#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 3.01 -0.00 3.10 3.76 -1.26 -5.08 115.29 118.83 1ttv s HIS 14 Ca 0.00 -0.07 -0.00 0.00 -0.15 0.00 0.00 55.06 54.84 1ttv s HIS 14 Cb 0.00 -1.46 -0.00 0.00 1.11 0.00 0.00 32.58 32.23 1ttv s HIS 14 CO 0.00 0.52 0.31 0.82 -0.85 0.00 0.00 174.74 175.54 1ttv h ILE 15 N 2.27 0.00 0.00 0.60 5.03 -2.10 -3.51 117.51 119.81 1ttv h ILE 15 Ca -0.47 -0.01 0.00 0.00 -0.12 0.00 0.00 64.86 64.26 1ttv h ILE 15 Cb 1.20 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.99 1ttv h ILE 15 CO 0.61 0.00 0.00 -0.24 -0.68 0.00 0.00 178.15 177.84 1ttv n SER 16 N -2.04 0.00 -0.06 1.72 2.88 -1.26 -5.06 113.62 109.80 1ttv n SER 16 Ca -0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 1ttv n SER 16 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 1ttv n SER 16 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1ttv n THR 17 N 0.62 0.70 -3.77 2.46 5.66 -1.26 -4.92 114.28 113.77 1ttv n THR 17 Ca 0.00 -0.22 -0.37 0.00 -3.05 0.00 0.00 64.05 60.41 1ttv n THR 17 Cb 0.00 -1.29 -0.12 0.00 -1.55 0.00 0.00 70.33 67.37 1ttv n THR 17 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1ttv s SER 18 N -5.65 5.26 -0.09 1.09 0.01 -1.26 -4.88 113.70 108.18 1ttv s SER 18 Ca -0.17 -1.75 0.04 0.00 1.31 0.00 0.00 55.95 55.38 1ttv s SER 18 Cb 0.06 -1.84 -0.08 0.00 0.21 0.00 0.00 66.02 64.37 1ttv s SER 18 CO 0.25 -0.48 -0.02 -0.67 0.41 0.00 0.00 173.24 172.73 1ttv n ASP 19 N 4.67 3.16 -4.90 2.44 2.03 -1.26 -5.04 116.55 117.65 1ttv n ASP 19 Ca -0.06 -0.02 -0.29 0.00 0.52 0.00 0.00 54.79 54.94 1ttv n ASP 19 Cb 0.42 0.34 0.08 0.00 -0.72 0.00 0.00 41.12 41.23 1ttv n ASP 19 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1ttv s GLN 20 N -2.19 2.22 0.00 -0.67 1.11 -1.26 -5.10 119.66 113.78 1ttv s GLN 20 Ca -0.08 0.15 0.00 0.00 0.01 0.00 0.00 55.36 55.44 1ttv s GLN 20 Cb 0.03 -2.00 0.00 0.00 -1.01 0.00 0.00 33.01 30.03 1ttv s GLN 20 CO 0.28 -1.40 0.00 0.39 0.01 0.00 0.00 175.29 174.57 1ttv n GLU 21 N -3.18 0.91 -1.67 2.91 1.02 -1.26 -4.98 120.64 114.39 1ttv n GLU 21 Ca 0.08 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.77 1ttv n GLU 21 Cb 0.60 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.98 1ttv n GLU 21 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1ttv n LYS 22 N -0.82 2.57 -4.05 3.49 0.00 -1.26 -4.93 118.16 113.16 1ttv n LYS 22 Ca 0.00 0.94 -0.30 0.00 -0.00 0.00 0.00 58.31 58.96 1ttv n LYS 22 Cb 0.00 -2.85 -0.06 0.00 -0.00 0.00 0.00 35.03 32.12 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 4.19 3.81 0.37 -5.58 1.02 -1.26 -4.43 118.68 116.80 1ttv s LEU 23 Ca 0.90 -0.03 0.07 0.00 0.02 0.00 0.00 54.13 55.09 1ttv s LEU 23 Cb -0.55 -2.48 -0.02 0.00 0.02 0.00 0.00 46.19 43.17 1ttv s LEU 23 CO 0.46 0.15 0.39 0.68 0.02 0.00 0.00 176.35 178.05 1ttv s VAL 24 N -1.47 3.29 -0.47 -1.59 -7.23 0.27 -3.17 120.40 110.03 1ttv s VAL 24 Ca 0.30 -1.23 -0.00 0.00 -1.81 0.00 0.00 61.98 59.23 1ttv s VAL 24 Cb -0.12 -3.14 0.12 0.00 0.56 0.00 0.00 36.38 33.80 1ttv s VAL 24 CO 0.22 -0.09 0.24 -1.58 -0.31 0.00 0.00 175.10 173.58 1ttv s GLN 25 N -4.12 2.03 0.16 4.82 2.00 -0.93 -1.30 119.66 122.33 1ttv s GLN 25 Ca 0.46 -2.15 -0.31 0.00 -2.00 0.00 0.00 55.36 51.36 1ttv s GLN 25 Cb -0.06 -3.50 -0.09 0.00 0.80 0.00 0.00 33.01 30.16 1ttv s GLN 25 CO 0.29 -1.08 1.48 -2.14 -0.50 0.00 0.00 175.29 173.34 1ttv s PRO 26 N 0.55 4.26 0.95 1.67 0.02 -1.26 0.26 135.00 141.44 1ttv s PRO 26 Ca 0.12 2.25 -0.12 0.00 0.02 0.00 0.00 61.00 63.27 1ttv s PRO 26 Cb -0.22 -3.18 0.05 0.00 0.02 0.00 0.00 34.50 31.17 1ttv s PRO 26 CO -0.04 -0.51 0.49 0.25 -0.33 0.00 0.00 177.00 176.86 1ttv n THR 27 N 3.65 0.02 -0.37 0.99 -2.24 -1.17 -4.23 114.28 110.92 1ttv n THR 27 Ca 0.12 -0.17 0.29 0.00 -2.27 0.00 0.00 64.05 62.02 1ttv n THR 27 Cb 0.40 -0.66 0.58 0.00 -2.10 0.00 0.00 70.33 68.55 1ttv n THR 27 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1ttv h PRO 28 N -1.59 0.23 0.46 -0.78 0.11 -1.94 0.42 132.00 128.91 1ttv h PRO 28 Ca -0.43 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 1ttv h PRO 28 Cb 1.28 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1ttv h PRO 28 CO 0.35 0.15 -0.22 1.25 -0.21 0.00 0.00 178.00 179.33 1ttv h LEU 29 N 0.24 -0.52 -1.33 2.35 5.85 -1.97 -2.97 115.31 116.97 1ttv h LEU 29 Ca 0.68 0.02 0.13 0.00 0.84 0.00 0.00 57.88 59.55 1ttv h LEU 29 Cb 2.00 0.13 -0.06 0.00 0.37 0.00 0.00 40.66 43.10 1ttv h LEU 29 CO -0.32 -0.20 0.56 0.25 -0.34 0.00 0.00 178.44 178.39 1ttv h LEU 30 N -0.96 0.63 0.00 2.25 5.85 -1.64 -2.82 115.31 118.62 1ttv h LEU 30 Ca -0.06 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.70 1ttv h LEU 30 Cb 0.47 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1ttv h LEU 30 CO 0.10 0.34 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.28 1ttv h LEU 31 N 0.68 -0.60 -0.91 2.25 3.38 -0.21 -2.27 115.31 117.63 1ttv h LEU 31 Ca 0.42 0.07 0.25 0.00 0.09 0.00 0.00 57.88 58.71 1ttv h LEU 31 Cb 0.66 0.23 -0.14 0.00 0.09 0.00 0.00 40.66 41.50 1ttv h LEU 31 CO -0.18 -0.19 0.33 0.28 0.09 0.00 0.00 178.44 178.76 1ttv h SER 32 N -0.25 0.15 -0.87 -0.43 0.02 -1.33 1.05 113.55 111.89 1ttv h SER 32 Ca 0.00 0.19 0.20 0.00 -0.84 0.00 0.00 61.79 61.35 1ttv h SER 32 Cb 0.26 0.23 -0.06 0.00 0.14 0.00 0.00 62.40 62.97 1ttv h SER 32 CO -0.13 -0.14 0.59 -0.07 -1.14 0.00 0.00 176.83 175.94 1ttv h LEU 33 N 0.25 0.34 -0.09 5.07 3.38 -1.34 0.66 115.31 123.58 1ttv h LEU 33 Ca 0.60 0.03 -0.24 0.00 0.09 0.00 0.00 57.88 58.36 1ttv h LEU 33 Cb 1.24 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1ttv h LEU 33 CO -0.64 0.14 -1.03 -0.07 0.09 0.00 0.00 178.44 176.94 1ttv h LEU 34 N 0.34 0.53 -1.25 1.67 3.38 0.14 -1.44 115.31 118.67 1ttv h LEU 34 Ca 0.45 -0.46 0.11 0.00 0.09 0.00 0.00 57.88 58.06 1ttv h LEU 34 Cb 1.21 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.73 1ttv h LEU 34 CO -0.14 1.28 0.56 0.11 0.09 0.00 0.00 178.44 180.34 1ttv h LYS 35 N 0.20 0.78 0.00 1.13 6.56 0.15 0.83 116.57 126.22 1ttv h LYS 35 Ca -0.10 -0.05 -0.07 0.00 -1.06 0.00 0.00 60.65 59.37 1ttv h LYS 35 Cb 1.68 -0.18 -0.01 0.00 -0.57 0.00 0.00 32.23 33.15 1ttv h LYS 35 CO 0.18 0.52 -1.22 0.45 -2.06 0.00 0.00 179.45 177.31 1ttv n SER 36 N -4.53 0.81 -0.09 0.86 2.88 -0.42 -3.84 113.62 109.29 1ttv n SER 36 Ca 0.15 0.33 0.12 0.00 -1.33 0.00 0.00 58.87 58.15 1ttv n SER 36 Cb 0.35 0.40 0.68 0.00 -0.75 0.00 0.00 64.21 64.89 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 -2.27 2.63 0.00 -1.46 0.00 -0.43 -4.84 120.51 114.14 1ttv n ALA 37 Ca -0.04 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1ttv n ALA 37 Cb 0.67 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 0.93 1.23 3.48 0.00 0.00 -0.63 -4.81 105.19 105.40 1ttv n GLY 38 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 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 2.67 0.05 4.61 0.00 0.27 -4.99 121.76 122.38 1ttv s ALA 39 Ca 0.00 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.69 1ttv s ALA 39 Cb 0.00 -0.72 -0.00 0.00 0.00 0.00 0.00 23.12 22.39 1ttv s ALA 39 CO 0.00 0.59 -0.02 1.04 0.00 0.00 0.00 175.76 177.37 1ttv n GLN 40 N 1.16 0.03 -0.34 0.00 1.13 -1.26 -4.20 117.38 113.90 1ttv n GLN 40 Ca -0.16 0.01 -0.25 0.00 -1.94 0.00 0.00 57.00 54.66 1ttv n GLN 40 Cb 0.52 -0.39 0.24 0.00 0.11 0.00 0.00 30.24 30.72 1ttv n GLN 40 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 1ttv n LYS 41 N -3.21 -3.90 -0.07 -1.09 0.00 -1.26 -4.97 118.16 103.66 1ttv n LYS 41 Ca -0.01 -1.16 -0.04 0.00 -0.00 0.00 0.00 58.31 57.11 1ttv n LYS 41 Cb 0.03 -1.76 -0.16 0.00 -0.00 0.00 0.00 35.03 33.14 1ttv n LYS 41 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1ttv n GLU 42 N -4.32 0.78 -4.01 -1.58 -0.58 -1.26 -4.97 120.64 104.70 1ttv n GLU 42 Ca 0.11 -0.06 -0.30 0.00 -0.42 0.00 0.00 57.16 56.48 1ttv n GLU 42 Cb 0.50 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.82 1ttv n GLU 42 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1ttv s THR 43 N -2.75 4.84 -0.05 2.62 2.01 -1.26 -4.25 115.64 116.80 1ttv s THR 43 Ca -0.09 -0.67 -0.21 0.00 0.31 0.00 0.00 61.69 61.03 1ttv s THR 43 Cb 0.08 -3.36 0.04 0.00 0.01 0.00 0.00 72.50 69.27 1ttv s THR 43 CO 0.82 0.10 0.47 -0.36 -0.69 0.00 0.00 174.62 174.95 1ttv s PHE 44 N -1.48 -0.40 0.47 4.92 0.40 -0.42 -4.95 117.98 116.52 1ttv s PHE 44 Ca 0.31 0.71 -0.20 0.00 -0.60 0.00 0.00 56.93 57.16 1ttv s PHE 44 Cb -0.12 0.22 -0.09 0.00 0.51 0.00 0.00 43.02 43.54 1ttv s PHE 44 CO 0.24 -0.45 0.99 0.95 0.70 0.00 0.00 175.22 177.65 1ttv s THR 45 N -1.08 4.19 0.56 0.64 -4.23 -1.26 0.94 115.64 115.40 1ttv s THR 45 Ca -0.11 1.31 0.37 0.00 -1.18 0.00 0.00 61.69 62.08 1ttv s THR 45 Cb -0.03 -3.56 0.55 0.00 1.34 0.00 0.00 72.50 70.80 1ttv s THR 45 CO 0.06 -0.35 1.75 -0.03 -0.54 0.00 0.00 174.62 175.51 1ttv h MET 46 N 1.61 0.00 -0.16 3.99 4.05 -1.95 0.52 114.93 123.00 1ttv h MET 46 Ca -0.49 0.00 -0.09 0.00 -0.28 0.00 0.00 59.70 58.84 1ttv h MET 46 Cb 1.19 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.99 1ttv h MET 46 CO 0.60 0.00 -0.25 -0.22 0.23 0.00 0.00 176.91 177.27 1ttv h LYS 47 N 0.00 0.45 -0.13 0.39 1.63 -1.93 -1.81 116.57 115.16 1ttv h LYS 47 Ca 0.57 -0.27 -0.05 0.00 -0.85 0.00 0.00 60.65 60.05 1ttv h LYS 47 Cb 2.40 0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 34.05 1ttv h LYS 47 CO -0.01 0.86 -0.12 0.93 -3.45 0.00 0.00 179.45 177.67 1ttv h GLU 48 N 0.07 0.31 -0.24 1.90 4.39 -0.48 -1.21 114.58 119.33 1ttv h GLU 48 Ca 0.01 -0.16 0.06 0.00 0.34 0.00 0.00 59.36 59.61 1ttv h GLU 48 Cb 0.83 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.41 1ttv h GLU 48 CO 0.06 0.69 -0.20 0.28 -1.16 0.00 0.00 179.01 178.68 1ttv h VAL 49 N -0.06 0.47 0.00 3.13 2.07 -0.67 0.23 116.25 121.42 1ttv h VAL 49 Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1ttv h VAL 49 Cb 0.63 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1ttv h VAL 49 CO 0.03 0.00 0.00 0.25 0.02 0.00 0.00 177.57 177.87 1ttv h LEU 50 N -0.20 0.00 0.02 2.57 6.46 -1.34 -2.76 115.31 120.07 1ttv h LEU 50 Ca 0.14 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1ttv h LEU 50 Cb 0.40 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.33 1ttv h LEU 50 CO -0.36 0.00 -0.01 0.22 -0.62 0.00 0.00 178.44 177.68 1ttv h TYR 51 N 0.00 -0.02 -0.85 1.25 5.03 0.61 -3.27 116.97 119.72 1ttv h TYR 51 Ca 0.00 -0.00 0.06 0.00 2.58 0.00 0.00 58.73 61.37 1ttv h TYR 51 Cb 0.40 0.01 -0.06 0.00 1.55 0.00 0.00 36.73 38.62 1ttv h TYR 51 CO 0.00 0.42 0.53 0.45 -1.32 0.00 0.00 178.16 178.24 1ttv h HIS 52 N -0.99 0.98 -0.56 -3.82 -0.00 -0.81 -2.41 115.15 107.54 1ttv h HIS 52 Ca -0.00 0.03 0.11 0.00 -0.00 0.00 0.00 60.37 60.50 1ttv h HIS 52 Cb 0.46 -0.32 -0.11 0.00 -0.00 0.00 0.00 27.41 27.44 1ttv h HIS 52 CO 0.12 0.50 -0.24 1.25 -0.00 0.00 0.00 177.93 179.56 1ttv h LEU 53 N 0.97 -0.85 -0.92 2.43 5.85 -1.62 1.56 115.31 122.73 1ttv h LEU 53 Ca 0.37 0.20 0.13 0.00 0.84 0.00 0.00 57.88 59.42 1ttv h LEU 53 Cb 0.15 0.46 -0.09 0.00 0.37 0.00 0.00 40.66 41.56 1ttv h LEU 53 CO -0.17 -0.26 0.54 1.23 -0.34 0.00 0.00 178.44 179.44 1ttv h GLY 54 N -0.11 1.50 2.00 3.75 0.00 -1.48 0.17 103.07 108.91 1ttv h GLY 54 Ca 0.25 -0.34 -0.13 0.00 0.00 0.00 0.00 47.33 47.10 1ttv h GLY 54 CO -0.63 0.07 -0.64 1.46 0.00 0.00 0.00 176.54 176.80 1ttv h GLN 55 N 0.82 0.00 -0.02 4.80 4.20 -0.55 -3.10 115.11 121.26 1ttv h GLN 55 Ca 0.47 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.18 1ttv h GLN 55 Cb 0.55 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.33 1ttv h GLN 55 CO -0.30 0.64 0.00 -0.92 -0.67 0.00 0.00 178.83 177.58 1ttv h TYR 56 N 0.00 0.03 0.45 2.96 3.20 0.48 -0.54 116.97 123.55 1ttv h TYR 56 Ca -0.01 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 1ttv h TYR 56 Cb 1.35 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.61 1ttv h TYR 56 CO 0.00 0.26 -0.24 0.82 -1.64 0.00 0.00 178.16 177.36 1ttv h ILE 57 N -0.21 0.51 -0.41 1.81 2.04 -1.04 0.22 117.51 120.42 1ttv h ILE 57 Ca 0.00 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.92 1ttv h ILE 57 Cb 0.25 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1ttv h ILE 57 CO 0.00 0.00 0.28 0.00 0.00 0.00 0.00 178.15 178.43 1ttv h MET 58 N -0.64 0.31 0.38 2.37 -0.00 -1.57 0.86 114.93 116.63 1ttv h MET 58 Ca -0.06 -0.02 -0.02 0.00 -0.00 0.00 0.00 59.70 59.61 1ttv h MET 58 Cb 0.50 -0.07 0.00 0.00 -0.00 0.00 0.00 31.60 32.04 1ttv h MET 58 CO 0.08 0.20 -0.18 0.00 -0.00 0.00 0.00 176.91 177.01 1ttv h ALA 59 N 1.78 -0.51 0.00 -3.00 0.00 -0.58 -3.21 119.26 113.74 1ttv h ALA 59 Ca 0.18 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ttv h ALA 59 Cb 0.32 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1ttv h ALA 59 CO -0.04 -0.50 -0.07 0.87 0.00 0.00 0.00 179.25 179.51 1ttv h LYS 60 N -1.08 0.00 -4.40 0.00 6.56 -0.32 -3.47 116.57 113.86 1ttv h LYS 60 Ca -0.05 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.51 1ttv h LYS 60 Cb 0.47 0.00 0.02 0.00 -0.57 0.00 0.00 32.23 32.15 1ttv h LYS 60 CO 0.09 0.07 -0.09 0.94 -2.06 0.00 0.00 179.45 178.39 1ttv n GLN 61 N -3.38 -0.87 0.00 3.15 -0.06 0.30 -4.98 117.38 111.53 1ttv n GLN 61 Ca -0.01 0.98 0.06 0.00 -2.00 0.00 0.00 57.00 56.02 1ttv n GLN 61 Cb 0.22 -4.01 0.03 0.00 -4.06 0.00 0.00 30.24 22.43 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 -1.64 1.78 -4.83 1.69 4.77 -1.08 -5.01 117.00 112.67 1ttv n LEU 62 Ca -0.01 -0.93 -0.32 0.00 -0.03 0.00 0.00 56.01 54.72 1ttv n LEU 62 Cb 0.51 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.55 1ttv n LEU 62 CO 0.32 0.34 0.67 -0.72 -1.33 0.00 0.00 177.39 176.66 1ttv s TYR 63 N -1.15 3.38 0.27 -1.77 -0.85 -1.26 -2.74 117.35 113.24 1ttv s TYR 63 Ca 0.12 1.53 -0.25 0.00 -0.52 0.00 0.00 57.07 57.95 1ttv s TYR 63 Cb 0.10 -2.82 -0.09 0.00 0.38 0.00 0.00 41.96 39.52 1ttv s TYR 63 CO 0.19 -0.28 0.87 0.34 -1.52 0.00 0.00 175.55 175.15 1ttv s ASP 64 N -2.70 7.31 0.04 -0.18 2.15 0.37 -4.89 116.67 118.76 1ttv s ASP 64 Ca 0.60 1.72 -0.24 0.00 0.43 0.00 0.00 52.55 55.07 1ttv s ASP 64 Cb -0.10 -2.53 -0.17 0.00 -0.30 0.00 0.00 42.92 39.82 1ttv s ASP 64 CO 0.24 0.01 1.50 -0.33 -0.17 0.00 0.00 175.17 176.42 1ttv h GLU 65 N 3.47 0.04 0.75 4.34 4.39 -1.96 -3.27 114.58 122.34 1ttv h GLU 65 Ca -0.47 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.19 1ttv h GLU 65 Cb 1.19 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.83 1ttv h GLU 65 CO 0.65 0.29 -0.48 0.87 -1.16 0.00 0.00 179.01 179.18 1ttv h LYS 66 N -0.20 -1.11 -5.09 2.33 1.57 -1.98 -3.40 116.57 108.68 1ttv h LYS 66 Ca 0.01 0.08 -0.65 0.00 -1.87 0.00 0.00 60.65 58.21 1ttv h LYS 66 Cb 0.26 0.25 -0.26 0.00 0.08 0.00 0.00 32.23 32.56 1ttv h LYS 66 CO 0.00 -0.74 -0.72 1.14 -0.57 0.00 0.00 179.45 178.56 1ttv s GLN 67 N -5.95 3.44 0.32 3.15 0.00 -1.23 -4.98 119.66 114.41 1ttv s GLN 67 Ca -0.19 -0.61 0.25 0.00 -0.00 0.00 0.00 55.36 54.81 1ttv s GLN 67 Cb 0.03 -2.95 0.64 0.00 0.00 0.00 0.00 33.01 30.73 1ttv s GLN 67 CO 0.61 -0.06 1.71 1.96 0.00 0.00 0.00 175.29 179.50 1ttv h GLN 68 N 7.68 0.00 -0.44 9.60 7.50 -1.79 -3.09 115.11 134.57 1ttv h GLN 68 Ca -0.37 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.78 1ttv h GLN 68 Cb 1.17 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.70 1ttv h GLN 68 CO 0.60 0.00 0.00 -2.39 -1.50 0.00 0.00 178.83 175.54 1ttv n HIS 69 N -2.64 0.60 -5.12 2.96 1.44 -1.26 -4.74 115.22 106.46 1ttv n HIS 69 Ca 0.05 -0.28 -0.30 0.00 -2.01 0.00 0.00 57.72 55.18 1ttv n HIS 69 Cb 0.46 -0.04 -0.16 0.00 0.12 0.00 0.00 29.99 30.37 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 -1.52 1.86 -0.30 0.61 -1.09 -1.17 -0.89 121.20 118.70 1ttv s ILE 70 Ca 0.27 -0.94 0.01 0.00 -2.23 0.00 0.00 60.65 57.75 1ttv s ILE 70 Cb 0.15 -1.59 0.09 0.00 -1.58 0.00 0.00 42.46 39.53 1ttv s ILE 70 CO 0.17 0.52 0.04 -0.69 -1.23 0.00 0.00 174.94 173.75 1ttv s VAL 71 N 0.03 1.44 -0.34 2.92 1.01 -1.13 -0.48 120.40 123.86 1ttv s VAL 71 Ca -0.07 -1.61 0.02 0.00 0.00 0.00 0.00 61.98 60.32 1ttv s VAL 71 Cb -0.14 -1.98 0.10 0.00 0.00 0.00 0.00 36.38 34.36 1ttv s VAL 71 CO 0.04 -0.49 0.10 -1.38 0.00 0.00 0.00 175.10 173.37 1ttv s HIS 72 N 1.36 2.64 -0.28 5.22 -3.43 -1.11 -1.54 115.29 118.15 1ttv s HIS 72 Ca 0.06 -2.38 -0.01 0.00 -0.80 0.00 0.00 55.06 51.93 1ttv s HIS 72 Cb -0.18 -2.28 0.09 0.00 -1.43 0.00 0.00 32.58 28.78 1ttv s HIS 72 CO -0.15 -0.89 0.06 0.00 -2.00 0.00 0.00 174.74 171.76 1ttv h SER 74 N 8.06 0.14 -3.65 0.00 0.02 -1.93 -3.31 113.55 112.88 1ttv h SER 74 Ca -0.14 0.02 -0.78 0.00 -0.84 0.00 0.00 61.79 60.05 1ttv h SER 74 Cb 1.04 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 63.33 1ttv h SER 74 CO 0.44 0.11 0.04 0.54 -1.14 0.00 0.00 176.83 176.82 1ttv s ASN 75 N -5.35 6.64 -0.28 3.07 4.22 -1.26 -4.76 114.94 117.23 1ttv s ASN 75 Ca -0.13 -2.49 -0.23 0.00 -2.14 0.00 0.00 52.86 47.87 1ttv s ASN 75 Cb 0.10 -2.21 0.09 0.00 1.28 0.00 0.00 41.25 40.51 1ttv s ASN 75 CO 0.70 -0.64 0.80 -1.81 -2.04 0.00 0.00 177.10 174.11 1ttv s ASP 76 N 2.49 -0.71 0.57 3.54 1.01 -1.25 -5.02 116.67 117.30 1ttv s ASP 76 Ca 0.15 1.30 0.28 0.00 0.71 0.00 0.00 52.55 54.99 1ttv s ASP 76 Cb -0.14 1.31 1.51 0.00 1.01 0.00 0.00 42.92 46.61 1ttv s ASP 76 CO -0.06 -0.22 1.98 -0.65 0.21 0.00 0.00 175.17 176.42 1ttv h PRO 77 N 5.27 0.00 0.23 8.23 0.11 -1.93 -0.50 132.00 143.42 1ttv h PRO 77 Ca -0.29 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 1ttv h PRO 77 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1ttv h PRO 77 CO 0.09 0.00 -0.11 1.25 -0.21 0.00 0.00 178.00 179.02 1ttv h LEU 78 N 0.00 -0.26 -1.98 2.35 5.85 -1.95 0.04 115.31 119.35 1ttv h LEU 78 Ca 0.19 0.01 0.15 0.00 0.84 0.00 0.00 57.88 59.07 1ttv h LEU 78 Cb 0.96 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 1ttv h LEU 78 CO -0.00 -0.11 0.38 1.23 -0.34 0.00 0.00 178.44 179.59 1ttv h GLY 79 N -0.47 0.03 2.00 3.75 0.00 -1.65 0.37 103.07 107.10 1ttv h GLY 79 Ca -0.03 -0.01 -0.14 0.00 0.00 0.00 0.00 47.33 47.16 1ttv h GLY 79 CO 0.05 0.00 -0.65 -2.09 0.00 0.00 0.00 176.54 173.86 1ttv h GLU 80 N 0.02 0.00 0.24 4.80 4.57 -1.10 0.15 114.58 123.26 1ttv h GLU 80 Ca 0.25 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.42 1ttv h GLU 80 Cb 0.98 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.57 1ttv h GLU 80 CO -0.01 0.65 -0.12 1.25 -1.18 0.00 0.00 179.01 179.60 1ttv h LEU 81 N 0.00 -0.28 -2.24 1.64 5.85 0.17 -3.28 115.31 117.18 1ttv h LEU 81 Ca -0.01 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1ttv h LEU 81 Cb 1.21 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 1ttv h LEU 81 CO 0.08 0.10 0.09 -0.26 -0.34 0.00 0.00 178.44 178.11 1ttv h PHE 82 N -0.93 0.00 0.00 1.25 0.04 -1.36 -3.46 116.94 112.48 1ttv h PHE 82 Ca -0.03 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1ttv h PHE 82 Cb 0.25 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.40 1ttv h PHE 82 CO 0.01 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.13 1ttv n GLY 83 N -1.43 1.11 3.21 -1.45 0.00 -0.67 -5.09 105.19 100.87 1ttv n GLY 83 Ca -0.01 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.57 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 0.02 -0.20 1.61 -7.23 0.42 -5.01 120.40 108.02 1ttv s VAL 84 Ca 0.00 -1.93 0.17 0.00 -1.81 0.00 0.00 61.98 58.40 1ttv s VAL 84 Cb 0.00 -2.36 -0.24 0.00 0.56 0.00 0.00 36.38 34.33 1ttv s VAL 84 CO 0.00 -0.11 0.05 0.00 -0.31 0.00 0.00 175.10 174.73 1ttv n GLN 85 N -0.23 0.73 -4.03 4.82 1.13 -1.26 -4.08 117.38 114.45 1ttv n GLN 85 Ca -0.00 0.00 -0.12 0.00 -1.94 0.00 0.00 57.00 54.94 1ttv n GLN 85 Cb 0.65 -1.51 -0.12 0.00 0.11 0.00 0.00 30.24 29.37 1ttv n GLN 85 CO 0.00 0.00 0.00 -1.83 -1.44 0.00 0.00 177.06 173.79 1ttv s GLU 86 N -2.48 0.42 -0.30 -1.09 -1.05 -1.26 -1.10 118.70 111.83 1ttv s GLU 86 Ca -0.11 -0.60 -0.12 0.00 -0.15 0.00 0.00 54.97 53.98 1ttv s GLU 86 Cb 0.06 -0.16 0.13 0.00 -0.44 0.00 0.00 34.13 33.72 1ttv s GLU 86 CO 0.80 0.02 0.72 -0.59 0.95 0.00 0.00 175.26 177.16 1ttv s PHE 87 N -1.18 -1.17 0.25 4.83 -0.71 -0.59 -4.98 117.98 114.43 1ttv s PHE 87 Ca -0.10 2.09 -0.30 0.00 -1.04 0.00 0.00 56.93 57.58 1ttv s PHE 87 Cb -0.09 0.70 -0.09 0.00 -1.21 0.00 0.00 43.02 42.34 1ttv s PHE 87 CO -0.00 -0.58 1.09 -1.12 -1.34 0.00 0.00 175.22 173.27 1ttv s SER 88 N 2.52 7.29 -0.02 1.98 0.01 -1.26 -2.83 113.70 121.38 1ttv s SER 88 Ca -0.06 2.21 0.09 0.00 1.31 0.00 0.00 55.95 59.50 1ttv s SER 88 Cb -0.09 -2.62 0.31 0.00 0.21 0.00 0.00 66.02 63.82 1ttv s SER 88 CO -0.19 -0.15 1.20 1.33 0.41 0.00 0.00 173.24 175.85 1ttv n VAL 89 N 1.51 0.62 0.09 3.43 0.24 -0.07 -3.90 118.33 120.25 1ttv n VAL 89 Ca -0.00 -0.48 -0.12 0.00 -2.04 0.00 0.00 64.34 61.70 1ttv n VAL 89 Cb 0.45 0.08 -0.10 0.00 -1.47 0.00 0.00 33.84 32.80 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 1.90 0.19 -4.22 7.34 1.63 -1.92 -3.38 116.57 118.11 1ttv h LYS 90 Ca 0.00 -0.28 -0.76 0.00 -0.85 0.00 0.00 60.65 58.75 1ttv h LYS 90 Cb 0.61 0.10 -0.22 0.00 -0.60 0.00 0.00 32.23 32.12 1ttv h LYS 90 CO 0.05 1.09 1.02 0.39 -3.45 0.00 0.00 179.45 178.55 1ttv n GLU 91 N -3.52 3.47 0.10 1.90 1.02 -1.25 -4.83 120.64 117.52 1ttv n GLU 91 Ca -0.05 -4.09 0.19 0.00 -0.02 0.00 0.00 57.16 53.18 1ttv n GLU 91 Cb 0.94 -2.84 0.74 0.00 -0.02 0.00 0.00 31.44 30.27 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 6.86 0.00 -0.25 -0.32 3.86 -1.89 -1.53 115.15 121.88 1ttv h HIS 92 Ca 0.26 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.46 1ttv h HIS 92 Cb 0.86 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.32 1ttv h HIS 92 CO 0.97 0.00 0.11 -0.09 0.86 0.00 0.00 177.93 179.78 1ttv h ARG 93 N 0.00 0.36 -0.25 2.45 1.12 -1.96 0.28 114.38 116.37 1ttv h ARG 93 Ca 0.17 -0.06 -0.01 0.00 -1.11 0.00 0.00 59.98 58.98 1ttv h ARG 93 Cb 0.80 -0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.69 1ttv h ARG 93 CO -0.00 0.37 0.12 0.00 -3.11 0.00 0.00 179.97 177.35 1ttv h ARG 94 N 0.26 0.37 0.21 0.20 2.47 -1.69 -2.75 114.38 113.45 1ttv h ARG 94 Ca 0.08 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 58.74 1ttv h ARG 94 Cb 0.14 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.39 1ttv h ARG 94 CO -0.01 0.37 -0.10 0.82 0.56 0.00 0.00 179.97 181.61 1ttv h ILE 95 N 0.28 0.87 -1.18 2.04 2.04 -1.43 -2.76 117.51 117.38 1ttv h ILE 95 Ca 0.09 -0.62 0.34 0.00 1.00 0.00 0.00 64.86 65.67 1ttv h ILE 95 Cb 0.12 1.23 -0.05 0.00 -0.74 0.00 0.00 36.82 37.38 1ttv h ILE 95 CO -0.01 0.13 0.90 0.22 0.00 0.00 0.00 178.15 179.40 1ttv h TYR 96 N -0.60 0.00 0.10 1.37 5.03 -0.45 0.12 116.97 122.53 1ttv h TYR 96 Ca -0.03 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.28 1ttv h TYR 96 Cb 0.44 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.72 1ttv h TYR 96 CO 0.02 0.00 -0.05 0.00 -1.32 0.00 0.00 178.16 176.81 1ttv h ALA 97 N 1.30 -0.22 -0.99 1.82 0.00 -1.29 -2.75 119.26 117.13 1ttv h ALA 97 Ca 0.56 -0.03 0.19 0.00 0.00 0.00 0.00 54.91 55.63 1ttv h ALA 97 Cb 2.36 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 20.10 1ttv h ALA 97 CO -0.01 -0.21 0.61 0.00 0.00 0.00 0.00 179.25 179.65 1ttv h MET 98 N -0.58 0.71 -0.13 0.00 -0.00 -1.10 0.43 114.93 114.25 1ttv h MET 98 Ca -0.01 -0.04 -0.10 0.00 -0.00 0.00 0.00 59.70 59.55 1ttv h MET 98 Cb 0.11 -0.16 -0.01 0.00 -0.00 0.00 0.00 31.60 31.53 1ttv h MET 98 CO 0.02 0.47 -0.35 -0.84 -0.00 0.00 0.00 176.91 176.21 1ttv h ILE 99 N 0.73 1.29 0.09 -0.10 -0.00 -1.13 -1.65 117.51 116.73 1ttv h ILE 99 Ca 0.56 -1.39 -0.20 0.00 -0.00 0.00 0.00 64.86 63.82 1ttv h ILE 99 Cb 0.91 1.58 0.02 0.00 -0.00 0.00 0.00 36.82 39.33 1ttv h ILE 99 CO -0.34 0.42 -0.85 0.28 -0.00 0.00 0.00 178.15 177.66 1ttv h SER 100 N 0.24 0.60 0.42 2.16 0.02 -0.28 -3.22 113.55 113.48 1ttv h SER 100 Ca 0.03 -0.85 0.00 0.00 -0.84 0.00 0.00 61.79 60.13 1ttv h SER 100 Cb 0.74 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.09 1ttv h SER 100 CO 0.06 1.39 0.00 -2.11 -1.14 0.00 0.00 176.83 175.03 1ttv n ARG 101 N -4.08 0.25 -0.84 3.45 1.85 0.12 -2.86 116.66 114.56 1ttv n ARG 101 Ca -0.13 0.10 -0.03 0.00 -1.00 0.00 0.00 57.85 56.79 1ttv n ARG 101 Cb 0.81 -1.50 0.27 0.00 -1.05 0.00 0.00 32.46 30.99 1ttv n ARG 101 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1ttv n ASN 102 N -1.31 4.47 -4.20 2.89 3.02 -0.63 -4.84 115.26 114.67 1ttv n ASN 102 Ca 0.09 -2.97 -0.34 0.00 -0.03 0.00 0.00 54.58 51.33 1ttv n ASN 102 Cb 0.17 -0.70 -0.14 0.00 -0.61 0.00 0.00 39.78 38.50 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 -2.44 3.27 0.00 3.41 1.43 -1.13 -3.03 118.68 120.18 1ttv s LEU 103 Ca 0.46 -0.92 0.00 0.00 -1.03 0.00 0.00 54.13 52.64 1ttv s LEU 103 Cb 0.36 -1.67 0.00 0.00 0.03 0.00 0.00 46.19 44.91 1ttv s LEU 103 CO 0.12 -0.14 0.00 1.33 0.23 0.00 0.00 176.35 177.89 1ttv n VAL 104 N 4.66 0.00 -3.30 -1.59 0.24 0.14 -4.31 118.33 114.18 1ttv n VAL 104 Ca -0.16 0.47 -0.46 0.00 -2.04 0.00 0.00 64.34 62.15 1ttv n VAL 104 Cb 0.47 -1.17 -0.05 0.00 -1.47 0.00 0.00 33.84 31.62 1ttv n VAL 104 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1ttv s SER 105 N -2.59 6.19 0.04 -1.34 1.04 -1.25 -4.92 113.70 110.87 1ttv s SER 105 Ca 0.00 -1.73 0.05 0.00 0.48 0.00 0.00 55.95 54.75 1ttv s SER 105 Cb 0.00 -2.22 -0.04 0.00 0.10 0.00 0.00 66.02 63.87 1ttv s SER 105 CO 0.00 -0.87 -0.09 0.00 0.98 0.00 0.00 173.24 173.26 1ttv s ALA 106 N 1.69 2.95 -0.45 5.32 0.00 -1.26 -2.18 121.76 127.83 1ttv s ALA 106 Ca 0.04 -1.12 -0.09 0.00 0.00 0.00 0.00 51.96 50.79 1ttv s ALA 106 Cb -0.29 -1.00 0.11 0.00 0.00 0.00 0.00 23.12 21.93 1ttv s ALA 106 CO 0.04 0.62 0.31 -0.80 0.00 0.00 0.00 175.76 175.93 1ttv s ASN 107 N -1.69 5.65 0.21 0.00 0.01 -1.19 -4.97 114.94 112.95 1ttv s ASN 107 Ca 0.18 -1.80 0.08 0.00 -0.71 0.00 0.00 52.86 50.61 1ttv s ASN 107 Cb -0.11 -1.99 -0.05 0.00 0.41 0.00 0.00 41.25 39.51 1ttv s ASN 107 CO 0.10 -0.64 -0.15 0.54 -1.51 0.00 0.00 177.10 175.44 1ttv s VAL 108 N 1.36 1.79 -0.15 1.60 0.11 -1.26 -4.52 120.40 119.33 1ttv s VAL 108 Ca 0.05 -2.20 -0.04 0.00 -2.93 0.00 0.00 61.98 56.86 1ttv s VAL 108 Cb -0.25 -2.04 -0.03 0.00 -1.53 0.00 0.00 36.38 32.53 1ttv s VAL 108 CO -0.00 -0.56 -0.02 -0.54 -3.33 0.00 0.00 175.10 170.65 1ttv s LYS 109 N -3.56 3.62 0.04 1.54 1.02 -1.26 -5.09 119.74 116.05 1ttv s LYS 109 Ca 0.22 -0.48 -0.27 0.00 0.02 0.00 0.00 55.97 55.46 1ttv s LYS 109 Cb -0.01 -2.94 -0.05 0.00 -0.52 0.00 0.00 37.83 34.31 1ttv s LYS 109 CO 0.07 0.31 0.84 -1.83 -0.92 0.00 0.00 175.35 173.83 1ttv s GLU 110 N 0.18 4.55 0.06 1.68 1.03 -1.26 -5.06 118.70 119.89 1ttv s GLU 110 Ca -0.01 1.20 0.10 0.00 0.03 0.00 0.00 54.97 56.29 1ttv s GLU 110 Cb -0.13 -3.39 -0.03 0.00 -0.80 0.00 0.00 34.13 29.77 1ttv s GLU 110 CO 0.02 0.19 -0.27 -1.54 -1.33 0.00 0.00 175.26 172.34 1ttv s SER 111 N 0.20 3.20 0.12 0.83 1.04 -1.26 -5.12 113.70 112.71 1ttv s SER 111 Ca 0.43 -0.62 -0.29 0.00 0.48 0.00 0.00 55.95 55.95 1ttv s SER 111 Cb -0.21 -0.27 -0.06 0.00 0.10 0.00 0.00 66.02 65.57 1ttv s SER 111 CO 0.25 0.24 0.91 -0.44 0.98 0.00 0.00 173.24 175.18 1ttv s SER 112 N -1.41 7.46 0.21 7.02 0.01 -1.26 -5.02 113.70 120.71 1ttv s SER 112 Ca 0.12 1.74 -0.30 0.00 1.31 0.00 0.00 55.95 58.83 1ttv s SER 112 Cb -0.10 -2.56 -0.08 0.00 0.21 0.00 0.00 66.02 63.48 1ttv s SER 112 CO 0.03 -0.00 1.12 -1.83 0.41 0.00 0.00 173.24 172.97 1ttv s GLU 113 N -0.26 4.58 0.17 12.44 -1.05 -1.26 -5.01 118.70 128.32 1ttv s GLU 113 Ca 0.44 1.78 -0.30 0.00 -0.15 0.00 0.00 54.97 56.74 1ttv s GLU 113 Cb -0.23 -3.24 -0.07 0.00 -0.44 0.00 0.00 34.13 30.14 1ttv s GLU 113 CO 0.29 0.08 1.06 -0.51 0.95 0.00 0.00 175.26 177.12 1ttv s ASP 114 N -0.27 7.35 -0.41 0.83 1.11 -1.26 -5.02 116.67 119.00 1ttv s ASP 114 Ca 0.49 2.01 -0.05 0.00 0.18 0.00 0.00 52.55 55.18 1ttv s ASP 114 Cb -0.31 -2.60 0.10 0.00 1.07 0.00 0.00 42.92 41.18 1ttv s ASP 114 CO 0.37 -0.16 0.22 -0.63 1.18 0.00 0.00 175.17 176.15 1ttv s ILE 115 N -0.26 3.62 -0.27 0.77 1.01 -1.26 -4.91 121.20 119.88 1ttv s ILE 115 Ca 0.48 -1.79 0.09 0.00 0.00 0.00 0.00 60.65 59.43 1ttv s ILE 115 Cb -0.28 -3.36 0.48 0.00 0.01 0.00 0.00 42.46 39.31 1ttv s ILE 115 CO 0.34 -0.60 1.38 0.49 0.00 0.00 0.00 174.94 176.55 1ttv n PHE 116 N 4.72 0.87 -2.28 3.97 3.72 -1.26 -4.93 117.46 122.27 1ttv n PHE 116 Ca -0.06 -1.64 -0.20 0.00 -0.05 0.00 0.00 57.45 55.49 1ttv n PHE 116 Cb 0.42 -0.42 -0.02 0.00 -0.94 0.00 0.00 39.48 38.51 1ttv n PHE 116 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ttv n GLY 117 N -1.10 -0.12 3.28 1.37 0.00 -1.26 -4.93 105.19 102.43 1ttv n GLY 117 Ca 0.30 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.87 1ttv n GLY 117 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ttv s ASN 118 N -2.15 6.27 0.00 1.61 -0.87 -1.26 -5.34 114.94 113.20 1ttv s ASN 118 Ca 0.00 -2.27 0.00 0.00 -1.57 0.00 0.00 52.86 49.02 1ttv s ASN 118 Cb 0.00 -2.15 0.00 0.00 -0.02 0.00 0.00 41.25 39.08 1ttv s ASN 118 CO 0.00 -0.68 0.39 0.52 -2.57 0.00 0.00 177.10 174.76