#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q81 h THR 11 N 0.00 0.46 0.00 8.89 2.02 -1.87 -3.29 112.91 119.13 1q81 h THR 11 Ca 0.00 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.04 1q81 h THR 11 Cb 0.00 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 1q81 h THR 11 CO 0.00 0.03 0.45 1.23 0.37 0.00 0.00 175.52 177.60 1q81 h GLY 12 N 0.23 0.00 1.64 2.16 0.00 -1.93 0.53 103.07 105.70 1q81 h GLY 12 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1q81 h GLY 12 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 176.54 175.58 1q81 n ARG 13 N -2.12 0.30 -0.02 4.80 1.85 -1.24 -2.56 116.66 117.68 1q81 n ARG 13 Ca -0.01 0.05 0.13 0.00 -1.00 0.00 0.00 57.85 57.03 1q81 n ARG 13 Cb 0.47 -1.50 0.34 0.00 -1.05 0.00 0.00 32.46 30.73 1q81 n ARG 13 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1q81 n PHE 14 N -1.32 0.04 -1.29 2.89 0.99 0.18 -5.05 117.46 113.91 1q81 n PHE 14 Ca 0.11 -0.02 0.00 0.00 -0.00 0.00 0.00 57.45 57.54 1q81 n PHE 14 Cb 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.69 1q81 n PHE 14 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1q81 n GLY 15 N 1.25 1.22 0.00 1.37 0.00 -1.06 -1.20 105.19 106.77 1q81 n GLY 15 Ca 0.17 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1q81 n GLY 15 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1q81 n PRO 16 N 5.76 0.98 -2.87 1.61 -0.04 -1.26 -4.90 135.00 134.29 1q81 n PRO 16 Ca 0.00 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.18 1q81 n PRO 16 Cb 0.00 -1.01 -0.02 0.00 -0.04 0.00 0.00 33.50 32.44 1q81 n PRO 16 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1q81 s ARG 17 N -2.00 3.63 0.00 0.54 0.52 -0.34 -4.60 118.95 116.69 1q81 s ARG 17 Ca 0.01 0.22 0.00 0.00 -0.52 0.00 0.00 55.73 55.44 1q81 s ARG 17 Cb 0.00 -2.44 0.00 0.00 0.52 0.00 0.00 34.95 33.03 1q81 s ARG 17 CO 0.01 -0.06 0.00 0.66 0.02 0.00 0.00 175.30 175.92 1q81 n TYR 18 N -1.71 0.00 0.00 -0.53 0.53 -1.26 -4.90 117.16 109.29 1q81 n TYR 18 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 1q81 n TYR 18 Cb 0.55 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.86 1q81 n TYR 18 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1q81 n GLY 19 N -1.20 1.74 0.06 2.72 0.00 -1.26 -4.48 105.19 102.76 1q81 n GLY 19 Ca 0.00 -1.82 -0.02 0.00 0.00 0.00 0.00 46.02 44.18 1q81 n GLY 19 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1q81 h LEU 20 N 0.00 -0.20 -0.69 0.99 3.38 -1.97 -2.66 115.31 114.15 1q81 h LEU 20 Ca 0.00 0.02 0.15 0.00 0.09 0.00 0.00 57.88 58.14 1q81 h LEU 20 Cb 0.00 0.08 -0.12 0.00 0.09 0.00 0.00 40.66 40.71 1q81 h LEU 20 CO 0.00 -0.07 0.04 0.11 0.09 0.00 0.00 178.44 178.62 1q81 h LYS 21 N -0.09 0.14 0.23 1.13 1.57 -1.99 0.14 116.57 117.71 1q81 h LYS 21 Ca 0.00 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1q81 h LYS 21 Cb 0.09 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1q81 h LYS 21 CO -0.04 0.09 -0.12 0.82 -0.57 0.00 0.00 179.45 179.64 1q81 h ILE 22 N 0.14 0.76 0.00 1.86 2.04 -1.78 -2.68 117.51 117.86 1q81 h ILE 22 Ca 0.38 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 66.13 1q81 h ILE 22 Cb 0.64 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 1q81 h ILE 22 CO -0.57 0.00 -0.51 0.08 0.00 0.00 0.00 178.15 177.14 1q81 h ARG 23 N -0.32 0.00 -0.43 2.37 0.11 -1.22 -2.89 114.38 112.00 1q81 h ARG 23 Ca -0.03 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 59.98 1q81 h ARG 23 Cb 0.25 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.32 1q81 h ARG 23 CO 0.05 0.51 -0.01 0.28 0.10 0.00 0.00 179.97 180.90 1q81 h VAL 24 N 0.00 1.26 0.00 0.08 2.07 -0.75 -0.90 116.25 118.02 1q81 h VAL 24 Ca -0.01 -1.05 -0.04 0.00 0.82 0.00 0.00 66.70 66.42 1q81 h VAL 24 Cb 1.35 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.21 1q81 h VAL 24 CO 0.07 0.36 -0.21 0.03 0.02 0.00 0.00 177.57 177.84 1q81 h ARG 25 N 0.60 0.00 -0.04 1.57 3.08 -1.51 -0.24 114.38 117.84 1q81 h ARG 25 Ca 0.12 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.99 1q81 h ARG 25 Cb 0.51 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.57 1q81 h ARG 25 CO 0.02 0.21 -0.68 0.28 -1.07 0.00 0.00 179.97 178.74 1q81 h VAL 26 N 0.00 1.37 0.01 2.04 2.07 -1.21 -1.48 116.25 119.05 1q81 h VAL 26 Ca -0.00 -2.04 -0.00 0.00 0.82 0.00 0.00 66.70 65.48 1q81 h VAL 26 Cb 0.63 2.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1q81 h VAL 26 CO 0.03 0.61 -0.01 0.00 0.02 0.00 0.00 177.57 178.22 1q81 h ALA 27 N 0.39 -0.02 0.21 1.67 0.00 -0.96 -1.68 119.26 118.88 1q81 h ALA 27 Ca -0.07 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1q81 h ALA 27 Cb 1.35 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 1q81 h ALA 27 CO 0.14 -0.33 -0.52 -0.44 0.00 0.00 0.00 179.25 178.10 1q81 h ASP 28 N -0.38 -1.52 -0.27 0.00 5.19 -1.12 0.54 116.42 118.85 1q81 h ASP 28 Ca -0.00 0.15 0.04 0.00 -0.62 0.00 0.00 57.03 56.60 1q81 h ASP 28 Cb 0.37 0.55 -0.04 0.00 0.18 0.00 0.00 39.33 40.40 1q81 h ASP 28 CO 0.00 -0.58 0.04 0.58 -3.12 0.00 0.00 179.24 176.16 1q81 h VAL 29 N -0.81 0.85 0.00 -1.35 2.07 -1.33 -2.37 116.25 113.32 1q81 h VAL 29 Ca -0.02 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1q81 h VAL 29 Cb 0.78 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1q81 h VAL 29 CO -0.24 0.02 0.00 -0.62 0.02 0.00 0.00 177.57 176.76 1q81 n GLU 30 N -5.10 0.20 0.02 1.57 1.02 -0.63 0.12 120.64 117.83 1q81 n GLU 30 Ca -0.01 0.30 -0.19 0.00 -0.02 0.00 0.00 57.16 57.25 1q81 n GLU 30 Cb 0.12 -1.79 -0.14 0.00 -0.02 0.00 0.00 31.44 29.61 1q81 n GLU 30 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1q81 h ILE 31 N 0.00 1.59 -0.36 -3.67 2.10 0.57 -0.99 117.51 116.75 1q81 h ILE 31 Ca 0.00 -2.49 -0.04 0.00 1.08 0.00 0.00 64.86 63.40 1q81 h ILE 31 Cb 0.52 3.26 -0.01 0.00 -1.09 0.00 0.00 36.82 39.49 1q81 h ILE 31 CO 0.00 0.69 0.06 0.11 -1.08 0.00 0.00 178.15 177.93 1q81 h LYS 32 N -0.53 0.59 -0.67 2.19 1.57 -1.36 -1.32 116.57 117.05 1q81 h LYS 32 Ca -0.11 -0.16 0.14 0.00 -1.87 0.00 0.00 60.65 58.66 1q81 h LYS 32 Cb 1.48 -0.07 -0.11 0.00 0.08 0.00 0.00 32.23 33.61 1q81 h LYS 32 CO 0.11 0.67 0.01 1.25 -0.57 0.00 0.00 179.45 180.92 1q81 h HIS 33 N 0.43 -0.03 -0.01 -1.35 2.76 -0.38 -1.86 115.15 114.71 1q81 h HIS 33 Ca 0.11 0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 1q81 h HIS 33 Cb 0.36 0.12 0.00 0.00 1.55 0.00 0.00 27.41 29.44 1q81 h HIS 33 CO 0.02 -0.19 -0.04 1.63 -1.30 0.00 0.00 177.93 178.06 1q81 n LYS 34 N -5.30 1.50 -0.86 5.26 5.02 -0.38 -4.80 118.16 118.61 1q81 n LYS 34 Ca 0.11 -0.85 -0.30 0.00 -2.02 0.00 0.00 58.31 55.25 1q81 n LYS 34 Cb 0.40 -1.48 0.18 0.00 -0.02 0.00 0.00 35.03 34.10 1q81 n LYS 34 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1q81 s LYS 35 N -2.08 0.65 -0.05 1.97 1.02 -0.53 -4.96 119.74 115.76 1q81 s LYS 35 Ca 0.36 1.10 -0.30 0.00 0.02 0.00 0.00 55.97 57.15 1q81 s LYS 35 Cb 0.21 -1.72 -0.04 0.00 -0.52 0.00 0.00 37.83 35.76 1q81 s LYS 35 CO 0.37 -2.74 1.25 0.15 -0.92 0.00 0.00 175.35 173.45 1q81 s LYS 36 N -4.70 4.33 -0.11 1.68 1.02 -1.26 -4.96 119.74 115.74 1q81 s LYS 36 Ca 0.66 1.74 -0.00 0.00 0.02 0.00 0.00 55.97 58.38 1q81 s LYS 36 Cb -0.21 -3.57 -0.02 0.00 -0.52 0.00 0.00 37.83 33.50 1q81 s LYS 36 CO 0.59 -0.48 -0.09 -1.01 -0.92 0.00 0.00 175.35 173.43 1q81 s HIS 37 N 2.30 2.88 -0.38 3.18 3.76 -1.24 -4.99 115.29 120.80 1q81 s HIS 37 Ca 0.58 -0.32 -0.29 0.00 -0.15 0.00 0.00 55.06 54.88 1q81 s HIS 37 Cb -0.26 -1.80 0.02 0.00 1.11 0.00 0.00 32.58 31.64 1q81 s HIS 37 CO 0.23 0.03 1.20 0.15 -0.85 0.00 0.00 174.74 175.49 1q81 s LYS 38 N -0.10 3.86 0.37 1.40 1.02 -1.26 -1.60 119.74 123.42 1q81 s LYS 38 Ca -0.00 0.94 -0.28 0.00 0.02 0.00 0.00 55.97 56.65 1q81 s LYS 38 Cb -0.13 -3.87 -0.10 0.00 -0.52 0.00 0.00 37.83 33.21 1q81 s LYS 38 CO 0.03 -1.20 1.40 0.00 -0.92 0.00 0.00 175.35 174.66 1q81 h PRO 40 N 3.05 -0.53 0.00 0.00 0.11 -1.95 -3.33 132.00 129.35 1q81 h PRO 40 Ca -0.50 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1q81 h PRO 40 Cb 1.24 0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.47 1q81 h PRO 40 CO 0.64 -0.32 0.00 0.28 -0.21 0.00 0.00 178.00 178.39 1q81 n VAL 41 N -5.30 0.00 -0.17 3.15 0.31 -1.26 -4.73 118.33 110.33 1q81 n VAL 41 Ca -0.11 1.49 0.00 0.00 -0.01 0.00 0.00 64.34 65.71 1q81 n VAL 41 Cb 0.25 -2.32 0.00 0.00 -0.91 0.00 0.00 33.84 30.86 1q81 n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1q81 n GLY 43 N 5.00 0.94 3.77 0.00 0.00 -1.25 -4.72 105.19 108.93 1q81 n GLY 43 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1q81 n GLY 43 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1q81 s PHE 44 N -0.54 2.42 -0.32 1.61 0.40 -1.26 -4.27 117.98 116.02 1q81 s PHE 44 Ca 0.00 1.25 -0.05 0.00 -0.60 0.00 0.00 56.93 57.53 1q81 s PHE 44 Cb 0.00 -3.94 -0.10 0.00 0.51 0.00 0.00 43.02 39.50 1q81 s PHE 44 CO 0.00 -3.01 3.16 1.63 0.70 0.00 0.00 175.22 177.70 1q81 n LYS 45 N -0.25 2.35 -1.95 0.44 5.02 -1.25 0.67 118.16 123.19 1q81 n LYS 45 Ca 0.05 -1.76 -0.27 0.00 -2.02 0.00 0.00 58.31 54.31 1q81 n LYS 45 Cb 0.42 -2.12 0.03 0.00 -0.02 0.00 0.00 35.03 33.34 1q81 n LYS 45 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1q81 n LYS 46 N 1.76 3.39 -3.67 1.97 5.02 -0.87 -3.91 118.16 121.85 1q81 n LYS 46 Ca 0.48 -4.03 -0.36 0.00 -2.02 0.00 0.00 58.31 52.38 1q81 n LYS 46 Cb 0.70 -2.28 -0.09 0.00 -0.02 0.00 0.00 35.03 33.34 1q81 n LYS 46 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1q81 s LEU 47 N -3.65 4.14 0.06 -0.35 1.43 -0.63 0.45 118.68 120.13 1q81 s LEU 47 Ca 0.53 0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.83 1q81 s LEU 47 Cb 0.43 -2.12 -0.03 0.00 0.03 0.00 0.00 46.19 44.50 1q81 s LEU 47 CO -0.02 0.09 -0.11 -0.54 0.23 0.00 0.00 176.35 176.00 1q81 s LYS 48 N 0.87 0.69 -0.01 1.70 1.02 0.14 -3.73 119.74 120.41 1q81 s LYS 48 Ca 0.08 -0.88 -0.30 0.00 0.02 0.00 0.00 55.97 54.89 1q81 s LYS 48 Cb -0.13 -0.56 -0.04 0.00 -0.52 0.00 0.00 37.83 36.58 1q81 s LYS 48 CO 0.03 0.12 1.19 0.50 -0.92 0.00 0.00 175.35 176.26 1q81 s ARG 49 N -1.73 4.39 0.03 1.68 3.52 -1.26 -1.35 118.95 124.23 1q81 s ARG 49 Ca -0.05 1.69 0.15 0.00 -0.13 0.00 0.00 55.73 57.40 1q81 s ARG 49 Cb -0.10 -3.48 -0.17 0.00 -1.56 0.00 0.00 34.95 29.65 1q81 s ARG 49 CO 0.01 -0.36 0.77 0.00 -0.81 0.00 0.00 175.30 174.91 1q81 n ALA 50 N 4.69 1.79 -3.00 6.12 0.00 0.48 -4.95 120.51 125.63 1q81 n ALA 50 Ca 0.10 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1q81 n ALA 50 Cb 0.47 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1q81 n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q81 n GLY 51 N 1.45 0.65 3.56 0.00 0.00 -1.13 -4.97 105.19 104.75 1q81 n GLY 51 Ca -0.12 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 1q81 n GLY 51 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1q81 n THR 52 N 0.00 0.20 -1.04 2.61 -1.04 -1.26 -1.72 114.28 112.03 1q81 n THR 52 Ca 0.00 -0.52 -0.01 0.00 -2.04 0.00 0.00 64.05 61.48 1q81 n THR 52 Cb 0.00 -2.46 -0.01 0.00 -1.82 0.00 0.00 70.33 66.04 1q81 n THR 52 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1q81 n GLY 53 N 5.97 0.46 3.29 3.41 0.00 -1.21 -4.98 105.19 112.12 1q81 n GLY 53 Ca 0.34 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1q81 n GLY 53 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q81 s ILE 54 N -1.80 2.87 0.19 -0.61 1.01 -0.70 -2.93 121.20 119.24 1q81 s ILE 54 Ca 0.00 -0.70 0.09 0.00 0.00 0.00 0.00 60.65 60.05 1q81 s ILE 54 Cb 0.00 -2.23 -0.04 0.00 0.01 0.00 0.00 42.46 40.20 1q81 s ILE 54 CO 0.00 0.50 -0.19 0.26 0.00 0.00 0.00 174.94 175.51 1q81 s TRP 55 N 0.87 1.95 0.18 3.97 0.52 -0.77 0.18 118.94 125.84 1q81 s TRP 55 Ca -0.04 -0.45 -0.14 0.00 0.02 0.00 0.00 56.10 55.50 1q81 s TRP 55 Cb -0.15 -0.94 0.01 0.00 -1.15 0.00 0.00 33.47 31.24 1q81 s TRP 55 CO -0.00 0.42 0.42 1.41 0.02 0.00 0.00 176.95 179.21 1q81 s MET 56 N -3.00 1.28 -0.18 4.98 1.75 -0.45 0.15 119.30 123.83 1q81 s MET 56 Ca 0.20 -1.00 -0.01 0.00 -1.25 0.00 0.00 55.69 53.63 1q81 s MET 56 Cb -0.05 0.46 0.00 0.00 2.84 0.00 0.00 34.83 38.08 1q81 s MET 56 CO 0.08 -0.51 -0.14 0.00 -0.65 0.00 0.00 175.02 173.80 1q81 h GLY 58 N 7.67 0.00 0.39 0.00 0.00 -0.37 0.41 103.07 111.17 1q81 h GLY 58 Ca -0.38 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 1q81 h GLY 58 CO 0.60 0.00 -0.19 0.84 0.00 0.00 0.00 176.54 177.79 1q81 h HIS 59 N 0.00 -0.49 -0.02 5.60 6.17 -1.94 -3.38 115.15 121.09 1q81 h HIS 59 Ca -0.00 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.07 1q81 h HIS 59 Cb 0.25 0.16 0.00 0.00 2.52 0.00 0.00 27.41 30.34 1q81 h HIS 59 CO 0.00 -0.30 0.00 0.00 0.71 0.00 0.00 177.93 178.34 1q81 n GLY 61 N 0.64 1.49 3.52 0.00 0.00 0.14 -4.98 105.19 106.00 1q81 n GLY 61 Ca 0.07 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.62 1q81 n GLY 61 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1q81 n TYR 62 N -2.00 1.72 -3.27 1.61 9.36 -1.25 -4.53 117.16 118.80 1q81 n TYR 62 Ca 0.00 0.10 -0.39 0.00 3.32 0.00 0.00 57.90 60.93 1q81 n TYR 62 Cb 0.00 -2.62 -0.07 0.00 -0.63 0.00 0.00 39.34 36.02 1q81 n TYR 62 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 1q81 s LYS 63 N 6.46 4.19 0.34 2.98 2.20 -1.26 -1.99 119.74 132.66 1q81 s LYS 63 Ca 1.06 0.38 0.08 0.00 -0.36 0.00 0.00 55.97 57.13 1q81 s LYS 63 Cb -0.60 -3.56 -0.07 0.00 -1.51 0.00 0.00 37.83 32.09 1q81 s LYS 63 CO 0.42 -0.13 -0.07 0.96 -0.36 0.00 0.00 175.35 176.17 1q81 s ILE 64 N 1.59 2.03 -0.32 5.43 -4.36 0.40 -4.95 121.20 121.02 1q81 s ILE 64 Ca 0.23 -2.15 -0.09 0.00 -0.26 0.00 0.00 60.65 58.38 1q81 s ILE 64 Cb -0.15 -2.65 0.01 0.00 1.25 0.00 0.00 42.46 40.91 1q81 s ILE 64 CO 0.09 -0.19 0.13 0.00 0.24 0.00 0.00 174.94 175.22 1q81 s ALA 65 N -2.74 3.19 0.00 2.27 0.00 -1.26 -1.85 121.76 121.37 1q81 s ALA 65 Ca 0.32 -1.48 0.00 0.00 0.00 0.00 0.00 51.96 50.81 1q81 s ALA 65 Cb 0.04 -2.33 0.00 0.00 0.00 0.00 0.00 23.12 20.83 1q81 s ALA 65 CO 0.16 -1.00 0.00 0.41 0.00 0.00 0.00 175.76 175.33 1q81 n GLY 66 N 4.94 5.39 3.42 0.00 0.00 -1.15 -5.01 105.19 112.79 1q81 n GLY 66 Ca -0.14 -1.30 -0.31 0.00 0.00 0.00 0.00 46.02 44.28 1q81 n GLY 66 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1q81 s GLY 67 N 0.00 1.49 -0.02 -0.02 0.00 0.89 -4.76 107.32 104.89 1q81 s GLY 67 Ca 0.00 -0.97 -0.21 0.00 0.00 0.00 0.00 44.72 43.54 1q81 s GLY 67 CO 0.00 0.02 1.03 0.00 0.00 0.00 0.00 173.10 174.16 1q81 n TYR 69 N -4.27 0.00 -4.29 0.00 4.02 -1.26 -3.33 117.16 108.03 1q81 n TYR 69 Ca -0.11 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.59 1q81 n TYR 69 Cb 0.66 0.00 -0.13 0.00 -0.02 0.00 0.00 39.34 39.85 1q81 n TYR 69 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 1q81 s GLN 70 N -1.28 0.83 0.46 -0.72 -0.21 -1.26 -3.73 119.66 113.75 1q81 s GLN 70 Ca 0.03 -0.72 0.26 0.00 0.02 0.00 0.00 55.36 54.94 1q81 s GLN 70 Cb 0.04 -0.80 0.95 0.00 1.00 0.00 0.00 33.01 34.19 1q81 s GLN 70 CO 0.18 0.20 1.83 -1.00 -2.12 0.00 0.00 175.29 174.38 1q81 h PRO 71 N 4.92 0.00 -5.41 2.91 0.13 -1.93 0.25 132.00 132.87 1q81 h PRO 71 Ca -0.37 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.25 1q81 h PRO 71 Cb 1.18 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.02 1q81 h PRO 71 CO 0.44 0.16 -0.82 -1.21 -0.23 0.00 0.00 178.00 176.33 1q81 s GLU 72 N -3.58 1.29 0.15 0.86 2.02 -1.26 -2.99 118.70 115.19 1q81 s GLU 72 Ca 0.01 -0.55 0.08 0.00 0.02 0.00 0.00 54.97 54.54 1q81 s GLU 72 Cb 0.09 -1.24 -0.04 0.00 0.10 0.00 0.00 34.13 33.05 1q81 s GLU 72 CO 0.62 0.32 -0.12 0.95 0.02 0.00 0.00 175.26 177.05 1q81 s THR 73 N -0.31 3.14 0.37 3.63 -4.23 -1.26 -4.73 115.64 112.25 1q81 s THR 73 Ca 0.05 -1.52 0.15 0.00 -1.18 0.00 0.00 61.69 59.19 1q81 s THR 73 Cb -0.07 -2.51 0.36 0.00 1.34 0.00 0.00 72.50 71.63 1q81 s THR 73 CO -0.00 -0.00 1.75 0.58 -0.54 0.00 0.00 174.62 176.40 1q81 h VAL 74 N 3.08 0.51 0.00 2.29 2.07 -2.01 0.24 116.25 122.44 1q81 h VAL 74 Ca -0.48 -0.16 -0.06 0.00 0.82 0.00 0.00 66.70 66.82 1q81 h VAL 74 Cb 1.19 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1q81 h VAL 74 CO 0.52 0.08 -0.30 0.00 0.02 0.00 0.00 177.57 177.88 1q81 h ALA 75 N 1.67 0.83 -0.10 1.67 0.00 -2.00 -2.99 119.26 118.33 1q81 h ALA 75 Ca 0.62 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 55.13 1q81 h ALA 75 Cb 1.44 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1q81 h ALA 75 CO -0.37 0.38 -0.51 0.78 0.00 0.00 0.00 179.25 179.52 1q81 h GLY 76 N 3.40 0.31 1.31 0.00 0.00 -0.92 -3.15 103.07 104.02 1q81 h GLY 76 Ca -0.00 -0.34 -0.21 0.00 0.00 0.00 0.00 47.33 46.78 1q81 h GLY 76 CO 0.04 0.31 -0.73 0.50 0.00 0.00 0.00 176.54 176.66 1q81 h LYS 77 N 0.22 0.68 0.00 4.80 1.57 -1.40 -2.98 116.57 119.47 1q81 h LYS 77 Ca 0.01 -0.54 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 1q81 h LYS 77 Cb 0.98 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1q81 h LYS 77 CO 0.08 1.15 0.00 0.00 -0.57 0.00 0.00 179.45 180.12 1q81 h ALA 78 N 0.70 1.00 0.17 3.86 0.00 -1.49 -2.42 119.26 121.08 1q81 h ALA 78 Ca -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1q81 h ALA 78 Cb 1.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1q81 h ALA 78 CO 0.14 0.00 -0.08 0.28 0.00 0.00 0.00 179.25 179.59 1q81 h VAL 79 N 0.00 0.86 -0.81 0.00 2.07 -1.51 -3.10 116.25 113.75 1q81 h VAL 79 Ca 0.00 -1.07 0.15 0.00 0.82 0.00 0.00 66.70 66.59 1q81 h VAL 79 Cb 0.12 1.42 -0.15 0.00 -1.52 0.00 0.00 31.29 31.16 1q81 h VAL 79 CO 0.00 0.21 -0.30 0.24 0.02 0.00 0.00 177.57 177.75 1q81 h MET 80 N -0.83 -0.05 0.00 1.57 2.07 -1.48 -3.11 114.93 113.09 1q81 h MET 80 Ca -0.02 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.61 1q81 h MET 80 Cb 0.52 0.01 0.00 0.00 -1.87 0.00 0.00 31.60 30.27 1q81 h MET 80 CO 0.04 -0.03 0.00 1.63 1.07 0.00 0.00 176.91 179.62 1q81 n LYS 81 N -5.49 0.00 0.00 1.72 5.02 -1.22 -5.16 118.16 113.02 1q81 n LYS 81 Ca 0.09 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 1q81 n LYS 81 Cb 0.40 -0.76 0.00 0.00 -0.02 0.00 0.00 35.03 34.65 1q81 n LYS 81 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88