#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tg1 h LEU 2 N 0.00 -0.03 -0.58 1.04 5.85 -1.03 0.13 115.31 120.70 1tg1 h LEU 2 Ca 0.00 0.23 -0.08 0.00 0.84 0.00 0.00 57.88 58.87 1tg1 h LEU 2 Cb 0.00 0.32 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1tg1 h LEU 2 CO 0.00 -0.26 0.05 -0.07 -0.34 0.00 0.00 178.44 177.82 1tg1 h LEU 3 N 0.13 0.95 -0.50 2.25 3.38 -1.93 -0.45 115.31 119.14 1tg1 h LEU 3 Ca 0.63 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 58.25 1tg1 h LEU 3 Cb 1.39 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 1tg1 h LEU 3 CO -0.75 1.00 0.03 -0.33 0.09 0.00 0.00 178.44 178.49 1tg1 h GLU 4 N 0.88 0.86 -0.61 1.13 5.08 -1.73 -1.58 114.58 118.60 1tg1 h GLU 4 Ca 0.17 -0.26 0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1tg1 h GLU 4 Cb 0.48 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 1tg1 h GLU 4 CO 0.02 0.88 0.37 0.35 -1.00 0.00 0.00 179.01 179.63 1tg1 h PHE 5 N 0.73 0.69 -0.80 4.33 3.57 -0.80 -0.36 116.94 124.30 1tg1 h PHE 5 Ca 0.15 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 1tg1 h PHE 5 Cb 0.47 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.95 1tg1 h PHE 5 CO 0.03 0.39 0.47 0.78 -2.23 0.00 0.00 178.31 177.75 1tg1 h GLY 6 N 0.72 1.17 1.07 2.40 0.00 -0.70 0.31 103.07 108.04 1tg1 h GLY 6 Ca 0.25 -0.50 -0.09 0.00 0.00 0.00 0.00 47.33 47.00 1tg1 h GLY 6 CO -0.11 0.48 0.05 1.70 0.00 0.00 0.00 176.54 178.66 1tg1 h LYS 7 N 1.10 1.08 -0.59 4.80 3.64 -0.83 -1.72 116.57 124.04 1tg1 h LYS 7 Ca 0.29 -0.32 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1tg1 h LYS 7 Cb -0.02 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.66 1tg1 h LYS 7 CO -0.05 1.02 0.35 1.98 -2.27 0.00 0.00 179.45 180.48 1tg1 h MET 8 N 0.98 0.81 -0.31 1.90 4.05 -0.48 -0.40 114.93 121.48 1tg1 h MET 8 Ca 0.18 -0.08 0.01 0.00 -0.28 0.00 0.00 59.70 59.53 1tg1 h MET 8 Cb 0.50 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 31.12 1tg1 h MET 8 CO 0.02 0.59 0.20 0.82 0.23 0.00 0.00 176.91 178.78 1tg1 h ILE 9 N 0.80 1.07 -0.38 1.77 2.04 -0.77 -0.99 117.51 121.05 1tg1 h ILE 9 Ca 0.21 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.92 1tg1 h ILE 9 Cb -0.00 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 36.68 1tg1 h ILE 9 CO -0.04 0.07 0.19 0.25 0.00 0.00 0.00 178.15 178.62 1tg1 h LEU 10 N 0.41 0.50 -0.80 1.44 5.85 -1.05 0.07 115.31 121.72 1tg1 h LEU 10 Ca 0.12 -0.12 0.06 0.00 0.84 0.00 0.00 57.88 58.78 1tg1 h LEU 10 Cb -0.03 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 40.81 1tg1 h LEU 10 CO -0.03 0.48 0.48 -0.33 -0.34 0.00 0.00 178.44 178.70 1tg1 h GLU 11 N 0.48 0.85 -0.03 1.25 5.08 -0.88 0.17 114.58 121.50 1tg1 h GLU 11 Ca 0.13 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.34 1tg1 h GLU 11 Cb 0.11 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 29.17 1tg1 h GLU 11 CO -0.02 0.56 -0.38 1.49 -1.00 0.00 0.00 179.01 179.67 1tg1 h GLU 12 N 0.88 0.30 0.00 2.33 4.57 -0.85 -3.40 114.58 118.40 1tg1 h GLU 12 Ca 0.36 -0.29 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 1tg1 h GLU 12 Cb 0.19 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 1tg1 h GLU 12 CO -0.18 0.97 -1.61 0.25 -1.18 0.00 0.00 179.01 177.26 1tg1 n THR 13 N -4.39 0.00 -0.84 0.32 -2.24 -0.02 -4.89 114.28 102.21 1tg1 n THR 13 Ca -0.09 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1tg1 n THR 13 Cb 0.55 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 1tg1 n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tg1 n GLY 14 N 1.70 1.24 3.88 3.38 0.00 0.59 -5.03 105.19 110.95 1tg1 n GLY 14 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 1tg1 n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tg1 s LYS 16 N -0.03 3.59 0.13 1.61 1.02 -1.26 -5.02 119.74 119.78 1tg1 s LYS 16 Ca 0.00 -0.02 -0.30 0.00 0.02 0.00 0.00 55.97 55.66 1tg1 s LYS 16 Cb 0.00 -3.13 -0.07 0.00 -0.52 0.00 0.00 37.83 34.11 1tg1 s LYS 16 CO 0.00 0.69 1.25 -0.51 -0.92 0.00 0.00 175.35 175.86 1tg1 s LEU 17 N -1.47 4.40 0.17 3.17 1.43 -1.26 -3.57 118.68 121.56 1tg1 s LEU 17 Ca 0.24 2.21 -0.14 0.00 -1.03 0.00 0.00 54.13 55.40 1tg1 s LEU 17 Cb -0.13 -3.59 0.14 0.00 0.03 0.00 0.00 46.19 42.63 1tg1 s LEU 17 CO 0.13 -0.48 1.73 0.00 0.23 0.00 0.00 176.35 177.95 1tg1 h ALA 18 N 6.07 0.49 -2.84 4.21 0.00 -1.93 -1.28 119.26 123.98 1tg1 h ALA 18 Ca -0.43 0.08 -0.66 0.00 0.00 0.00 0.00 54.91 53.90 1tg1 h ALA 18 Cb 1.21 0.10 -0.19 0.00 0.00 0.00 0.00 17.79 18.91 1tg1 h ALA 18 CO 0.79 -0.30 -0.53 0.42 0.00 0.00 0.00 179.25 179.64 1tg1 s ILE 19 N -6.15 5.04 -1.84 0.00 1.01 -1.26 -0.37 121.20 117.63 1tg1 s ILE 19 Ca -0.13 -0.11 0.19 0.00 0.00 0.00 0.00 60.65 60.59 1tg1 s ILE 19 Cb 0.14 -3.49 0.41 0.00 0.01 0.00 0.00 42.46 39.52 1tg1 s ILE 19 CO 0.72 0.14 1.33 -0.81 0.00 0.00 0.00 174.94 176.32 1tg1 n PRO 20 N 5.04 2.42 0.17 2.79 -0.04 -1.23 -4.98 135.00 139.17 1tg1 n PRO 20 Ca -0.14 -2.19 0.02 0.00 -0.04 0.00 0.00 63.50 61.15 1tg1 n PRO 20 Cb 0.51 -1.43 0.30 0.00 -0.04 0.00 0.00 33.50 32.83 1tg1 n PRO 20 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1tg1 h SER 21 N 3.56 0.00 0.00 3.54 0.02 -0.99 -3.32 113.55 116.36 1tg1 h SER 21 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1tg1 h SER 21 Cb 0.86 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.40 1tg1 h SER 21 CO 0.00 0.45 0.00 -1.22 -1.14 0.00 0.00 176.83 174.92 1tg1 n TYR 22 N -3.91 0.00 0.69 3.45 4.01 0.49 -4.69 117.16 117.20 1tg1 n TYR 22 Ca -0.01 -0.16 0.11 0.00 -0.16 0.00 0.00 57.90 57.68 1tg1 n TYR 22 Cb 0.49 -0.02 0.10 0.00 -0.31 0.00 0.00 39.34 39.60 1tg1 n TYR 22 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1tg1 n SER 23 N -0.16 0.63 -1.42 7.72 3.41 -0.97 -3.47 113.62 119.37 1tg1 n SER 23 Ca 0.00 -0.19 -0.01 0.00 -0.26 0.00 0.00 58.87 58.42 1tg1 n SER 23 Cb 0.15 0.55 -0.01 0.00 -0.26 0.00 0.00 64.21 64.64 1tg1 n SER 23 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1tg1 n SER 24 N -1.87 0.19 -4.70 4.04 3.41 -1.17 -4.04 113.62 109.48 1tg1 n SER 24 Ca 0.03 -2.01 -0.38 0.00 -0.26 0.00 0.00 58.87 56.25 1tg1 n SER 24 Cb 0.41 -0.05 -0.06 0.00 -0.26 0.00 0.00 64.21 64.25 1tg1 n SER 24 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1tg1 s TYR 25 N -0.19 3.45 0.00 7.33 6.14 -1.11 -1.27 117.35 131.71 1tg1 s TYR 25 Ca 0.20 0.82 0.00 0.00 0.64 0.00 0.00 57.07 58.73 1tg1 s TYR 25 Cb 0.24 -2.58 0.00 0.00 0.42 0.00 0.00 41.96 40.04 1tg1 s TYR 25 CO -0.10 0.07 0.00 0.41 0.64 0.00 0.00 175.55 176.57 1tg1 n GLY 26 N 3.52 1.29 0.07 8.97 0.00 0.16 -1.86 105.19 117.35 1tg1 n GLY 26 Ca -0.07 -0.57 0.11 0.00 0.00 0.00 0.00 46.02 45.50 1tg1 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tg1 n TYR 28 N -2.42 0.00 -3.28 0.00 4.02 -1.25 -3.39 117.16 110.84 1tg1 n TYR 28 Ca -0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.48 1tg1 n TYR 28 Cb 0.52 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.76 1tg1 n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1tg1 n GLY 30 N 4.71 2.64 0.71 0.00 0.00 -1.23 -2.76 105.19 109.27 1tg1 n GLY 30 Ca -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.93 1tg1 n GLY 30 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1tg1 n TRP 31 N -2.00 0.00 -1.14 1.61 -0.00 -1.25 -4.89 117.44 109.77 1tg1 n TRP 31 Ca 0.00 -0.26 0.00 0.00 -0.00 0.00 0.00 57.50 57.24 1tg1 n TRP 31 Cb 0.00 0.37 0.00 0.00 -0.00 0.00 0.00 31.31 31.68 1tg1 n TRP 31 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1tg1 n GLY 32 N 0.00 0.00 0.32 5.87 0.00 -0.89 -4.78 105.19 105.71 1tg1 n GLY 32 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1tg1 n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tg1 n GLY 33 N 1.78 -0.04 3.37 -0.02 0.00 -1.22 -4.92 105.19 104.14 1tg1 n GLY 33 Ca 0.00 -0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 1tg1 n GLY 33 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tg1 s LYS 34 N -1.41 1.21 0.00 1.61 -2.85 -1.26 -4.84 119.74 112.21 1tg1 s LYS 34 Ca 0.00 -1.18 0.00 0.00 -1.00 0.00 0.00 55.97 53.79 1tg1 s LYS 34 Cb 0.00 0.39 0.00 0.00 -2.06 0.00 0.00 37.83 36.16 1tg1 s LYS 34 CO 0.00 -0.45 0.00 0.41 0.10 0.00 0.00 175.35 175.41 1tg1 n GLY 35 N -0.24 1.87 3.68 0.59 0.00 0.44 -4.44 105.19 107.08 1tg1 n GLY 35 Ca -0.06 -1.95 -0.41 0.00 0.00 0.00 0.00 46.02 43.59 1tg1 n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tg1 s THR 36 N -2.53 4.89 0.36 2.61 2.01 -1.26 -4.64 115.64 117.08 1tg1 s THR 36 Ca 0.00 1.65 -0.26 0.00 0.31 0.00 0.00 61.69 63.38 1tg1 s THR 36 Cb 0.00 -4.14 -0.12 0.00 0.01 0.00 0.00 72.50 68.25 1tg1 s THR 36 CO 0.00 0.05 1.07 -2.65 -0.69 0.00 0.00 174.62 172.40 1tg1 n PRO 37 N 5.08 1.53 0.14 4.92 -0.02 -1.26 -4.85 135.00 140.54 1tg1 n PRO 37 Ca 0.04 0.54 0.01 0.00 -2.02 0.00 0.00 63.50 62.07 1tg1 n PRO 37 Cb 0.49 -2.05 0.17 0.00 -0.02 0.00 0.00 33.50 32.09 1tg1 n PRO 37 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1tg1 h LYS 38 N 1.91 0.00 0.00 -0.52 1.79 -1.95 -3.47 116.57 114.33 1tg1 h LYS 38 Ca -0.43 0.00 0.06 0.00 -2.18 0.00 0.00 60.65 58.10 1tg1 h LYS 38 Cb 1.33 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.97 1tg1 h LYS 38 CO 0.59 0.58 0.28 -0.40 -1.08 0.00 0.00 179.45 179.42 1tg1 n ASP 39 N -3.58 -1.04 -0.31 0.86 5.75 -1.26 -5.01 116.55 111.95 1tg1 n ASP 39 Ca -0.00 -1.60 -0.04 0.00 -0.01 0.00 0.00 54.79 53.13 1tg1 n ASP 39 Cb 0.64 1.71 0.08 0.00 -1.03 0.00 0.00 41.12 42.52 1tg1 n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1tg1 h ALA 40 N 2.00 1.08 -0.40 2.12 0.00 -1.92 -0.91 119.26 121.23 1tg1 h ALA 40 Ca -0.16 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1tg1 h ALA 40 Cb 0.67 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1tg1 h ALA 40 CO 0.21 0.55 0.25 1.15 0.00 0.00 0.00 179.25 181.41 1tg1 h THR 41 N 1.17 1.07 -0.53 0.00 2.02 -1.92 -0.91 112.91 113.81 1tg1 h THR 41 Ca 0.30 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.30 1tg1 h THR 41 Cb -0.03 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 66.88 1tg1 h THR 41 CO -0.05 0.09 0.31 -0.78 0.37 0.00 0.00 175.52 175.46 1tg1 h ASP 42 N 0.50 0.63 0.02 4.18 3.58 -1.80 -1.42 116.42 122.12 1tg1 h ASP 42 Ca 0.15 -0.03 -0.07 0.00 0.42 0.00 0.00 57.03 57.50 1tg1 h ASP 42 Cb -0.03 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 40.85 1tg1 h ASP 42 CO -0.05 0.50 -0.19 0.03 -2.88 0.00 0.00 179.24 176.64 1tg1 h ARG 43 N 0.73 0.32 -0.68 0.28 3.08 -0.28 -0.12 114.38 117.71 1tg1 h ARG 43 Ca 0.19 -0.09 0.06 0.00 0.07 0.00 0.00 59.98 60.21 1tg1 h ARG 43 Cb -0.02 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 29.95 1tg1 h ARG 43 CO -0.04 0.51 0.38 0.00 -1.07 0.00 0.00 179.97 179.75 1tg1 h PHE 46 N 0.68 -0.18 -0.58 0.00 3.57 -0.57 0.58 116.94 120.44 1tg1 h PHE 46 Ca 0.06 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.50 1tg1 h PHE 46 Cb 0.92 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.73 1tg1 h PHE 46 CO 0.05 -0.12 0.07 0.28 -2.23 0.00 0.00 178.31 176.36 1tg1 h VAL 47 N -0.10 1.25 -0.64 1.41 2.07 -1.11 -1.19 116.25 117.94 1tg1 h VAL 47 Ca 0.05 -1.00 -0.03 0.00 0.82 0.00 0.00 66.70 66.55 1tg1 h VAL 47 Cb 0.17 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1tg1 h VAL 47 CO -0.13 0.37 0.29 -0.74 0.02 0.00 0.00 177.57 177.38 1tg1 h HIS 48 N 0.89 0.93 -0.42 1.57 -0.00 -0.89 0.23 115.15 117.47 1tg1 h HIS 48 Ca 0.18 -0.05 0.01 0.00 -0.00 0.00 0.00 60.37 60.50 1tg1 h HIS 48 Cb 0.43 -0.29 -0.02 0.00 -0.00 0.00 0.00 27.41 27.53 1tg1 h HIS 48 CO 0.03 0.71 0.28 -0.44 -0.00 0.00 0.00 177.93 178.50 1tg1 h ASP 49 N 0.88 0.47 -0.97 3.26 3.32 -0.49 -0.85 116.42 122.05 1tg1 h ASP 49 Ca 0.22 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.27 1tg1 h ASP 49 Cb 0.14 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.52 1tg1 h ASP 49 CO -0.03 0.34 0.64 0.00 -1.72 0.00 0.00 179.24 178.47 1tg1 h TYR 52 N 0.34 0.65 0.00 0.00 -1.99 -0.92 -2.43 116.97 112.62 1tg1 h TYR 52 Ca 0.10 -0.07 -0.03 0.00 2.00 0.00 0.00 58.73 60.74 1tg1 h TYR 52 Cb 0.09 -0.19 -0.00 0.00 2.00 0.00 0.00 36.73 38.63 1tg1 h TYR 52 CO -0.03 0.61 -0.12 0.78 -0.00 0.00 0.00 178.16 179.40 1tg1 h GLY 53 N 0.89 0.00 2.00 3.88 0.00 0.04 0.01 103.07 109.89 1tg1 h GLY 53 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1tg1 h GLY 53 CO 0.01 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.25 1tg1 n ASN 54 N -3.85 0.19 -3.00 0.19 3.02 -0.29 -4.06 115.26 107.47 1tg1 n ASN 54 Ca -0.02 0.56 -0.25 0.00 -0.03 0.00 0.00 54.58 54.83 1tg1 n ASN 54 Cb 0.22 -0.60 -0.04 0.00 -0.61 0.00 0.00 39.78 38.75 1tg1 n ASN 54 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1tg1 n LEU 55 N -1.73 3.74 0.31 3.41 4.77 -0.01 -4.92 117.00 122.58 1tg1 n LEU 55 Ca 0.02 -5.54 0.19 0.00 -0.03 0.00 0.00 56.01 50.65 1tg1 n LEU 55 Cb 0.14 -0.31 1.00 0.00 -2.33 0.00 0.00 43.42 41.93 1tg1 n LEU 55 CO 0.12 2.34 1.11 1.55 -1.33 0.00 0.00 177.39 181.17 1tg1 h PRO 56 N 3.02 0.00 -0.38 3.23 0.13 -1.73 -1.11 132.00 135.17 1tg1 h PRO 56 Ca 0.13 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.25 1tg1 h PRO 56 Cb 0.60 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 1tg1 h PRO 56 CO 0.76 0.02 0.01 -0.25 -0.23 0.00 0.00 178.00 178.30 1tg1 n ASP 59 N -3.23 4.50 -4.70 1.44 10.43 -1.26 -4.94 116.55 118.79 1tg1 n ASP 59 Ca -0.02 -3.01 -0.24 0.00 2.57 0.00 0.00 54.79 54.09 1tg1 n ASP 59 Cb 0.15 -0.60 -0.07 0.00 1.84 0.00 0.00 41.12 42.44 1tg1 n ASP 59 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1tg1 n ASN 67 N -1.12 1.22 0.30 0.00 3.02 -1.26 -4.99 115.26 112.44 1tg1 n ASN 67 Ca -0.03 -2.81 0.19 0.00 -0.03 0.00 0.00 54.58 51.89 1tg1 n ASN 67 Cb 0.63 -0.64 0.91 0.00 -0.61 0.00 0.00 39.78 40.06 1tg1 n ASN 67 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1tg1 h PRO 68 N 5.12 0.00 -0.36 3.52 0.14 -1.92 -0.91 132.00 137.59 1tg1 h PRO 68 Ca 0.19 0.00 -0.12 0.00 0.14 0.00 0.00 66.00 66.21 1tg1 h PRO 68 Cb 0.83 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 31.95 1tg1 h PRO 68 CO 0.55 0.03 -0.26 0.87 0.14 0.00 0.00 178.00 179.32 1tg1 h LYS 69 N 0.00 0.74 0.00 0.86 1.79 -1.94 -3.17 116.57 114.86 1tg1 h LYS 69 Ca -0.00 -0.31 -0.09 0.00 -2.18 0.00 0.00 60.65 58.07 1tg1 h LYS 69 Cb 0.27 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.88 1tg1 h LYS 69 CO 0.00 0.92 -1.43 -1.13 -1.08 0.00 0.00 179.45 176.73 1tg1 n SER 70 N -4.10 3.29 -4.70 0.86 3.41 -1.04 -0.98 113.62 110.36 1tg1 n SER 70 Ca -0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 1tg1 n SER 70 Cb 0.45 0.89 -0.03 0.00 -0.26 0.00 0.00 64.21 65.26 1tg1 n SER 70 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1tg1 s ASP 71 N -3.53 6.94 -0.03 4.04 -1.08 -0.37 -4.65 116.67 117.99 1tg1 s ASP 71 Ca -0.03 2.09 -0.15 0.00 -0.52 0.00 0.00 52.55 53.94 1tg1 s ASP 71 Cb 0.03 -2.57 -0.05 0.00 -1.46 0.00 0.00 42.92 38.87 1tg1 s ASP 71 CO 0.29 -0.62 0.39 -0.13 0.52 0.00 0.00 175.17 175.63 1tg1 s ARG 72 N 1.74 3.96 0.35 4.34 0.52 -1.26 -0.03 118.95 128.57 1tg1 s ARG 72 Ca 0.61 0.37 0.08 0.00 -0.52 0.00 0.00 55.73 56.27 1tg1 s ARG 72 Cb -0.31 -3.25 -0.07 0.00 0.52 0.00 0.00 34.95 31.84 1tg1 s ARG 72 CO 0.27 0.61 -0.06 1.52 0.02 0.00 0.00 175.30 177.66 1tg1 s TYR 73 N -0.80 2.36 0.02 -0.53 -0.85 -1.26 -4.89 117.35 111.39 1tg1 s TYR 73 Ca 0.23 -0.58 0.05 0.00 -0.52 0.00 0.00 57.07 56.25 1tg1 s TYR 73 Cb -0.16 -1.43 -0.03 0.00 0.38 0.00 0.00 41.96 40.72 1tg1 s TYR 73 CO 0.12 0.50 -0.13 0.15 -1.52 0.00 0.00 175.55 174.67 1tg1 s LYS 74 N -3.66 2.30 0.13 -3.49 -0.14 -1.26 -4.93 119.74 108.69 1tg1 s LYS 74 Ca 0.33 -0.85 -0.09 0.00 -1.36 0.00 0.00 55.97 53.99 1tg1 s LYS 74 Cb 0.04 -2.33 -0.00 0.00 -1.68 0.00 0.00 37.83 33.86 1tg1 s LYS 74 CO 0.16 0.57 0.24 1.52 -0.76 0.00 0.00 175.35 177.09 1tg1 s TYR 75 N -0.94 0.26 0.25 3.18 -0.85 -1.26 -0.88 117.35 117.10 1tg1 s TYR 75 Ca 0.15 -0.66 0.01 0.00 -0.52 0.00 0.00 57.07 56.06 1tg1 s TYR 75 Cb -0.11 -0.05 -0.05 0.00 0.38 0.00 0.00 41.96 42.13 1tg1 s TYR 75 CO 0.06 -0.64 0.09 -1.59 -1.52 0.00 0.00 175.55 171.95 1tg1 s LYS 76 N -3.91 1.37 -0.18 -3.49 -2.85 -0.38 -4.91 119.74 105.38 1tg1 s LYS 76 Ca 0.11 -1.73 -0.06 0.00 -1.00 0.00 0.00 55.97 53.28 1tg1 s LYS 76 Cb 0.04 -0.23 -0.04 0.00 -2.06 0.00 0.00 37.83 35.54 1tg1 s LYS 76 CO -0.06 -0.29 0.03 1.03 0.10 0.00 0.00 175.35 176.17 1tg1 s ARG 77 N -4.03 3.85 -0.43 1.78 1.81 -1.26 -0.36 118.95 120.31 1tg1 s ARG 77 Ca 0.37 -0.41 -0.05 0.00 -1.72 0.00 0.00 55.73 53.91 1tg1 s ARG 77 Cb 0.08 -3.14 0.11 0.00 -0.45 0.00 0.00 34.95 31.55 1tg1 s ARG 77 CO 0.13 0.20 0.26 0.08 -0.68 0.00 0.00 175.30 175.29 1tg1 s VAL 78 N 0.53 3.67 -0.38 3.52 1.01 0.62 -4.74 120.40 124.63 1tg1 s VAL 78 Ca 0.01 -1.93 -0.07 0.00 0.00 0.00 0.00 61.98 59.99 1tg1 s VAL 78 Cb -0.13 -3.46 0.01 0.00 0.00 0.00 0.00 36.38 32.80 1tg1 s VAL 78 CO 0.02 -0.71 0.23 0.59 0.00 0.00 0.00 175.10 175.23 1tg1 n ASN 79 N 4.73 -1.58 0.00 3.32 4.13 -1.26 -1.43 115.26 123.16 1tg1 n ASN 79 Ca -0.05 -0.43 0.00 0.00 1.68 0.00 0.00 54.58 55.79 1tg1 n ASN 79 Cb 0.41 -0.57 0.00 0.00 -1.54 0.00 0.00 39.78 38.08 1tg1 n ASN 79 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1tg1 n GLY 80 N -1.17 3.10 3.74 7.41 0.00 -1.26 -5.04 105.19 111.97 1tg1 n GLY 80 Ca -0.07 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.71 1tg1 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tg1 s ALA 81 N 0.00 3.37 -0.06 4.61 0.00 -0.51 -4.97 121.76 124.19 1tg1 s ALA 81 Ca 0.00 0.80 -0.28 0.00 0.00 0.00 0.00 51.96 52.48 1tg1 s ALA 81 Cb 0.00 -3.32 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 1tg1 s ALA 81 CO 0.00 -0.13 0.92 0.42 0.00 0.00 0.00 175.76 176.96 1tg1 s ILE 82 N -0.60 4.88 -0.23 0.00 1.01 -1.26 -0.28 121.20 124.72 1tg1 s ILE 82 Ca 0.47 1.89 0.01 0.00 0.00 0.00 0.00 60.65 63.02 1tg1 s ILE 82 Cb -0.29 -4.24 0.06 0.00 0.01 0.00 0.00 42.46 37.99 1tg1 s ILE 82 CO 0.36 0.12 -0.08 -0.69 0.00 0.00 0.00 174.94 174.65 1tg1 s VAL 83 N 1.37 1.74 0.08 2.92 1.01 0.52 -4.93 120.40 123.10 1tg1 s VAL 83 Ca 0.47 -1.30 -0.31 0.00 0.00 0.00 0.00 61.98 60.84 1tg1 s VAL 83 Cb -0.19 -1.92 -0.07 0.00 0.00 0.00 0.00 36.38 34.20 1tg1 s VAL 83 CO 0.22 -0.03 1.39 0.00 0.00 0.00 0.00 175.10 176.68 1tg1 s GLU 85 N 1.50 3.58 -0.18 0.00 2.02 -0.06 -4.96 118.70 120.60 1tg1 s GLU 85 Ca 0.64 0.04 -0.29 0.00 0.02 0.00 0.00 54.97 55.38 1tg1 s GLU 85 Cb -0.35 -2.53 -0.00 0.00 0.10 0.00 0.00 34.13 31.35 1tg1 s GLU 85 CO 0.29 0.02 1.15 0.21 0.02 0.00 0.00 175.26 176.96 1tg1 s LYS 86 N -4.19 4.26 0.00 1.61 2.20 -1.26 -4.63 119.74 117.73 1tg1 s LYS 86 Ca 0.45 1.52 0.00 0.00 -0.36 0.00 0.00 55.97 57.58 1tg1 s LYS 86 Cb -0.10 -3.69 0.00 0.00 -1.51 0.00 0.00 37.83 32.53 1tg1 s LYS 86 CO 0.37 -0.64 0.00 0.41 -0.36 0.00 0.00 175.35 175.13 1tg1 n GLY 88 N 3.45 5.25 3.75 5.54 0.00 -1.26 -4.98 105.19 116.94 1tg1 n GLY 88 Ca 0.13 -1.53 -0.29 0.00 0.00 0.00 0.00 46.02 44.32 1tg1 n GLY 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tg1 s THR 89 N 3.41 2.60 0.19 2.61 -4.23 -1.26 -4.80 115.64 114.16 1tg1 s THR 89 Ca 0.00 0.20 -0.12 0.00 -1.18 0.00 0.00 61.69 60.58 1tg1 s THR 89 Cb 0.00 -2.82 0.10 0.00 1.34 0.00 0.00 72.50 71.11 1tg1 s THR 89 CO 0.00 -0.25 1.79 0.28 -0.54 0.00 0.00 174.62 175.90 1tg1 h SER 90 N -1.43 0.42 -0.36 3.99 0.02 -2.00 -0.94 113.55 113.25 1tg1 h SER 90 Ca -0.49 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 60.50 1tg1 h SER 90 Cb 1.29 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 63.76 1tg1 h SER 90 CO 0.58 0.28 0.19 0.00 -1.14 0.00 0.00 176.83 176.75 1tg1 h GLU 92 N 0.40 1.00 -0.53 0.00 5.08 -1.74 0.51 114.58 119.30 1tg1 h GLU 92 Ca 0.14 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1tg1 h GLU 92 Cb 0.03 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 1tg1 h GLU 92 CO -0.08 0.70 0.28 -0.91 -1.00 0.00 0.00 179.01 177.99 1tg1 h ASN 93 N 1.01 0.66 -0.13 1.42 2.35 -0.88 -0.43 115.58 119.59 1tg1 h ASN 93 Ca 0.27 -0.10 -0.20 0.00 -0.55 0.00 0.00 56.30 55.71 1tg1 h ASN 93 Cb -0.05 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.15 1tg1 h ASN 93 CO -0.05 0.57 -0.69 0.03 -1.65 0.00 0.00 177.43 175.64 1tg1 h ARG 94 N 0.70 0.76 -0.33 0.81 3.08 -0.93 -1.95 114.38 116.52 1tg1 h ARG 94 Ca 0.18 -0.56 -0.00 0.00 0.07 0.00 0.00 59.98 59.67 1tg1 h ARG 94 Cb 0.06 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 1tg1 h ARG 94 CO -0.03 1.18 0.20 0.82 -1.07 0.00 0.00 179.97 181.07 1tg1 h ILE 95 N 0.54 1.11 -0.64 2.04 2.04 -0.80 -2.05 117.51 119.76 1tg1 h ILE 95 Ca -0.03 -0.26 0.05 0.00 1.00 0.00 0.00 64.86 65.62 1tg1 h ILE 95 Cb 1.30 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 38.03 1tg1 h ILE 95 CO 0.14 0.11 0.36 0.00 0.00 0.00 0.00 178.15 178.76 1tg1 h GLU 97 N 0.67 0.80 -0.38 0.00 4.39 -1.11 0.10 114.58 119.05 1tg1 h GLU 97 Ca 0.28 -0.15 -0.03 0.00 0.34 0.00 0.00 59.36 59.81 1tg1 h GLU 97 Cb 0.16 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 1tg1 h GLU 97 CO -0.17 0.71 0.14 0.00 -1.16 0.00 0.00 179.01 178.53 1tg1 h ASP 99 N 0.47 0.63 -0.40 0.00 5.19 -0.77 -2.28 116.42 119.27 1tg1 h ASP 99 Ca 0.13 -0.43 0.07 0.00 -0.62 0.00 0.00 57.03 56.17 1tg1 h ASP 99 Cb 0.22 -0.18 -0.06 0.00 0.18 0.00 0.00 39.33 39.49 1tg1 h ASP 99 CO -0.01 0.93 0.03 0.50 -3.12 0.00 0.00 179.24 177.57 1tg1 h LYS 100 N 0.34 0.14 -0.44 3.56 3.64 -0.81 -0.18 116.57 122.82 1tg1 h LYS 100 Ca 0.06 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1tg1 h LYS 100 Cb 0.71 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.48 1tg1 h LYS 100 CO 0.05 0.09 0.29 0.00 -2.27 0.00 0.00 179.45 177.61 1tg1 h ALA 101 N 1.34 0.56 -0.59 5.00 0.00 -1.29 -1.43 119.26 122.84 1tg1 h ALA 101 Ca 0.20 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1tg1 h ALA 101 Cb 0.27 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1tg1 h ALA 101 CO -0.30 0.02 0.20 0.00 0.00 0.00 0.00 179.25 179.16 1tg1 h ALA 102 N 1.16 0.77 -0.51 0.00 0.00 -0.88 0.76 119.26 120.56 1tg1 h ALA 102 Ca 0.16 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1tg1 h ALA 102 Cb -0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1tg1 h ALA 102 CO -0.03 0.43 0.22 0.00 0.00 0.00 0.00 179.25 179.86 1tg1 h ALA 103 N 1.06 0.66 -0.66 0.00 0.00 -0.80 0.14 119.26 119.68 1tg1 h ALA 103 Ca 0.19 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1tg1 h ALA 103 Cb 0.26 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1tg1 h ALA 103 CO -0.01 0.26 0.34 0.82 0.00 0.00 0.00 179.25 180.66 1tg1 h ILE 104 N 0.69 1.21 -0.64 0.00 2.04 -1.09 -1.88 117.51 117.84 1tg1 h ILE 104 Ca 0.17 -0.56 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1tg1 h ILE 104 Cb 0.17 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.60 1tg1 h ILE 104 CO -0.02 0.24 0.34 0.00 0.00 0.00 0.00 178.15 178.71 1tg1 h PHE 106 N 0.87 0.73 -0.65 0.00 0.04 -0.50 -1.97 116.94 115.46 1tg1 h PHE 106 Ca 0.22 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.99 1tg1 h PHE 106 Cb 0.05 -0.24 -0.03 0.00 2.20 0.00 0.00 35.95 37.93 1tg1 h PHE 106 CO -0.01 0.50 0.42 -0.09 -0.60 0.00 0.00 178.31 178.54 1tg1 h ARG 107 N 0.74 0.87 0.00 1.51 9.65 -0.90 -1.48 114.38 124.76 1tg1 h ARG 107 Ca 0.20 -0.06 -0.00 0.00 -1.10 0.00 0.00 59.98 59.01 1tg1 h ARG 107 Cb -0.01 -0.19 -0.00 0.00 -1.39 0.00 0.00 29.97 28.38 1tg1 h ARG 107 CO -0.04 0.59 -0.01 0.37 2.80 0.00 0.00 179.97 183.68 1tg1 h GLN 108 N 0.88 0.00 -0.05 0.20 4.15 -0.53 -3.12 115.11 116.64 1tg1 h GLN 108 Ca 0.24 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.66 1tg1 h GLN 108 Cb -0.07 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.62 1tg1 h GLN 108 CO -0.05 0.01 0.00 0.09 -1.93 0.00 0.00 178.83 176.96 1tg1 n ASN 109 N -3.14 2.34 0.12 -0.69 3.02 -0.78 -4.64 115.26 111.50 1tg1 n ASN 109 Ca -0.01 -2.42 0.13 0.00 -0.03 0.00 0.00 54.58 52.25 1tg1 n ASN 109 Cb 0.22 -0.20 0.64 0.00 -0.61 0.00 0.00 39.78 39.83 1tg1 n ASN 109 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1tg1 h LEU 110 N 0.34 0.05 -1.69 3.41 3.38 -1.22 -1.92 115.31 117.64 1tg1 h LEU 110 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1tg1 h LEU 110 Cb 0.75 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1tg1 h LEU 110 CO 0.02 0.03 0.00 -0.55 0.09 0.00 0.00 178.44 178.03 1tg1 h ASN 111 N 0.06 0.00 -0.00 -0.43 -0.00 -1.84 -2.42 115.58 110.95 1tg1 h ASN 111 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.42 1tg1 h ASN 111 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.75 1tg1 h ASN 111 CO -0.01 0.00 0.00 0.35 -0.00 0.00 0.00 177.43 177.77 1tg1 n THR 112 N -2.64 0.65 -1.72 6.14 -2.24 -0.74 -5.04 114.28 108.69 1tg1 n THR 112 Ca -0.01 -0.83 -0.43 0.00 -2.27 0.00 0.00 64.05 60.52 1tg1 n THR 112 Cb 0.14 0.67 -0.02 0.00 -2.10 0.00 0.00 70.33 69.03 1tg1 n THR 112 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tg1 n TYR 113 N -0.32 2.59 -4.02 4.78 4.19 -0.91 -4.95 117.16 118.52 1tg1 n TYR 113 Ca 0.00 0.31 -0.27 0.00 3.31 0.00 0.00 57.90 61.24 1tg1 n TYR 113 Cb 0.16 -2.55 -0.17 0.00 0.49 0.00 0.00 39.34 37.27 1tg1 n TYR 113 CO 0.00 0.00 0.00 -1.12 0.91 0.00 0.00 176.86 176.65 1tg1 s SER 114 N 0.47 2.23 0.63 2.98 0.01 -1.26 -5.01 113.70 113.74 1tg1 s SER 114 Ca 0.66 -0.34 0.36 0.00 1.31 0.00 0.00 55.95 57.94 1tg1 s SER 114 Cb -0.55 -0.91 2.04 0.00 0.21 0.00 0.00 66.02 66.81 1tg1 s SER 114 CO 0.48 -0.09 2.25 0.11 0.41 0.00 0.00 173.24 176.41 1tg1 h LYS 115 N 7.99 0.00 0.00 12.44 1.57 -1.99 -1.73 116.57 134.84 1tg1 h LYS 115 Ca -0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 1tg1 h LYS 115 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1tg1 h LYS 115 CO 0.44 0.00 0.00 0.36 -0.57 0.00 0.00 179.45 179.68 1tg1 n LYS 116 N -3.44 0.17 0.00 3.15 2.85 -1.26 -1.61 118.16 118.02 1tg1 n LYS 116 Ca -0.02 0.55 0.13 0.00 -1.05 0.00 0.00 58.31 57.92 1tg1 n LYS 116 Cb 0.14 -1.94 0.32 0.00 -0.65 0.00 0.00 35.03 32.90 1tg1 n LYS 116 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1tg1 n TYR 117 N -2.28 0.00 -2.30 5.58 4.01 -0.65 -4.81 117.16 116.71 1tg1 n TYR 117 Ca 0.00 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.34 1tg1 n TYR 117 Cb 0.12 -0.04 -0.03 0.00 -0.31 0.00 0.00 39.34 39.08 1tg1 n TYR 117 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 1tg1 s MET 118 N -2.23 4.50 -1.52 -0.72 -1.94 -0.63 -0.66 119.30 116.09 1tg1 s MET 118 Ca 0.29 2.01 -0.06 0.00 -1.71 0.00 0.00 55.69 56.22 1tg1 s MET 118 Cb 0.20 -3.13 0.01 0.00 2.01 0.00 0.00 34.83 33.92 1tg1 s MET 118 CO 0.42 0.01 0.64 1.28 -0.01 0.00 0.00 175.02 177.37 1tg1 n LEU 119 N 1.03 -2.62 -4.71 -0.03 4.77 -0.39 -4.90 117.00 110.15 1tg1 n LEU 119 Ca -0.00 -0.32 -0.42 0.00 -0.03 0.00 0.00 56.01 55.23 1tg1 n LEU 119 Cb 0.43 -2.89 -0.03 0.00 -2.33 0.00 0.00 43.42 38.60 1tg1 n LEU 119 CO 0.57 0.26 1.24 -0.47 -1.33 0.00 0.00 177.39 177.65 1tg1 s TYR 120 N -3.17 2.94 0.26 -1.77 5.04 -1.13 -4.93 117.35 114.59 1tg1 s TYR 120 Ca 0.34 0.58 -0.30 0.00 -2.44 0.00 0.00 57.07 55.26 1tg1 s TYR 120 Cb -0.15 -3.92 -0.10 0.00 0.35 0.00 0.00 41.96 38.14 1tg1 s TYR 120 CO 0.42 -3.45 1.32 -1.25 -1.34 0.00 0.00 175.55 171.25 1tg1 s PRO 121 N 1.45 4.37 0.29 4.97 0.05 -1.26 -4.86 135.00 140.01 1tg1 s PRO 121 Ca 0.70 2.14 0.03 0.00 0.05 0.00 0.00 61.00 63.92 1tg1 s PRO 121 Cb -0.43 -3.14 0.67 0.00 0.05 0.00 0.00 34.50 31.65 1tg1 s PRO 121 CO 0.31 -0.23 1.75 0.22 0.05 0.00 0.00 177.00 179.10 1tg1 h ASP 122 N 4.54 0.58 0.49 6.66 1.82 -1.94 -2.48 116.42 126.10 1tg1 h ASP 122 Ca -0.46 0.11 0.00 0.00 -0.39 0.00 0.00 57.03 56.29 1tg1 h ASP 122 Cb 1.22 0.02 0.00 0.00 0.68 0.00 0.00 39.33 41.25 1tg1 h ASP 122 CO 0.73 0.18 0.00 2.22 -1.61 0.00 0.00 179.24 180.76 1tg1 n PHE 124 N -4.87 0.73 1.57 0.28 -1.74 -1.26 -0.55 117.46 111.62 1tg1 n PHE 124 Ca 0.21 0.32 0.11 0.00 -0.56 0.00 0.00 57.45 57.52 1tg1 n PHE 124 Cb 0.55 -1.01 0.49 0.00 1.52 0.00 0.00 39.48 41.04 1tg1 n PHE 124 CO 0.00 0.00 0.00 1.28 -0.56 0.00 0.00 176.76 177.48 1tg1 n LEU 125 N -2.19 0.97 -4.04 5.98 4.77 -0.93 -4.58 117.00 116.98 1tg1 n LEU 125 Ca 0.01 -0.39 -0.32 0.00 -0.03 0.00 0.00 56.01 55.28 1tg1 n LEU 125 Cb 0.17 -0.05 -0.14 0.00 -2.33 0.00 0.00 43.42 41.07 1tg1 n LEU 125 CO 0.16 0.19 -0.23 0.00 -1.33 0.00 0.00 177.39 176.18 1tg1 s LYS 127 N 0.66 1.07 0.00 0.00 1.02 -1.26 -4.23 119.74 117.00 1tg1 s LYS 127 Ca 0.12 -0.58 0.00 0.00 0.02 0.00 0.00 55.97 55.53 1tg1 s LYS 127 Cb -0.21 -1.05 0.00 0.00 -0.52 0.00 0.00 37.83 36.04 1tg1 s LYS 127 CO -0.05 0.28 0.00 0.41 -0.92 0.00 0.00 175.35 175.07 1tg1 n GLY 128 N 2.48 2.38 3.85 -3.33 0.00 -1.26 -3.25 105.19 106.05 1tg1 n GLY 128 Ca -0.15 -1.67 -0.37 0.00 0.00 0.00 0.00 46.02 43.83 1tg1 n GLY 128 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tg1 s GLU 129 N -4.43 3.73 -0.15 1.61 2.02 -1.26 0.16 118.70 120.39 1tg1 s GLU 129 Ca 0.00 0.12 0.02 0.00 0.02 0.00 0.00 54.97 55.13 1tg1 s GLU 129 Cb 0.00 -3.23 0.01 0.00 0.10 0.00 0.00 34.13 31.02 1tg1 s GLU 129 CO 0.00 0.69 -0.20 -1.17 0.02 0.00 0.00 175.26 174.60 1tg1 s LEU 130 N -0.89 2.01 0.24 1.80 0.20 -1.26 -4.93 118.68 115.86 1tg1 s LEU 130 Ca 0.19 -0.58 -0.30 0.00 0.69 0.00 0.00 54.13 54.13 1tg1 s LEU 130 Cb -0.14 -1.37 -0.09 0.00 -0.43 0.00 0.00 46.19 44.16 1tg1 s LEU 130 CO 0.08 0.04 1.06 -0.54 -0.29 0.00 0.00 176.35 176.70 1tg1 s LYS 131 N 1.02 4.67 0.00 1.98 1.02 -1.26 -5.07 119.74 122.10 1tg1 s LYS 131 Ca -0.03 1.71 0.07 0.00 0.02 0.00 0.00 55.97 57.75 1tg1 s LYS 131 Cb -0.15 -3.23 0.44 0.00 -0.52 0.00 0.00 37.83 34.37 1tg1 s LYS 131 CO -0.05 0.24 0.89 0.00 -0.92 0.00 0.00 175.35 175.51