU 91 Ca 0.19 -3.79 0.10 0.00 -0.02 0.00 0.00 57.16 53.64 1ttv n GLU 91 Cb 0.69 -3.08 0.67 0.00 -0.02 0.00 0.00 31.44 29.70 1ttv n GLU 91 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1ttv h HIS 92 N 7.11 0.00 -0.08 -0.32 3.86 -1.87 -1.27 115.15 122.59 1ttv h HIS 92 Ca 0.33 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.53 1ttv h HIS 92 Cb 0.86 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.33 1ttv h HIS 92 CO 1.13 0.00 -0.02 0.00 0.86 0.00 0.00 177.93 179.90 1ttv h ARG 93 N 0.00 0.11 0.02 2.45 3.08 -1.91 -0.92 114.38 117.21 1ttv h ARG 93 Ca 0.03 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 1ttv h ARG 93 Cb 0.14 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1ttv h ARG 93 CO -0.00 0.15 -0.19 0.00 -1.07 0.00 0.00 179.97 178.86 1ttv h ARG 94 N 0.11 0.09 -0.16 0.04 3.08 -1.64 -3.04 114.38 112.86 1ttv h ARG 94 Ca 0.03 -0.13 0.01 0.00 0.07 0.00 0.00 59.98 59.96 1ttv h ARG 94 Cb 0.12 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1ttv h ARG 94 CO 0.00 0.98 0.08 0.82 -1.07 0.00 0.00 179.97 180.78 1ttv h ILE 95 N -0.74 0.99 -0.24 2.04 2.04 -1.39 0.64 117.51 120.85 1ttv h ILE 95 Ca -0.03 -0.06 0.05 0.00 1.00 0.00 0.00 64.86 65.82 1ttv h ILE 95 Cb 1.06 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 37.91 1ttv h ILE 95 CO 0.04 0.03 -0.05 0.22 0.00 0.00 0.00 178.15 178.39 1ttv h TYR 96 N 0.17 -0.11 0.00 1.37 5.03 -1.31 0.10 116.97 122.22 1ttv h TYR 96 Ca 0.07 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.34 1ttv h TYR 96 Cb 0.02 0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.38 1ttv h TYR 96 CO -0.09 -0.09 -0.26 0.00 -1.32 0.00 0.00 178.16 176.39 1ttv h ALA 97 N 1.23 0.95 0.24 1.82 0.00 -1.38 -2.76 119.26 119.36 1ttv h ALA 97 Ca 0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1ttv h ALA 97 Cb 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ttv h ALA 97 CO -0.24 0.32 -0.12 1.98 0.00 0.00 0.00 179.25 181.20 1ttv h MET 98 N 0.00 -0.31 -0.26 0.00 1.85 0.13 -2.88 114.93 113.46 1ttv h MET 98 Ca -0.00 0.02 0.08 0.00 -0.61 0.00 0.00 59.70 59.18 1ttv h MET 98 Cb 0.89 0.07 -0.01 0.00 0.43 0.00 0.00 31.60 32.98 1ttv h MET 98 CO 0.03 -0.21 0.28 -0.84 -0.40 0.00 0.00 176.91 175.77 1ttv h ILE 99 N -0.71 0.46 -0.44 1.77 -0.00 -0.94 0.27 117.51 117.92 1ttv h ILE 99 Ca -0.03 0.00 -0.13 0.00 -0.00 0.00 0.00 64.86 64.70 1ttv h ILE 99 Cb 0.25 0.78 -0.01 0.00 -0.00 0.00 0.00 36.82 37.83 1ttv h ILE 99 CO 0.05 0.00 -0.23 0.28 -0.00 0.00 0.00 178.15 178.25 1ttv h SER 100 N 0.00 0.93 0.80 2.16 0.02 -1.52 -2.52 113.55 113.42 1ttv h SER 100 Ca 0.12 -0.35 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 1ttv h SER 100 Cb 0.68 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1ttv h SER 100 CO -0.00 1.12 0.00 0.54 -1.14 0.00 0.00 176.83 177.35 1ttv n ARG 101 N -4.10 0.20 -1.11 3.45 1.74 0.07 -2.77 116.66 114.13 1ttv n ARG 101 Ca -0.00 0.40 -0.24 0.00 -0.77 0.00 0.00 57.85 57.24 1ttv n ARG 101 Cb 0.46 -1.86 0.13 0.00 -1.02 0.00 0.00 32.46 30.16 1ttv n ARG 101 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1ttv n ASN 102 N -2.23 4.86 -4.33 0.55 3.02 -0.95 -4.90 115.26 111.28 1ttv n ASN 102 Ca 0.02 -3.46 -0.34 0.00 -0.03 0.00 0.00 54.58 50.78 1ttv n ASN 102 Cb 0.25 -0.86 -0.14 0.00 -0.61 0.00 0.00 39.78 38.42 1ttv n ASN 102 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ttv s LEU 103 N -2.99 2.72 -0.18 3.41 1.43 -1.11 -1.74 118.68 120.21 1ttv s LEU 103 Ca 0.51 -0.37 -0.24 0.00 -1.03 0.00 0.00 54.13 53.01 1ttv s LEU 103 Cb 0.42 -1.64 -0.22 0.00 0.03 0.00 0.00 46.19 44.79 1ttv s LEU 103 CO 0.06 0.10 0.39 -0.37 0.23 0.00 0.00 176.35 176.76 1ttv h VAL 104 N 5.54 1.18 -3.50 -1.59 -1.51 -1.07 -3.46 116.25 111.84 1ttv h VAL 104 Ca -0.32 -2.24 -0.65 0.00 -1.23 0.00 0.00 66.70 62.26 1ttv h VAL 104 Cb 1.19 2.59 -0.23 0.00 -2.13 0.00 0.00 31.29 32.71 1ttv h VAL 104 CO 0.58 0.42 -0.65 -0.55 -1.23 0.00 0.00 177.57 176.13 1ttv s SER 105 N -6.67 4.89 -0.06 4.19 0.15 -1.16 -5.00 113.70 110.03 1ttv s SER 105 Ca -0.26 -0.22 0.03 0.00 0.70 0.00 0.00 55.95 56.20 1ttv s SER 105 Cb 0.03 -1.85 -0.03 0.00 -1.71 0.00 0.00 66.02 62.46 1ttv s SER 105 CO 0.63 0.02 -0.12 0.00 1.20 0.00 0.00 173.24 174.96 1ttv s ALA 106 N 1.28 2.75 -0.53 5.45 0.00 -1.26 -0.23 121.76 129.22 1ttv s ALA 106 Ca 0.04 -0.95 -0.27 0.00 0.00 0.00 0.00 51.96 50.78 1ttv s ALA 106 Cb -0.15 -1.05 -0.09 0.00 0.00 0.00 0.00 23.12 21.84 1ttv s ALA 106 CO 0.02 0.55 2.44 -1.71 0.00 0.00 0.00 175.76 177.06 1ttv n ASN 107 N 2.31 2.13 -4.75 0.00 2.85 -1.07 -4.91 115.26 111.82 1ttv n ASN 107 Ca -0.17 -0.40 -0.35 0.00 -0.11 0.00 0.00 54.58 53.55 1ttv n ASN 107 Cb 0.52 -1.51 0.05 0.00 1.24 0.00 0.00 39.78 40.08 1ttv n ASN 107 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 1ttv s VAL 108 N 11.71 2.72 -0.50 3.44 -7.23 -1.26 -4.96 120.40 124.32 1ttv s VAL 108 Ca 1.03 0.40 0.03 0.00 -1.81 0.00 0.00 61.98 61.62 1ttv s VAL 108 Cb -0.31 -3.05 0.13 0.00 0.56 0.00 0.00 36.38 33.71 1ttv s VAL 108 CO 0.29 -0.14 0.24 -0.54 -0.31 0.00 0.00 175.10 174.64 1ttv s LYS 109 N -3.62 1.96 0.00 4.82 -0.14 -1.26 -5.04 119.74 116.45 1ttv s LYS 109 Ca 0.74 -2.49 0.00 0.00 -1.36 0.00 0.00 55.97 52.87 1ttv s LYS 109 Cb -0.27 -3.35 0.00 0.00 -1.68 0.00 0.00 37.83 32.53 1ttv s LYS 109 CO 0.37 -1.09 0.00 -0.85 -0.76 0.00 0.00 175.35 173.02 1ttv n GLU 110 N 3.35 0.00 -2.97 1.68 0.28 -1.26 -5.11 120.64 116.61 1ttv n GLU 110 Ca 0.05 0.00 -0.43 0.00 -0.16 0.00 0.00 57.16 56.62 1ttv n GLU 110 Cb 0.34 0.00 -0.05 0.00 1.43 0.00 0.00 31.44 33.16 1ttv n GLU 110 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 1ttv s SER 111 N 0.00 6.38 0.11 -1.84 0.01 -1.26 -5.04 113.70 112.06 1ttv s SER 111 Ca 0.00 -0.23 -0.18 0.00 1.31 0.00 0.00 55.95 56.85 1ttv s SER 111 Cb 0.00 -2.38 -0.07 0.00 0.21 0.00 0.00 66.02 63.78 1ttv s SER 111 CO 0.00 -0.96 0.58 -0.94 0.41 0.00 0.00 173.24 172.34 1ttv s SER 112 N 2.29 7.01 0.23 2.44 1.04 -1.26 -5.09 113.70 120.36 1ttv s SER 112 Ca 0.28 1.24 0.06 0.00 0.48 0.00 0.00 55.95 58.01 1ttv s SER 112 Cb -0.13 -2.35 -0.04 0.00 0.10 0.00 0.00 66.02 63.61 1ttv s SER 112 CO 0.21 0.20 0.21 -1.83 0.98 0.00 0.00 173.24 173.01 1ttv s GLU 113 N -1.43 2.99 0.51 4.02 1.03 -1.26 -5.12 118.70 119.44 1ttv s GLU 113 Ca 0.33 -0.98 -0.03 0.00 0.03 0.00 0.00 54.97 54.32 1ttv s GLU 113 Cb -0.18 -2.62 0.00 0.00 -0.80 0.00 0.00 34.13 30.53 1ttv s GLU 113 CO 0.19 0.42 0.78 0.34 -1.33 0.00 0.00 175.26 175.66 1ttv s ASP 114 N -3.73 5.74 -0.41 0.83 2.15 -1.26 -5.06 116.67 114.93 1ttv s ASP 114 Ca 0.33 0.50 -0.05 0.00 0.43 0.00 0.00 52.55 53.75 1ttv s ASP 114 Cb -0.08 -1.63 0.10 0.00 -0.30 0.00 0.00 42.92 41.00 1ttv s ASP 114 CO 0.25 -0.86 0.22 -0.63 -0.17 0.00 0.00 175.17 173.98 1ttv s ILE 115 N -2.76 3.62 0.29 4.11 1.01 -1.26 -4.93 121.20 121.28 1ttv s ILE 115 Ca 0.51 -1.79 0.13 0.00 0.00 0.00 0.00 60.65 59.50 1ttv s ILE 115 Cb -0.10 -3.36 0.05 0.00 0.01 0.00 0.00 42.46 39.06 1ttv s ILE 115 CO 0.41 -0.60 1.72 -0.26 0.00 0.00 0.00 174.94 176.22 1ttv h PHE 116 N 8.19 0.00 -0.57 3.97 0.04 -2.08 -3.47 116.94 123.02 1ttv h PHE 116 Ca -0.17 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.60 1ttv h PHE 116 Cb 1.06 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.21 1ttv h PHE 116 CO 0.59 0.48 0.00 0.41 -0.60 0.00 0.00 178.31 179.18 1ttv n GLY 117 N -0.03 0.91 3.77 -1.45 0.00 -1.26 -5.05 105.19 102.08 1ttv n GLY 117 Ca -0.01 -0.57 -0.39 0.00 0.00 0.00 0.00 46.02 45.05 1ttv n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ttv s ASN 118 N -2.78 7.30 0.00 1.61 2.20 -1.26 -5.36 114.94 116.65 1ttv s ASN 118 Ca 0.00 2.04 0.14 0.00 -0.94 0.00 0.00 52.86 54.11 1ttv s ASN 118 Cb 0.00 -2.60 0.11 0.00 -2.00 0.00 0.00 41.25 36.76 1ttv s ASN 118 CO 0.00 -0.11 0.95 0.52 -2.94 0.00 0.00 177.10 175.53