#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 1.80 -2.83 0.03 -0.04 -1.26 -4.89 135.00 127.81 1tl4 n PRO 2 Ca 0.00 0.57 -0.43 0.00 -0.04 0.00 0.00 63.50 63.60 1tl4 n PRO 2 Cb 0.00 -2.78 -0.02 0.00 -0.04 0.00 0.00 33.50 30.65 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 5.44 3.64 -0.57 0.54 2.20 0.11 -4.44 119.74 126.66 1tl4 s LYS 3 Ca 1.00 -1.68 -0.27 0.00 -0.36 0.00 0.00 55.97 54.66 1tl4 s LYS 3 Cb -0.63 -5.05 -0.00 0.00 -1.51 0.00 0.00 37.83 30.64 1tl4 s LYS 3 CO 0.46 -1.89 1.64 -1.01 -0.36 0.00 0.00 175.35 174.19 1tl4 s HIS 4 N 3.17 1.96 -0.09 4.03 3.76 0.11 -3.32 115.29 124.91 1tl4 s HIS 4 Ca 0.37 0.57 -0.07 0.00 -0.15 0.00 0.00 55.06 55.78 1tl4 s HIS 4 Cb -0.03 -4.26 -0.04 0.00 1.11 0.00 0.00 32.58 29.36 1tl4 s HIS 4 CO -0.09 -2.25 0.17 -2.00 -0.85 0.00 0.00 174.74 169.72 1tl4 s GLU 5 N 6.20 3.48 -0.01 1.40 2.12 -1.26 -0.67 118.70 129.96 1tl4 s GLU 5 Ca 0.60 -0.12 0.01 0.00 0.36 0.00 0.00 54.97 55.83 1tl4 s GLU 5 Cb -0.13 -3.17 0.00 0.00 0.26 0.00 0.00 34.13 31.09 1tl4 s GLU 5 CO 0.23 0.75 -0.05 -0.06 -0.54 0.00 0.00 175.26 175.60 1tl4 s PHE 6 N -1.08 0.45 0.17 5.30 0.40 0.16 -0.20 117.98 123.18 1tl4 s PHE 6 Ca 0.18 -0.08 -0.09 0.00 -0.60 0.00 0.00 56.93 56.33 1tl4 s PHE 6 Cb -0.12 -0.32 -0.07 0.00 0.51 0.00 0.00 43.02 43.02 1tl4 s PHE 6 CO 0.07 -0.03 0.49 0.45 0.70 0.00 0.00 175.22 176.90 1tl4 s SER 7 N 0.04 6.64 0.36 1.36 0.15 0.07 -0.65 113.70 121.68 1tl4 s SER 7 Ca -0.00 0.86 0.04 0.00 0.70 0.00 0.00 55.95 57.55 1tl4 s SER 7 Cb -0.04 -2.20 -0.03 0.00 -1.71 0.00 0.00 66.02 62.04 1tl4 s SER 7 CO -0.00 0.03 0.16 -0.69 1.20 0.00 0.00 173.24 173.94 1tl4 s VAL 8 N -1.65 0.43 0.27 4.45 1.01 0.21 -0.91 120.40 124.22 1tl4 s VAL 8 Ca 0.42 -2.00 -0.12 0.00 0.00 0.00 0.00 61.98 60.28 1tl4 s VAL 8 Cb -0.12 -2.43 -0.08 0.00 0.00 0.00 0.00 36.38 33.75 1tl4 s VAL 8 CO 0.21 0.00 0.63 -0.62 0.00 0.00 0.00 175.10 175.32 1tl4 s ASP 9 N -3.50 6.67 -0.42 3.32 2.15 -1.22 -4.62 116.67 119.05 1tl4 s ASP 9 Ca 0.30 1.06 0.05 0.00 0.43 0.00 0.00 52.55 54.39 1tl4 s ASP 9 Cb 0.03 -2.28 0.18 0.00 -0.30 0.00 0.00 42.92 40.55 1tl4 s ASP 9 CO 0.18 -0.14 0.39 0.23 -0.17 0.00 0.00 175.17 175.66 1tl4 n MET 10 N -0.30 0.25 0.25 4.34 2.81 -1.26 -4.85 117.12 118.36 1tl4 n MET 10 Ca 0.02 -3.04 0.16 0.00 -1.81 0.00 0.00 57.70 53.02 1tl4 n MET 10 Cb 0.53 -1.62 0.58 0.00 -0.71 0.00 0.00 33.22 31.99 1tl4 n MET 10 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1tl4 h THR 11 N 4.52 0.00 -4.10 2.03 2.02 -1.97 -3.45 112.91 111.97 1tl4 h THR 11 Ca 0.23 -0.57 -0.11 0.00 0.77 0.00 0.00 66.41 66.74 1tl4 h THR 11 Cb 0.93 1.54 -0.15 0.00 -1.74 0.00 0.00 68.15 68.74 1tl4 h THR 11 CO 0.34 0.00 -0.57 0.00 0.37 0.00 0.00 175.52 175.65 1tl4 h GLY 13 N 3.01 1.83 1.74 0.00 0.00 -2.00 0.78 103.07 108.44 1tl4 h GLY 13 Ca -0.34 -0.16 0.02 0.00 0.00 0.00 0.00 47.33 46.86 1tl4 h GLY 13 CO 0.63 -0.47 0.12 -1.33 0.00 0.00 0.00 176.54 175.49 1tl4 h GLY 14 N 0.26 0.16 1.24 4.60 0.00 -1.97 0.23 103.07 107.59 1tl4 h GLY 14 Ca 0.68 -0.06 -0.06 0.00 0.00 0.00 0.00 47.33 47.90 1tl4 h GLY 14 CO -0.64 0.05 0.15 0.00 0.00 0.00 0.00 176.54 176.10 1tl4 h ALA 16 N 1.25 0.33 -0.30 0.00 0.00 -1.18 -2.26 119.26 117.11 1tl4 h ALA 16 Ca 0.20 -0.40 0.07 0.00 0.00 0.00 0.00 54.91 54.78 1tl4 h ALA 16 Cb 0.32 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.97 1tl4 h ALA 16 CO -0.00 0.34 -0.22 1.49 0.00 0.00 0.00 179.25 180.85 1tl4 h GLU 17 N 0.27 -0.19 -0.09 0.00 4.81 -0.69 0.18 114.58 118.86 1tl4 h GLU 17 Ca 0.03 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 1tl4 h GLU 17 Cb 0.85 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.24 1tl4 h GLU 17 CO 0.07 -0.13 -0.14 0.00 -0.73 0.00 0.00 179.01 178.07 1tl4 h ALA 18 N 0.92 -0.09 -0.31 2.92 0.00 -0.84 0.10 119.26 121.96 1tl4 h ALA 18 Ca 0.16 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.16 1tl4 h ALA 18 Cb 0.44 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 18.46 1tl4 h ALA 18 CO -0.41 -0.61 -0.08 0.28 0.00 0.00 0.00 179.25 178.43 1tl4 h VAL 19 N -0.20 0.69 -0.35 0.00 2.07 -0.99 -0.64 116.25 116.84 1tl4 h VAL 19 Ca 0.08 -0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.65 1tl4 h VAL 19 Cb 0.31 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 1tl4 h VAL 19 CO -0.21 0.00 0.06 -1.28 0.02 0.00 0.00 177.57 176.17 1tl4 h SER 20 N 0.00 -0.00 -0.48 0.57 0.87 0.05 0.96 113.55 115.51 1tl4 h SER 20 Ca 0.15 0.06 0.08 0.00 -1.23 0.00 0.00 61.79 60.85 1tl4 h SER 20 Cb 0.22 0.08 -0.07 0.00 -0.44 0.00 0.00 62.40 62.20 1tl4 h SER 20 CO -0.32 0.04 0.08 -0.09 -0.53 0.00 0.00 176.83 176.01 1tl4 h ARG 21 N 0.18 0.20 0.11 2.24 2.43 -0.37 0.34 114.38 119.52 1tl4 h ARG 21 Ca 0.17 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 1tl4 h ARG 21 Cb 0.19 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1tl4 h ARG 21 CO -0.22 0.13 -0.05 0.28 -1.51 0.00 0.00 179.97 178.60 1tl4 h VAL 22 N 0.21 0.91 -0.56 0.20 2.07 0.21 -1.14 116.25 118.14 1tl4 h VAL 22 Ca 0.24 -0.05 -0.11 0.00 0.82 0.00 0.00 66.70 67.60 1tl4 h VAL 22 Cb 0.33 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1tl4 h VAL 22 CO -0.33 0.01 -0.07 -0.07 0.02 0.00 0.00 177.57 177.13 1tl4 h LEU 23 N -0.17 1.02 -0.53 2.57 3.38 -0.57 -1.93 115.31 119.09 1tl4 h LEU 23 Ca -0.01 -0.32 0.07 0.00 0.09 0.00 0.00 57.88 57.70 1tl4 h LEU 23 Cb 0.13 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.55 1tl4 h LEU 23 CO 0.02 1.11 0.22 -1.13 0.09 0.00 0.00 178.44 178.75 1tl4 h ASN 24 N 0.92 0.25 -0.20 -0.43 -0.00 -0.14 -0.52 115.58 115.47 1tl4 h ASN 24 Ca 0.15 0.05 0.06 0.00 -0.00 0.00 0.00 56.30 56.57 1tl4 h ASN 24 Cb 0.63 0.02 -0.01 0.00 -0.00 0.00 0.00 38.32 38.96 1tl4 h ASN 24 CO 0.04 0.17 0.20 0.11 -0.00 0.00 0.00 177.43 177.95 1tl4 h LYS 25 N 0.42 0.00 -0.62 6.67 1.57 -0.45 0.22 116.57 124.37 1tl4 h LYS 25 Ca 0.25 0.00 0.13 0.00 -1.87 0.00 0.00 60.65 59.16 1tl4 h LYS 25 Cb 0.25 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.46 1tl4 h LYS 25 CO -0.23 0.00 0.06 1.25 -0.57 0.00 0.00 179.45 179.96 1tl4 h LEU 26 N 0.00 -0.16 0.00 2.94 7.12 -0.55 -3.48 115.31 121.18 1tl4 h LEU 26 Ca 0.10 0.14 0.00 0.00 0.13 0.00 0.00 57.88 58.25 1tl4 h LEU 26 Cb 0.49 0.22 0.00 0.00 -0.53 0.00 0.00 40.66 40.84 1tl4 h LEU 26 CO -0.00 -0.07 0.00 0.61 -0.13 0.00 0.00 178.44 178.85 1tl4 n GLY 27 N -1.35 0.09 2.11 3.75 0.00 0.76 -4.93 105.19 105.63 1tl4 n GLY 27 Ca 0.09 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.95 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 5.32 3.72 -0.02 0.00 -1.26 -4.80 105.19 108.15 1tl4 n GLY 28 Ca 0.00 -2.24 -0.31 0.00 0.00 0.00 0.00 46.02 43.46 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 -4.30 2.69 -0.04 1.61 -7.23 -1.26 -5.00 120.40 106.87 1tl4 s VAL 29 Ca 0.45 0.23 0.01 0.00 -1.81 0.00 0.00 61.98 60.87 1tl4 s VAL 29 Cb 0.39 -2.52 0.02 0.00 0.56 0.00 0.00 36.38 34.83 1tl4 s VAL 29 CO 0.01 -0.28 -0.04 -0.75 -0.31 0.00 0.00 175.10 173.73 1tl4 s LYS 30 N -4.70 0.72 -0.04 4.82 2.47 -1.26 -5.00 119.74 116.76 1tl4 s LYS 30 Ca 0.65 -0.09 -0.25 0.00 -1.56 0.00 0.00 55.97 54.72 1tl4 s LYS 30 Cb -0.20 -0.75 0.05 0.00 -1.46 0.00 0.00 37.83 35.47 1tl4 s LYS 30 CO 0.56 -0.06 0.54 1.52 0.16 0.00 0.00 175.35 178.06 1tl4 s TYR 31 N 0.81 -0.48 0.19 4.03 1.13 -1.26 -0.86 117.35 120.91 1tl4 s TYR 31 Ca -0.10 0.81 0.05 0.00 -1.41 0.00 0.00 57.07 56.41 1tl4 s TYR 31 Cb -0.13 0.29 -0.04 0.00 -1.10 0.00 0.00 41.96 40.98 1tl4 s TYR 31 CO -0.00 -0.52 0.20 0.34 -2.51 0.00 0.00 175.55 173.05 1tl4 s ASP 32 N -1.23 5.73 -0.14 -0.18 2.15 0.10 -4.93 116.67 118.18 1tl4 s ASP 32 Ca -0.12 -0.09 -0.04 0.00 0.43 0.00 0.00 52.55 52.73 1tl4 s ASP 32 Cb -0.02 -1.55 0.05 0.00 -0.30 0.00 0.00 42.92 41.10 1tl4 s ASP 32 CO 0.08 0.03 0.08 -0.63 -0.17 0.00 0.00 175.17 174.55 1tl4 s ILE 33 N -1.86 -0.05 -0.24 4.11 1.01 -1.26 -0.62 121.20 122.29 1tl4 s ILE 33 Ca 0.32 -0.03 -0.04 0.00 0.00 0.00 0.00 60.65 60.90 1tl4 s ILE 33 Cb -0.10 -0.49 0.00 0.00 0.01 0.00 0.00 42.46 41.89 1tl4 s ILE 33 CO 0.25 -0.14 -0.01 -0.62 0.00 0.00 0.00 174.94 174.41 1tl4 s ASP 34 N 2.13 4.52 -0.04 3.58 -1.08 -0.11 -5.00 116.67 120.67 1tl4 s ASP 34 Ca 0.03 -0.55 -0.06 0.00 -0.52 0.00 0.00 52.55 51.44 1tl4 s ASP 34 Cb -0.15 -1.76 -0.03 0.00 -1.46 0.00 0.00 42.92 39.52 1tl4 s ASP 34 CO -0.07 -0.08 0.33 -0.07 0.52 0.00 0.00 175.17 175.79 1tl4 h LEU 35 N 8.12 -0.18 -0.96 -1.34 -0.00 -1.93 0.65 115.31 119.67 1tl4 h LEU 35 Ca -0.37 0.01 0.17 0.00 -0.00 0.00 0.00 57.88 57.68 1tl4 h LEU 35 Cb 1.14 0.05 -0.17 0.00 -0.00 0.00 0.00 40.66 41.68 1tl4 h LEU 35 CO 0.60 0.12 -0.33 -0.65 -0.00 0.00 0.00 178.44 178.18 1tl4 h PRO 36 N -0.72 -0.01 -0.00 1.13 0.11 -1.96 -1.80 132.00 128.75 1tl4 h PRO 36 Ca -0.02 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.91 1tl4 h PRO 36 Cb 0.16 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 1tl4 h PRO 36 CO 0.04 -0.01 -0.82 -0.97 -0.21 0.00 0.00 178.00 176.03 1tl4 h ASN 37 N -0.01 0.18 -4.10 -2.05 -0.73 -1.97 -3.48 115.58 103.41 1tl4 h ASN 37 Ca 0.38 -0.14 -0.03 0.00 1.87 0.00 0.00 56.30 58.39 1tl4 h ASN 37 Cb 0.64 -0.05 0.02 0.00 0.27 0.00 0.00 38.32 39.19 1tl4 h ASN 37 CO -0.97 0.92 -0.09 0.29 -0.37 0.00 0.00 177.43 177.21 1tl4 n LYS 38 N -3.67 -0.71 -3.77 6.67 5.02 0.09 -4.87 118.16 116.93 1tl4 n LYS 38 Ca -0.03 0.83 -0.11 0.00 -2.02 0.00 0.00 58.31 56.99 1tl4 n LYS 38 Cb 0.77 -3.48 -0.07 0.00 -0.02 0.00 0.00 35.03 32.23 1tl4 n LYS 38 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1tl4 s LYS 39 N -3.15 0.84 0.02 1.97 1.02 -0.44 -0.62 119.74 119.39 1tl4 s LYS 39 Ca 0.05 -0.67 0.06 0.00 0.02 0.00 0.00 55.97 55.43 1tl4 s LYS 39 Cb -0.01 0.36 -0.02 0.00 -0.52 0.00 0.00 37.83 37.64 1tl4 s LYS 39 CO 0.35 -0.28 -0.19 0.08 -0.92 0.00 0.00 175.35 174.39 1tl4 s VAL 40 N -3.08 1.51 -0.35 3.17 1.01 0.18 -0.93 120.40 121.91 1tl4 s VAL 40 Ca -0.01 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 60.96 1tl4 s VAL 40 Cb 0.01 -1.30 0.10 0.00 0.00 0.00 0.00 36.38 35.19 1tl4 s VAL 40 CO -0.07 0.24 0.09 0.00 0.00 0.00 0.00 175.10 175.36 1tl4 s ILE 42 N 0.96 5.14 -0.40 0.00 1.09 0.15 -0.72 121.20 127.42 1tl4 s ILE 42 Ca 0.11 1.01 0.03 0.00 -1.10 0.00 0.00 60.65 60.70 1tl4 s ILE 42 Cb -0.19 -3.85 0.11 0.00 -1.06 0.00 0.00 42.46 37.47 1tl4 s ILE 42 CO -0.11 0.25 0.14 -1.61 -0.10 0.00 0.00 174.94 173.50 1tl4 s GLU 43 N 1.10 1.48 -0.05 2.79 2.02 -0.04 0.09 118.70 126.09 1tl4 s GLU 43 Ca 0.26 -1.98 -0.24 0.00 0.02 0.00 0.00 54.97 53.03 1tl4 s GLU 43 Cb -0.15 -2.96 0.05 0.00 0.10 0.00 0.00 34.13 31.16 1tl4 s GLU 43 CO 0.11 -1.02 0.54 -1.12 0.02 0.00 0.00 175.26 173.78 1tl4 s SER 44 N 0.61 -0.48 -1.35 -0.19 0.01 -1.26 -4.12 113.70 106.91 1tl4 s SER 44 Ca 0.13 0.53 -0.14 0.00 1.31 0.00 0.00 55.95 57.78 1tl4 s SER 44 Cb -0.21 0.51 -0.03 0.00 0.21 0.00 0.00 66.02 66.50 1tl4 s SER 44 CO -0.07 -0.51 2.34 -1.84 0.41 0.00 0.00 173.24 173.56 1tl4 n GLU 45 N 1.21 2.78 -3.94 12.44 0.28 -1.26 -4.78 120.64 127.37 1tl4 n GLU 45 Ca -0.19 -2.32 -0.11 0.00 -0.16 0.00 0.00 57.16 54.38 1tl4 n GLU 45 Cb 0.57 -3.07 -0.01 0.00 1.43 0.00 0.00 31.44 30.36 1tl4 n GLU 45 CO 0.00 0.00 0.00 -3.38 -0.16 0.00 0.00 177.13 173.59 1tl4 s HIS 46 N 3.27 0.47 1.08 -1.84 -3.43 -1.26 -5.17 115.29 108.40 1tl4 s HIS 46 Ca 0.53 -0.93 -0.15 0.00 -0.80 0.00 0.00 55.06 53.71 1tl4 s HIS 46 Cb 0.15 0.42 0.23 0.00 -1.43 0.00 0.00 32.58 31.94 1tl4 s HIS 46 CO -0.05 -1.32 1.11 0.45 -2.00 0.00 0.00 174.74 172.94 1tl4 s SER 47 N -3.11 1.98 0.20 7.38 0.15 -1.26 -4.96 113.70 114.07 1tl4 s SER 47 Ca 0.21 0.88 -0.03 0.00 0.70 0.00 0.00 55.95 57.71 1tl4 s SER 47 Cb -0.03 -1.34 0.14 0.00 -1.71 0.00 0.00 66.02 63.09 1tl4 s SER 47 CO 0.14 -3.50 1.54 0.00 1.20 0.00 0.00 173.24 172.62 1tl4 h MET 48 N -2.15 0.59 -0.28 5.44 -0.00 -2.00 -3.33 114.93 113.21 1tl4 h MET 48 Ca -0.50 -0.33 0.06 0.00 -0.00 0.00 0.00 59.70 58.93 1tl4 h MET 48 Cb 1.31 0.02 -0.06 0.00 -0.00 0.00 0.00 31.60 32.88 1tl4 h MET 48 CO 0.48 0.94 -0.10 -0.44 -0.00 0.00 0.00 176.91 177.78 1tl4 h ASP 49 N 0.47 -0.35 -0.86 -0.10 5.19 -1.99 0.29 116.42 119.08 1tl4 h ASP 49 Ca 0.03 0.10 0.21 0.00 -0.62 0.00 0.00 57.03 56.74 1tl4 h ASP 49 Cb 1.00 0.21 -0.12 0.00 0.18 0.00 0.00 39.33 40.60 1tl4 h ASP 49 CO 0.09 -0.13 0.34 0.74 -3.12 0.00 0.00 179.24 177.16 1tl4 h THR 50 N -0.04 0.48 0.39 0.35 2.02 -1.96 -1.00 112.91 113.14 1tl4 h THR 50 Ca 0.14 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 67.18 1tl4 h THR 50 Cb 0.26 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.75 1tl4 h THR 50 CO -0.32 0.07 -0.19 -0.07 0.37 0.00 0.00 175.52 175.38 1tl4 h LEU 51 N 0.37 -0.44 -0.78 2.58 3.38 -0.84 -3.30 115.31 116.28 1tl4 h LEU 51 Ca 0.53 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.58 1tl4 h LEU 51 Cb 0.98 0.12 -0.09 0.00 0.09 0.00 0.00 40.66 41.75 1tl4 h LEU 51 CO -0.53 -0.07 -0.46 0.18 0.09 0.00 0.00 178.44 177.65 1tl4 n LEU 52 N -4.78 -0.82 0.25 1.67 4.32 0.74 0.18 117.00 118.56 1tl4 n LEU 52 Ca -0.07 1.55 0.17 0.00 -0.02 0.00 0.00 56.01 57.64 1tl4 n LEU 52 Cb 0.21 -0.26 0.90 0.00 -1.62 0.00 0.00 43.42 42.65 1tl4 n LEU 52 CO 0.16 -1.21 1.01 0.00 -1.22 0.00 0.00 177.39 176.13 1tl4 h ALA 53 N 0.22 1.01 0.00 -1.18 0.00 -1.35 0.13 119.26 118.09 1tl4 h ALA 53 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.64 1tl4 h ALA 53 Cb 0.32 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.04 1tl4 h ALA 53 CO -0.73 -0.01 -2.48 2.41 0.00 0.00 0.00 179.25 178.44 1tl4 n THR 54 N -2.66 1.49 -0.14 0.00 -1.04 0.89 -4.21 114.28 108.61 1tl4 n THR 54 Ca -0.02 -0.56 -0.07 0.00 -2.04 0.00 0.00 64.05 61.36 1tl4 n THR 54 Cb 0.06 -1.44 0.09 0.00 -1.82 0.00 0.00 70.33 67.22 1tl4 n THR 54 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1tl4 h LEU 55 N -0.05 0.88 -2.05 -4.42 3.38 0.47 0.06 115.31 113.59 1tl4 h LEU 55 Ca -0.59 -0.26 0.10 0.00 0.09 0.00 0.00 57.88 57.23 1tl4 h LEU 55 Cb 1.89 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 42.39 1tl4 h LEU 55 CO -0.11 0.98 0.37 0.11 0.09 0.00 0.00 178.44 179.88 1tl4 h LYS 56 N 0.81 0.00 0.00 1.13 6.56 -0.99 -1.63 116.57 122.46 1tl4 h LYS 56 Ca 0.14 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.73 1tl4 h LYS 56 Cb 0.57 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.23 1tl4 h LYS 56 CO 0.03 0.00 -0.01 0.87 -2.06 0.00 0.00 179.45 178.28 1tl4 h LYS 57 N 0.00 0.00 -0.71 3.15 1.57 -1.14 0.34 116.57 119.77 1tl4 h LYS 57 Ca 0.16 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.91 1tl4 h LYS 57 Cb 0.90 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.18 1tl4 h LYS 57 CO -0.00 0.01 0.32 1.79 -0.57 0.00 0.00 179.45 181.00 1tl4 h THR 58 N 0.00 1.23 -4.13 -0.16 1.35 -1.43 -3.47 112.91 106.30 1tl4 h THR 58 Ca -0.00 -0.68 -0.40 0.00 -0.55 0.00 0.00 66.41 64.78 1tl4 h THR 58 Cb 0.10 0.34 0.03 0.00 -1.73 0.00 0.00 68.15 66.90 1tl4 h THR 58 CO 0.00 0.28 -0.58 0.61 -0.25 0.00 0.00 175.52 175.58 1tl4 n GLY 59 N -1.04 -0.52 0.00 5.82 0.00 0.12 -4.99 105.19 104.58 1tl4 n GLY 59 Ca 0.07 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -3.73 3.50 -0.69 1.61 5.02 -1.26 -4.93 118.16 117.68 1tl4 n LYS 60 Ca -0.14 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.07 1tl4 n LYS 60 Cb 0.63 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.54 1tl4 n LYS 60 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1tl4 n THR 61 N 0.00 2.16 -3.56 -0.18 -1.04 -1.26 -4.88 114.28 105.52 1tl4 n THR 61 Ca 0.00 -0.98 -0.36 0.00 -2.04 0.00 0.00 64.05 60.67 1tl4 n THR 61 Cb 0.00 -1.77 -0.07 0.00 -1.82 0.00 0.00 70.33 66.67 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 1.19 5.32 0.13 12.58 0.11 -1.26 -3.37 120.40 135.10 1tl4 s VAL 62 Ca 0.40 0.49 -0.24 0.00 -2.93 0.00 0.00 61.98 59.69 1tl4 s VAL 62 Cb 0.19 -3.61 0.07 0.00 -1.53 0.00 0.00 36.38 31.50 1tl4 s VAL 62 CO 0.00 0.39 0.69 -0.44 -3.33 0.00 0.00 175.10 172.40 1tl4 s SER 63 N 0.52 -0.48 0.29 3.54 0.01 -0.08 -4.91 113.70 112.59 1tl4 s SER 63 Ca 0.15 -0.06 -0.20 0.00 1.31 0.00 0.00 55.95 57.15 1tl4 s SER 63 Cb -0.13 0.56 -0.09 0.00 0.21 0.00 0.00 66.02 66.57 1tl4 s SER 63 CO 0.03 -0.92 0.80 -0.47 0.41 0.00 0.00 173.24 173.09 1tl4 s TYR 64 N -3.61 3.54 0.52 2.43 5.04 -1.26 -0.75 117.35 123.27 1tl4 s TYR 64 Ca 0.03 1.45 0.05 0.00 -2.44 0.00 0.00 57.07 56.16 1tl4 s TYR 64 Cb -0.01 -2.69 0.01 0.00 0.35 0.00 0.00 41.96 39.62 1tl4 s TYR 64 CO -0.10 0.19 0.28 -0.51 -1.34 0.00 0.00 175.55 174.07 1tl4 s LEU 65 N -2.40 2.67 0.74 6.97 1.02 0.72 -4.86 118.68 123.54 1tl4 s LEU 65 Ca 0.50 -1.32 -0.16 0.00 0.02 0.00 0.00 54.13 53.18 1tl4 s LEU 65 Cb -0.14 -1.13 0.00 0.00 0.02 0.00 0.00 46.19 44.94 1tl4 s LEU 65 CO 0.20 -0.96 0.86 0.61 0.02 0.00 0.00 176.35 177.08 1tl4 n GLY 66 N -1.57 -0.72 3.45 -3.19 0.00 -1.26 -4.41 105.19 97.48 1tl4 n GLY 66 Ca -0.06 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 1tl4 n GLY 66 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1tl4 n LEU 67 N -1.48 5.02 -0.38 0.99 -0.00 -1.26 -4.01 117.00 115.87 1tl4 n LEU 67 Ca 0.12 -3.86 0.05 0.00 -0.00 0.00 0.00 56.01 52.32 1tl4 n LEU 67 Cb 0.50 -1.72 0.04 0.00 -0.00 0.00 0.00 43.42 42.23 1tl4 n LEU 67 CO 0.49 0.08 0.40 -0.62 -0.00 0.00 0.00 177.39 177.74