#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tl4 n PRO 2 N 0.00 0.61 -3.83 2.12 -0.04 -1.26 -3.86 135.00 128.73 1tl4 n PRO 2 Ca 0.00 -1.36 -0.12 0.00 -0.04 0.00 0.00 63.50 61.97 1tl4 n PRO 2 Cb 0.00 -2.71 -0.12 0.00 -0.04 0.00 0.00 33.50 30.63 1tl4 n PRO 2 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1tl4 s LYS 3 N 6.25 0.28 -0.22 0.54 2.20 -1.26 -1.11 119.74 126.42 1tl4 s LYS 3 Ca 0.65 0.05 -0.14 0.00 -0.36 0.00 0.00 55.97 56.16 1tl4 s LYS 3 Cb 0.14 0.13 0.06 0.00 -1.51 0.00 0.00 37.83 36.65 1tl4 s LYS 3 CO 0.25 -0.05 0.54 -1.01 -0.36 0.00 0.00 175.35 174.73 1tl4 s HIS 4 N -0.34 -0.75 0.05 4.03 3.76 0.20 -0.55 115.29 121.69 1tl4 s HIS 4 Ca -0.04 1.62 -0.18 0.00 -0.15 0.00 0.00 55.06 56.31 1tl4 s HIS 4 Cb -0.03 0.37 -0.06 0.00 1.11 0.00 0.00 32.58 33.97 1tl4 s HIS 4 CO 0.01 -0.39 0.52 -2.00 -0.85 0.00 0.00 174.74 172.02 1tl4 s GLU 5 N 1.15 4.10 -0.13 1.40 2.12 -1.23 -0.49 118.70 125.63 1tl4 s GLU 5 Ca -0.07 0.62 0.01 0.00 0.36 0.00 0.00 54.97 55.89 1tl4 s GLU 5 Cb -0.06 -3.22 0.02 0.00 0.26 0.00 0.00 34.13 31.13 1tl4 s GLU 5 CO -0.11 0.65 -0.15 -0.06 -0.54 0.00 0.00 175.26 175.05 1tl4 s PHE 6 N -1.11 2.07 -0.16 5.30 0.40 0.25 -0.45 117.98 124.28 1tl4 s PHE 6 Ca 0.28 -1.07 -0.28 0.00 -0.60 0.00 0.00 56.93 55.25 1tl4 s PHE 6 Cb -0.18 -1.51 -0.01 0.00 0.51 0.00 0.00 43.02 41.83 1tl4 s PHE 6 CO 0.17 -0.57 0.97 0.45 0.70 0.00 0.00 175.22 176.94 1tl4 s SER 7 N 1.23 7.12 -0.08 1.36 0.15 0.64 -0.30 113.70 123.82 1tl4 s SER 7 Ca -0.01 1.39 -0.01 0.00 0.70 0.00 0.00 55.95 58.02 1tl4 s SER 7 Cb -0.14 -2.53 -0.03 0.00 -1.71 0.00 0.00 66.02 61.61 1tl4 s SER 7 CO -0.06 -0.51 -0.02 -0.69 1.20 0.00 0.00 173.24 173.17 1tl4 s VAL 8 N 2.44 4.16 -1.19 4.45 1.01 -0.34 -0.24 120.40 130.69 1tl4 s VAL 8 Ca 0.44 -0.30 -0.19 0.00 0.00 0.00 0.00 61.98 61.93 1tl4 s VAL 8 Cb -0.17 -2.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 1tl4 s VAL 8 CO 0.13 0.60 1.94 -0.67 0.00 0.00 0.00 175.10 177.10 1tl4 n ASP 9 N 2.18 3.68 -4.56 3.32 -0.08 -1.25 -4.39 116.55 115.44 1tl4 n ASP 9 Ca -0.18 -2.79 -0.35 0.00 -1.51 0.00 0.00 54.79 49.95 1tl4 n ASP 9 Cb 0.53 -1.59 -0.04 0.00 2.34 0.00 0.00 41.12 42.37 1tl4 n ASP 9 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 1tl4 s MET 10 N 4.75 3.20 0.31 -0.67 -1.94 -1.26 -4.72 119.30 118.98 1tl4 s MET 10 Ca 0.57 -0.91 0.16 0.00 -1.71 0.00 0.00 55.69 53.80 1tl4 s MET 10 Cb 0.07 -5.27 0.37 0.00 2.01 0.00 0.00 34.83 32.02 1tl4 s MET 10 CO 0.07 -2.72 1.59 1.79 -0.01 0.00 0.00 175.02 175.74 1tl4 h THR 11 N 6.82 0.97 -3.21 2.05 1.35 -1.98 -3.47 112.91 115.45 1tl4 h THR 11 Ca 0.19 -1.96 -0.03 0.00 -0.55 0.00 0.00 66.41 64.05 1tl4 h THR 11 Cb 0.99 2.19 -0.12 0.00 -1.73 0.00 0.00 68.15 69.48 1tl4 h THR 11 CO 1.34 0.48 0.06 0.00 -0.25 0.00 0.00 175.52 177.15 1tl4 h GLY 13 N 2.19 1.65 1.92 0.00 0.00 -2.01 -0.58 103.07 106.24 1tl4 h GLY 13 Ca -0.34 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.99 1tl4 h GLY 13 CO 0.42 -0.58 0.04 -1.33 0.00 0.00 0.00 176.54 175.09 1tl4 h GLY 14 N 0.07 0.00 0.82 4.60 0.00 -1.99 0.70 103.07 107.26 1tl4 h GLY 14 Ca 0.68 0.00 0.08 0.00 0.00 0.00 0.00 47.33 48.09 1tl4 h GLY 14 CO -0.80 0.00 0.57 0.00 0.00 0.00 0.00 176.54 176.31 1tl4 h ALA 16 N 1.54 -0.02 0.11 0.00 0.00 -1.05 0.55 119.26 120.39 1tl4 h ALA 16 Ca 0.39 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.32 1tl4 h ALA 16 Cb 0.29 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 1tl4 h ALA 16 CO -0.15 -0.51 -0.42 0.93 0.00 0.00 0.00 179.25 179.10 1tl4 h GLU 17 N -0.02 -0.62 -0.31 0.00 5.08 -1.50 0.46 114.58 117.67 1tl4 h GLU 17 Ca -0.00 0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.47 1tl4 h GLU 17 Cb 0.02 0.14 -0.08 0.00 0.50 0.00 0.00 28.75 29.33 1tl4 h GLU 17 CO 0.00 -0.42 -0.29 0.00 -1.00 0.00 0.00 179.01 177.30 1tl4 h ALA 18 N -0.17 -0.17 0.12 3.43 0.00 -0.52 0.14 119.26 122.09 1tl4 h ALA 18 Ca 0.02 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1tl4 h ALA 18 Cb 0.68 0.62 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1tl4 h ALA 18 CO -0.25 -0.71 -0.06 0.28 0.00 0.00 0.00 179.25 178.51 1tl4 h VAL 19 N -0.27 0.95 -0.61 0.00 2.07 -0.76 0.18 116.25 117.81 1tl4 h VAL 19 Ca 0.15 -0.30 0.11 0.00 0.82 0.00 0.00 66.70 67.49 1tl4 h VAL 19 Cb 0.51 1.14 -0.09 0.00 -1.52 0.00 0.00 31.29 31.34 1tl4 h VAL 19 CO -0.46 0.07 0.15 -1.28 0.02 0.00 0.00 177.57 176.06 1tl4 h SER 20 N -0.30 0.04 0.25 0.57 0.87 -0.14 0.17 113.55 115.02 1tl4 h SER 20 Ca -0.02 0.11 0.01 0.00 -1.23 0.00 0.00 61.79 60.66 1tl4 h SER 20 Cb 0.24 0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.32 1tl4 h SER 20 CO 0.03 0.02 -0.31 -0.09 -0.53 0.00 0.00 176.83 175.95 1tl4 h ARG 21 N 0.28 -0.60 -0.69 2.24 2.43 -0.61 0.54 114.38 117.98 1tl4 h ARG 21 Ca 0.32 0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.55 1tl4 h ARG 21 Cb 0.47 0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 30.12 1tl4 h ARG 21 CO -0.39 -0.40 0.44 -0.24 -1.51 0.00 0.00 179.97 177.87 1tl4 h VAL 22 N -0.62 1.13 0.02 0.20 3.04 0.36 -0.57 116.25 119.80 1tl4 h VAL 22 Ca -0.00 -0.30 -0.21 0.00 -1.01 0.00 0.00 66.70 65.18 1tl4 h VAL 22 Cb 0.59 0.17 -0.02 0.00 -2.01 0.00 0.00 31.29 30.02 1tl4 h VAL 22 CO -0.10 0.16 -0.97 -0.07 -1.01 0.00 0.00 177.57 175.58 1tl4 h LEU 23 N 0.88 0.16 -0.94 3.16 3.38 -0.66 -2.65 115.31 118.63 1tl4 h LEU 23 Ca 0.27 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1tl4 h LEU 23 Cb -0.03 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 1tl4 h LEU 23 CO -0.09 1.03 0.50 -1.13 0.09 0.00 0.00 178.44 178.84 1tl4 h ASN 24 N 0.05 1.10 -0.60 -0.43 -0.00 0.58 0.51 115.58 116.79 1tl4 h ASN 24 Ca -0.04 -0.09 0.12 0.00 -0.00 0.00 0.00 56.30 56.28 1tl4 h ASN 24 Cb 1.66 -0.28 -0.03 0.00 -0.00 0.00 0.00 38.32 39.67 1tl4 h ASN 24 CO 0.14 0.88 0.41 0.50 -0.00 0.00 0.00 177.43 179.36 1tl4 h LYS 25 N 1.24 0.30 0.59 6.67 3.11 -0.80 0.42 116.57 128.10 1tl4 h LYS 25 Ca 0.31 -0.02 -0.03 0.00 -2.81 0.00 0.00 60.65 58.11 1tl4 h LYS 25 Cb 0.01 -0.07 0.01 0.00 -1.00 0.00 0.00 32.23 31.18 1tl4 h LYS 25 CO -0.05 0.20 -0.29 1.25 -2.81 0.00 0.00 179.45 177.75 1tl4 h LEU 26 N 0.31 -0.67 0.00 5.20 7.12 -0.66 -3.48 115.31 123.12 1tl4 h LEU 26 Ca 0.28 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.29 1tl4 h LEU 26 Cb 0.70 0.17 0.00 0.00 -0.53 0.00 0.00 40.66 41.00 1tl4 h LEU 26 CO -0.07 -0.44 0.00 0.61 -0.13 0.00 0.00 178.44 178.41 1tl4 n GLY 27 N -1.27 1.87 2.45 3.75 0.00 0.13 -4.83 105.19 107.28 1tl4 n GLY 27 Ca -0.13 -0.61 -0.32 0.00 0.00 0.00 0.00 46.02 44.96 1tl4 n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tl4 n GLY 28 N 0.00 3.76 3.04 -0.02 0.00 -1.26 -4.80 105.19 105.91 1tl4 n GLY 28 Ca 0.00 -1.22 -0.09 0.00 0.00 0.00 0.00 46.02 44.71 1tl4 n GLY 28 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1tl4 s VAL 29 N 2.73 0.24 0.10 1.61 -7.23 -1.26 -4.49 120.40 112.10 1tl4 s VAL 29 Ca 0.57 -1.34 0.09 0.00 -1.81 0.00 0.00 61.98 59.49 1tl4 s VAL 29 Cb 0.15 -0.88 -0.04 0.00 0.56 0.00 0.00 36.38 36.17 1tl4 s VAL 29 CO -0.05 -0.70 -0.23 -0.75 -0.31 0.00 0.00 175.10 173.06 1tl4 s LYS 30 N -2.57 1.69 -0.01 4.82 2.36 -0.02 -5.01 119.74 120.99 1tl4 s LYS 30 Ca -0.05 -1.20 0.02 0.00 -2.55 0.00 0.00 55.97 52.19 1tl4 s LYS 30 Cb -0.02 -2.03 0.00 0.00 -1.05 0.00 0.00 37.83 34.73 1tl4 s LYS 30 CO -0.05 0.48 -0.05 1.52 1.55 0.00 0.00 175.35 178.80 1tl4 s TYR 31 N -1.03 0.54 0.12 4.03 -0.85 -1.26 -0.41 117.35 118.49 1tl4 s TYR 31 Ca 0.15 -0.11 0.03 0.00 -0.52 0.00 0.00 57.07 56.62 1tl4 s TYR 31 Cb -0.10 -0.38 -0.04 0.00 0.38 0.00 0.00 41.96 41.82 1tl4 s TYR 31 CO 0.07 -0.04 0.17 0.34 -1.52 0.00 0.00 175.55 174.57 1tl4 s ASP 32 N 0.05 5.86 -0.06 -0.18 2.15 0.10 -4.96 116.67 119.64 1tl4 s ASP 32 Ca -0.00 0.04 -0.02 0.00 0.43 0.00 0.00 52.55 53.01 1tl4 s ASP 32 Cb -0.04 -1.65 0.03 0.00 -0.30 0.00 0.00 42.92 40.95 1tl4 s ASP 32 CO -0.00 0.11 0.02 -0.63 -0.17 0.00 0.00 175.17 174.50 1tl4 s ILE 33 N -1.61 0.18 -0.20 4.11 1.01 -1.26 -0.53 121.20 122.90 1tl4 s ILE 33 Ca 0.32 0.24 -0.00 0.00 0.00 0.00 0.00 60.65 61.21 1tl4 s ILE 33 Cb -0.11 -0.38 0.02 0.00 0.01 0.00 0.00 42.46 41.99 1tl4 s ILE 33 CO 0.25 0.23 -0.14 -0.62 0.00 0.00 0.00 174.94 174.66 1tl4 s ASP 34 N 2.04 3.65 -0.05 3.58 -1.08 0.25 -5.01 116.67 120.03 1tl4 s ASP 34 Ca 0.05 -0.69 -0.07 0.00 -0.52 0.00 0.00 52.55 51.32 1tl4 s ASP 34 Cb -0.12 -1.57 -0.04 0.00 -1.46 0.00 0.00 42.92 39.73 1tl4 s ASP 34 CO -0.04 -0.04 0.32 -0.07 0.52 0.00 0.00 175.17 175.86 1tl4 h LEU 35 N 7.97 -0.21 -1.44 -1.34 -0.00 -1.96 0.20 115.31 118.54 1tl4 h LEU 35 Ca -0.41 0.01 0.10 0.00 -0.00 0.00 0.00 57.88 57.58 1tl4 h LEU 35 Cb 1.13 0.05 -0.05 0.00 -0.00 0.00 0.00 40.66 41.80 1tl4 h LEU 35 CO 0.61 0.17 0.49 1.55 -0.00 0.00 0.00 178.44 181.25 1tl4 h PRO 36 N -0.88 0.61 -0.20 1.13 0.13 -1.97 0.16 132.00 130.98 1tl4 h PRO 36 Ca -0.03 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1tl4 h PRO 36 Cb 0.19 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.18 1tl4 h PRO 36 CO 0.04 0.40 0.00 0.09 -0.23 0.00 0.00 178.00 178.30 1tl4 n ASN 37 N -4.49 2.49 -3.79 1.44 3.02 -1.26 -5.00 115.26 107.67 1tl4 n ASN 37 Ca 0.12 -1.83 -0.33 0.00 -0.03 0.00 0.00 54.58 52.51 1tl4 n ASN 37 Cb 0.35 -0.13 0.02 0.00 -0.61 0.00 0.00 39.78 39.42 1tl4 n ASN 37 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1tl4 n LYS 38 N 0.89 -0.97 -3.83 3.52 2.85 0.57 -4.91 118.16 116.28 1tl4 n LYS 38 Ca 0.17 0.48 -0.09 0.00 -1.05 0.00 0.00 58.31 57.82 1tl4 n LYS 38 Cb 0.47 -3.30 -0.07 0.00 -0.65 0.00 0.00 35.03 31.49 1tl4 n LYS 38 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1tl4 s LYS 39 N -6.00 0.85 -0.06 -1.58 1.02 0.00 -1.20 119.74 112.76 1tl4 s LYS 39 Ca 0.34 -0.88 0.01 0.00 0.02 0.00 0.00 55.97 55.46 1tl4 s LYS 39 Cb -0.15 0.35 0.02 0.00 -0.52 0.00 0.00 37.83 37.53 1tl4 s LYS 39 CO 0.90 -0.27 -0.06 0.08 -0.92 0.00 0.00 175.35 175.08 1tl4 s VAL 40 N -3.64 0.70 -0.44 3.17 1.01 0.58 -0.59 120.40 121.19 1tl4 s VAL 40 Ca 0.03 -0.17 -0.11 0.00 0.00 0.00 0.00 61.98 61.73 1tl4 s VAL 40 Cb 0.04 -0.73 0.08 0.00 0.00 0.00 0.00 36.38 35.77 1tl4 s VAL 40 CO -0.10 0.28 0.30 0.00 0.00 0.00 0.00 175.10 175.58 1tl4 s ILE 42 N 1.48 5.31 -0.02 0.00 1.01 0.36 -0.72 121.20 128.62 1tl4 s ILE 42 Ca 0.03 0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.86 1tl4 s ILE 42 Cb -0.24 -3.56 0.03 0.00 0.01 0.00 0.00 42.46 38.70 1tl4 s ILE 42 CO 0.03 0.39 0.02 -0.70 0.00 0.00 0.00 174.94 174.68 1tl4 s GLU 43 N -1.70 0.00 0.36 2.79 2.12 0.45 -0.63 118.70 122.09 1tl4 s GLU 43 Ca 0.27 0.16 -0.12 0.00 0.36 0.00 0.00 54.97 55.64 1tl4 s GLU 43 Cb -0.13 -0.26 0.05 0.00 0.26 0.00 0.00 34.13 34.05 1tl4 s GLU 43 CO 0.15 -0.15 0.68 0.45 -0.54 0.00 0.00 175.26 175.85 1tl4 n SER 44 N 4.09 -1.97 0.05 -1.70 2.88 -0.27 -0.84 113.62 115.86 1tl4 n SER 44 Ca -0.27 -2.52 -0.19 0.00 -1.33 0.00 0.00 58.87 54.57 1tl4 n SER 44 Cb 0.51 3.32 -0.14 0.00 -0.75 0.00 0.00 64.21 67.14 1tl4 n SER 44 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1tl4 h GLU 45 N 0.00 0.28 -7.70 -1.46 4.11 -1.80 -3.41 114.58 104.60 1tl4 h GLU 45 Ca -0.30 -0.49 -0.45 0.00 0.07 0.00 0.00 59.36 58.19 1tl4 h GLU 45 Cb 1.13 0.18 0.15 0.00 0.50 0.00 0.00 28.75 30.71 1tl4 h GLU 45 CO 0.38 1.15 0.39 -3.38 0.07 0.00 0.00 179.01 177.62 1tl4 s HIS 46 N -2.59 1.98 1.07 2.06 -3.43 -1.26 -4.85 115.29 108.26 1tl4 s HIS 46 Ca -0.13 0.50 -0.16 0.00 -0.80 0.00 0.00 55.06 54.47 1tl4 s HIS 46 Cb 0.06 -3.83 0.23 0.00 -1.43 0.00 0.00 32.58 27.61 1tl4 s HIS 46 CO 0.84 -2.48 1.15 0.45 -2.00 0.00 0.00 174.74 172.70 1tl4 s SER 47 N -4.64 2.07 0.37 7.38 0.15 -1.26 -4.79 113.70 112.98 1tl4 s SER 47 Ca 0.69 0.72 0.07 0.00 0.70 0.00 0.00 55.95 58.13 1tl4 s SER 47 Cb -0.07 -1.07 0.74 0.00 -1.71 0.00 0.00 66.02 63.91 1tl4 s SER 47 CO 0.52 -3.42 1.94 0.00 1.20 0.00 0.00 173.24 173.48 1tl4 h MET 48 N -2.10 0.45 -0.02 5.44 -0.00 -1.97 -3.31 114.93 113.42 1tl4 h MET 48 Ca -0.48 -0.07 -0.00 0.00 -0.00 0.00 0.00 59.70 59.15 1tl4 h MET 48 Cb 1.30 -0.08 -0.00 0.00 -0.00 0.00 0.00 31.60 32.82 1tl4 h MET 48 CO 0.44 0.44 0.00 -0.44 -0.00 0.00 0.00 176.91 177.35 1tl4 h ASP 49 N 0.44 0.03 -0.67 -0.10 5.19 -1.99 0.11 116.42 119.44 1tl4 h ASP 49 Ca 0.10 -0.29 0.14 0.00 -0.62 0.00 0.00 57.03 56.36 1tl4 h ASP 49 Cb 0.22 -0.01 -0.11 0.00 0.18 0.00 0.00 39.33 39.62 1tl4 h ASP 49 CO 0.00 0.32 0.09 0.74 -3.12 0.00 0.00 179.24 177.27 1tl4 h THR 50 N -0.25 0.51 0.29 0.35 2.02 -1.96 -0.78 112.91 113.10 1tl4 h THR 50 Ca 0.01 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 1tl4 h THR 50 Cb 0.30 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1tl4 h THR 50 CO 0.00 0.04 -0.14 -0.07 0.37 0.00 0.00 175.52 175.72 1tl4 h LEU 51 N 0.20 -0.33 -0.65 2.58 3.38 -1.55 -3.06 115.31 115.87 1tl4 h LEU 51 Ca 0.37 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.41 1tl4 h LEU 51 Cb 0.61 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.37 1tl4 h LEU 51 CO -0.51 -0.23 -0.38 0.18 0.09 0.00 0.00 178.44 177.59 1tl4 n LEU 52 N -3.13 -0.69 -0.31 1.67 4.77 0.36 0.02 117.00 119.70 1tl4 n LEU 52 Ca -0.05 1.26 0.02 0.00 -0.03 0.00 0.00 56.01 57.21 1tl4 n LEU 52 Cb 0.16 -0.20 0.16 0.00 -2.33 0.00 0.00 43.42 41.20 1tl4 n LEU 52 CO 0.12 -0.99 1.17 0.00 -1.33 0.00 0.00 177.39 176.36 1tl4 h ALA 53 N 0.22 1.20 -0.13 -1.18 0.00 -1.28 0.88 119.26 118.98 1tl4 h ALA 53 Ca 0.10 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1tl4 h ALA 53 Cb 0.27 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1tl4 h ALA 53 CO -0.61 0.20 -0.09 1.15 0.00 0.00 0.00 179.25 179.89 1tl4 h THR 54 N 0.90 1.34 -0.27 0.00 2.02 -0.31 -3.34 112.91 113.25 1tl4 h THR 54 Ca 0.39 -1.20 -0.16 0.00 0.77 0.00 0.00 66.41 66.21 1tl4 h THR 54 Cb 0.27 1.85 -0.00 0.00 -1.74 0.00 0.00 68.15 68.52 1tl4 h THR 54 CO -0.21 0.35 -0.48 -0.07 0.37 0.00 0.00 175.52 175.47 1tl4 h LEU 55 N -0.07 0.82 -0.95 2.58 3.38 0.27 -2.65 115.31 118.68 1tl4 h LEU 55 Ca 0.02 -0.41 0.39 0.00 0.09 0.00 0.00 57.88 57.97 1tl4 h LEU 55 Cb 0.59 -0.23 -0.17 0.00 0.09 0.00 0.00 40.66 40.94 1tl4 h LEU 55 CO 0.03 1.16 0.48 0.29 0.09 0.00 0.00 178.44 180.49 1tl4 n LYS 56 N -4.01 -0.06 0.13 1.13 4.01 0.24 -1.17 118.16 118.44 1tl4 n LYS 56 Ca -0.03 1.31 0.10 0.00 -0.51 0.00 0.00 58.31 59.19 1tl4 n LYS 56 Cb 0.58 -2.34 0.49 0.00 -0.51 0.00 0.00 35.03 33.25 1tl4 n LYS 56 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1tl4 n LYS 57 N -5.16 0.15 0.02 1.97 5.02 -1.00 -0.14 118.16 119.02 1tl4 n LYS 57 Ca 0.35 0.51 0.02 0.00 -2.02 0.00 0.00 58.31 57.17 1tl4 n LYS 57 Cb 1.19 -1.86 0.37 0.00 -0.02 0.00 0.00 35.03 34.71 1tl4 n LYS 57 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1tl4 h THR 58 N 0.00 1.15 -3.54 -0.18 1.35 -1.35 -3.47 112.91 106.86 1tl4 h THR 58 Ca 0.00 -0.49 -0.40 0.00 -0.55 0.00 0.00 66.41 64.97 1tl4 h THR 58 Cb 0.19 0.76 0.00 0.00 -1.73 0.00 0.00 68.15 67.37 1tl4 h THR 58 CO 0.00 0.18 -0.54 0.61 -0.25 0.00 0.00 175.52 175.52 1tl4 n GLY 59 N -1.17 -0.51 3.13 5.82 0.00 0.80 -5.01 105.19 108.25 1tl4 n GLY 59 Ca 0.02 0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 1tl4 n GLY 59 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tl4 n LYS 60 N -3.30 -0.98 -0.97 1.61 4.76 -1.26 -4.92 118.16 113.10 1tl4 n LYS 60 Ca -0.20 -1.71 -0.25 0.00 -2.87 0.00 0.00 58.31 53.28 1tl4 n LYS 60 Cb 0.66 -1.07 -0.05 0.00 -1.84 0.00 0.00 35.03 32.73 1tl4 n LYS 60 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1tl4 n THR 61 N -3.43 3.13 -2.38 -0.18 -1.04 -1.26 -4.86 114.28 104.27 1tl4 n THR 61 Ca 0.14 -1.81 -0.37 0.00 -2.04 0.00 0.00 64.05 59.96 1tl4 n THR 61 Cb 0.47 -2.26 -0.04 0.00 -1.82 0.00 0.00 70.33 66.69 1tl4 n THR 61 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1tl4 s VAL 62 N 2.45 3.71 -0.15 12.58 0.11 -1.26 -3.94 120.40 133.90 1tl4 s VAL 62 Ca 0.54 -0.36 -0.20 0.00 -2.93 0.00 0.00 61.98 59.03 1tl4 s VAL 62 Cb 0.17 -4.66 -0.03 0.00 -1.53 0.00 0.00 36.38 30.33 1tl4 s VAL 62 CO -0.04 -1.57 0.55 -0.44 -3.33 0.00 0.00 175.10 170.28 1tl4 s SER 63 N 5.85 6.69 -0.11 3.54 0.01 0.66 -4.94 113.70 125.41 1tl4 s SER 63 Ca 0.52 0.83 -0.21 0.00 1.31 0.00 0.00 55.95 58.41 1tl4 s SER 63 Cb -0.04 -2.32 -0.04 0.00 0.21 0.00 0.00 66.02 63.83 1tl4 s SER 63 CO -0.00 -0.13 0.59 -0.47 0.41 0.00 0.00 173.24 173.64 1tl4 s TYR 64 N 1.22 3.52 -0.68 2.43 5.04 -1.26 -0.26 117.35 127.36 1tl4 s TYR 64 Ca 0.28 1.05 0.03 0.00 -2.44 0.00 0.00 57.07 55.99 1tl4 s TYR 64 Cb -0.16 -2.69 0.17 0.00 0.35 0.00 0.00 41.96 39.63 1tl4 s TYR 64 CO 0.11 0.09 0.47 -0.51 -1.34 0.00 0.00 175.55 174.38 1tl4 s LEU 65 N 0.86 4.84 0.00 6.97 1.02 0.41 -4.95 118.68 127.83 1tl4 s LEU 65 Ca 0.31 -3.55 0.00 0.00 0.02 0.00 0.00 54.13 50.91 1tl4 s LEU 65 Cb -0.16 -1.70 0.00 0.00 0.02 0.00 0.00 46.19 44.35 1tl4 s LEU 65 CO 0.14 -0.16 0.00 0.61 0.02 0.00 0.00 176.35 176.96 1tl4 n GLY 66 N 2.42 -1.26 3.72 -3.19 0.00 -1.26 -3.52 105.19 102.11 1tl4 n GLY 66 Ca 0.15 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.86 1tl4 n GLY 66 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tl4 s LEU 67 N 0.00 3.81 0.00 0.99 1.43 -1.26 -4.16 118.68 119.49 1tl4 s LEU 67 Ca 0.00 0.21 0.29 0.00 -1.03 0.00 0.00 54.13 53.60 1tl4 s LEU 67 Cb 0.00 -1.90 1.23 0.00 0.03 0.00 0.00 46.19 45.55 1tl4 s LEU 67 CO 0.00 0.36 1.85 -0.62 0.23 0.00 0.00 176.35 178.16