#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 0.00 -3.42 0.03 -0.01 -1.07 -4.76 135.00 125.77 1tl4 n PRO 2 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 63.50 63.10 1tl4 n PRO 2 Cb 0.00 -0.98 -0.09 0.00 -0.01 0.00 0.00 33.50 32.42 1tl4 n PRO 2 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 175.50 175.70 1tl4 s LYS 3 N 5.91 4.03 -0.37 -0.52 2.20 0.10 -3.58 119.74 127.51 1tl4 s LYS 3 Ca 0.67 0.01 0.01 0.00 -0.36 0.00 0.00 55.97 56.30 1tl4 s LYS 3 Cb -0.43 -3.64 0.10 0.00 -1.51 0.00 0.00 37.83 32.36 1tl4 s LYS 3 CO 0.29 -0.23 0.12 -1.01 -0.36 0.00 0.00 175.35 174.16 1tl4 s HIS 4 N 1.91 3.68 -0.02 4.03 3.76 0.50 -1.86 115.29 127.30 1tl4 s HIS 4 Ca 0.14 -2.72 -0.10 0.00 -0.15 0.00 0.00 55.06 52.24 1tl4 s HIS 4 Cb -0.16 -3.05 -0.05 0.00 1.11 0.00 0.00 32.58 30.44 1tl4 s HIS 4 CO 0.10 -0.96 0.30 -2.00 -0.85 0.00 0.00 174.74 171.33 1tl4 s GLU 5 N 1.02 3.68 -0.03 1.40 2.12 -1.26 -0.43 118.70 125.19 1tl4 s GLU 5 Ca 0.09 0.10 0.02 0.00 0.36 0.00 0.00 54.97 55.55 1tl4 s GLU 5 Cb -0.21 -3.14 0.01 0.00 0.26 0.00 0.00 34.13 31.05 1tl4 s GLU 5 CO -0.06 0.68 -0.09 -0.06 -0.54 0.00 0.00 175.26 175.19 1tl4 s PHE 6 N -1.18 0.98 -0.07 5.30 0.40 0.52 -0.51 117.98 123.42 1tl4 s PHE 6 Ca 0.24 -0.26 -0.25 0.00 -0.60 0.00 0.00 56.93 56.06 1tl4 s PHE 6 Cb -0.14 -0.72 -0.03 0.00 0.51 0.00 0.00 43.02 42.64 1tl4 s PHE 6 CO 0.12 -0.13 0.77 0.45 0.70 0.00 0.00 175.22 177.14 1tl4 s SER 7 N 0.31 7.04 -0.08 1.36 0.15 0.36 -0.42 113.70 122.42 1tl4 s SER 7 Ca -0.05 1.26 -0.03 0.00 0.70 0.00 0.00 55.95 57.83 1tl4 s SER 7 Cb -0.10 -2.45 0.04 0.00 -1.71 0.00 0.00 66.02 61.81 1tl4 s SER 7 CO 0.01 -0.19 0.17 -0.69 1.20 0.00 0.00 173.24 173.73 1tl4 s VAL 8 N 1.08 -0.18 -0.25 4.45 1.01 0.15 -0.37 120.40 126.29 1tl4 s VAL 8 Ca 0.40 0.27 -0.36 0.00 0.00 0.00 0.00 61.98 62.29 1tl4 s VAL 8 Cb -0.18 -0.29 -0.12 0.00 0.00 0.00 0.00 36.38 35.79 1tl4 s VAL 8 CO 0.19 0.11 1.99 -0.67 0.00 0.00 0.00 175.10 176.72 1tl4 n ASP 9 N 4.83 2.62 -4.26 3.32 2.03 -1.26 -3.55 116.55 120.29 1tl4 n ASP 9 Ca -0.14 0.73 -0.24 0.00 0.52 0.00 0.00 54.79 55.66 1tl4 n ASP 9 Cb 0.51 -1.27 -0.13 0.00 -0.72 0.00 0.00 41.12 39.50 1tl4 n ASP 9 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1tl4 s MET 10 N 4.95 1.17 0.00 -0.67 -1.94 -1.26 -4.87 119.30 116.68 1tl4 s MET 10 Ca 1.02 -1.04 0.00 0.00 -1.71 0.00 0.00 55.69 53.95 1tl4 s MET 10 Cb -0.84 -1.35 0.00 0.00 2.01 0.00 0.00 34.83 34.64 1tl4 s MET 10 CO 0.54 0.33 0.00 -2.37 -0.01 0.00 0.00 175.02 173.50 1tl4 n THR 11 N 1.41 0.00 -4.49 2.05 5.66 -1.26 -4.76 114.28 112.89 1tl4 n THR 11 Ca -0.19 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.56 1tl4 n THR 11 Cb 0.54 -0.22 -0.10 0.00 -1.55 0.00 0.00 70.33 69.00 1tl4 n THR 11 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1tl4 h GLY 13 N 2.12 1.64 -0.85 0.00 0.00 -2.00 0.28 103.07 104.25 1tl4 h GLY 13 Ca -0.41 -0.04 0.33 0.00 0.00 0.00 0.00 47.33 47.21 1tl4 h GLY 13 CO 0.65 -0.52 0.32 -1.33 0.00 0.00 0.00 176.54 175.66 1tl4 h GLY 14 N 0.13 1.76 0.81 4.60 0.00 -1.98 0.17 103.07 108.57 1tl4 h GLY 14 Ca 0.66 -0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.95 1tl4 h GLY 14 CO -0.74 -0.61 -0.03 0.00 0.00 0.00 0.00 176.54 175.16 1tl4 h ALA 16 N 0.64 -0.03 -0.26 0.00 0.00 -0.89 0.08 119.26 118.80 1tl4 h ALA 16 Ca -0.01 0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1tl4 h ALA 16 Cb 0.24 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 1tl4 h ALA 16 CO 0.02 -0.54 -0.25 0.93 0.00 0.00 0.00 179.25 179.40 1tl4 h GLU 17 N -0.09 -0.24 0.19 0.00 5.08 -0.75 0.13 114.58 118.91 1tl4 h GLU 17 Ca 0.04 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1tl4 h GLU 17 Cb 0.14 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 1tl4 h GLU 17 CO -0.09 -0.16 -0.27 0.00 -1.00 0.00 0.00 179.01 177.49 1tl4 h ALA 18 N 0.80 -0.51 -0.12 3.43 0.00 -0.40 0.84 119.26 123.29 1tl4 h ALA 18 Ca 0.14 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1tl4 h ALA 18 Cb 0.47 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1tl4 h ALA 18 CO -0.41 -0.83 -0.01 0.28 0.00 0.00 0.00 179.25 178.29 1tl4 h VAL 19 N -0.52 0.91 -0.27 0.00 2.07 -0.68 -1.01 116.25 116.74 1tl4 h VAL 19 Ca 0.01 -0.01 0.06 0.00 0.82 0.00 0.00 66.70 67.58 1tl4 h VAL 19 Cb 0.52 0.87 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 1tl4 h VAL 19 CO -0.11 0.01 -0.13 -1.28 0.02 0.00 0.00 177.57 176.07 1tl4 h SER 20 N 0.03 -0.45 -0.45 0.57 0.87 -0.56 0.61 113.55 114.17 1tl4 h SER 20 Ca 0.06 0.11 0.09 0.00 -1.23 0.00 0.00 61.79 60.81 1tl4 h SER 20 Cb 0.07 0.25 -0.09 0.00 -0.44 0.00 0.00 62.40 62.19 1tl4 h SER 20 CO -0.10 -0.17 -0.13 -0.09 -0.53 0.00 0.00 176.83 175.81 1tl4 h ARG 21 N -0.10 -0.02 -0.18 2.24 2.43 -0.32 0.69 114.38 119.11 1tl4 h ARG 21 Ca 0.14 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1tl4 h ARG 21 Cb 0.31 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 1tl4 h ARG 21 CO -0.34 -0.01 0.10 0.28 -1.51 0.00 0.00 179.97 178.49 1tl4 h VAL 22 N -0.02 1.12 0.00 0.20 2.07 -0.15 -0.27 116.25 119.20 1tl4 h VAL 22 Ca 0.22 -0.32 -0.06 0.00 0.82 0.00 0.00 66.70 67.35 1tl4 h VAL 22 Cb 0.35 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 1tl4 h VAL 22 CO -0.47 0.11 -0.29 -0.07 0.02 0.00 0.00 177.57 176.87 1tl4 h LEU 23 N 0.18 0.00 -0.50 2.57 3.38 -0.54 -2.56 115.31 117.84 1tl4 h LEU 23 Ca 0.06 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.88 1tl4 h LEU 23 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1tl4 h LEU 23 CO -0.01 0.29 -0.46 -1.13 0.09 0.00 0.00 178.44 177.22 1tl4 h ASN 24 N 0.00 0.77 -0.90 -0.43 -0.00 0.99 0.12 115.58 116.13 1tl4 h ASN 24 Ca -0.00 -0.37 0.17 0.00 -0.00 0.00 0.00 56.30 56.09 1tl4 h ASN 24 Cb 0.83 -0.22 -0.10 0.00 -0.00 0.00 0.00 38.32 38.84 1tl4 h ASN 24 CO 0.04 1.11 0.48 0.50 -0.00 0.00 0.00 177.43 179.56 1tl4 h LYS 25 N 0.57 0.63 0.55 6.67 3.11 -0.66 0.67 116.57 128.11 1tl4 h LYS 25 Ca 0.03 -0.04 -0.02 0.00 -2.81 0.00 0.00 60.65 57.82 1tl4 h LYS 25 Cb 1.01 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 32.10 1tl4 h LYS 25 CO 0.10 0.42 -0.35 1.25 -2.81 0.00 0.00 179.45 178.05 1tl4 h LEU 26 N 0.65 -0.88 0.00 5.20 7.12 -1.14 -3.46 115.31 122.80 1tl4 h LEU 26 Ca 0.51 0.05 0.00 0.00 0.13 0.00 0.00 57.88 58.57 1tl4 h LEU 26 Cb 0.76 0.26 0.00 0.00 -0.53 0.00 0.00 40.66 41.15 1tl4 h LEU 26 CO -0.38 -0.54 0.00 0.61 -0.13 0.00 0.00 178.44 178.00 1tl4 n GLY 27 N -1.48 1.78 2.38 3.75 0.00 0.35 -4.76 105.19 107.21 1tl4 n GLY 27 Ca -0.12 -0.15 -0.16 0.00 0.00 0.00 0.00 46.02 45.58 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 2.80 3.20 -0.02 0.00 -1.26 -4.79 105.19 105.11 1tl4 n GLY 28 Ca 0.00 -0.86 -0.09 0.00 0.00 0.00 0.00 46.02 45.07 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 2.49 0.13 -0.00 1.61 -7.23 -1.26 -4.65 120.40 111.49 1tl4 s VAL 29 Ca 0.43 -1.50 0.04 0.00 -1.81 0.00 0.00 61.98 59.14 1tl4 s VAL 29 Cb 0.16 -1.63 -0.01 0.00 0.56 0.00 0.00 36.38 35.45 1tl4 s VAL 29 CO -0.02 -0.60 -0.11 -0.75 -0.31 0.00 0.00 175.10 173.31 1tl4 s LYS 30 N -3.94 0.90 0.05 4.82 2.47 -0.92 -5.05 119.74 118.08 1tl4 s LYS 30 Ca 0.12 -0.44 0.01 0.00 -1.56 0.00 0.00 55.97 54.10 1tl4 s LYS 30 Cb 0.06 -0.87 -0.03 0.00 -1.46 0.00 0.00 37.83 35.53 1tl4 s LYS 30 CO -0.06 0.24 -0.06 1.52 0.16 0.00 0.00 175.35 177.15 1tl4 s TYR 31 N -0.34 0.64 0.18 4.03 -0.85 -1.26 -0.69 117.35 119.06 1tl4 s TYR 31 Ca 0.04 -0.64 0.09 0.00 -0.52 0.00 0.00 57.07 56.04 1tl4 s TYR 31 Cb -0.05 -0.39 -0.04 0.00 0.38 0.00 0.00 41.96 41.86 1tl4 s TYR 31 CO -0.00 -0.14 -0.13 0.34 -1.52 0.00 0.00 175.55 174.10 1tl4 s ASP 32 N -1.98 4.05 -0.04 -0.18 2.15 0.33 -4.98 116.67 116.02 1tl4 s ASP 32 Ca -0.05 -0.64 -0.01 0.00 0.43 0.00 0.00 52.55 52.28 1tl4 s ASP 32 Cb -0.05 -0.61 0.03 0.00 -0.30 0.00 0.00 42.92 41.99 1tl4 s ASP 32 CO -0.02 0.11 0.03 -0.63 -0.17 0.00 0.00 175.17 174.49 1tl4 s ILE 33 N -1.66 0.09 -0.25 4.11 1.01 -1.26 -0.61 121.20 122.62 1tl4 s ILE 33 Ca 0.24 0.25 -0.02 0.00 0.00 0.00 0.00 60.65 61.12 1tl4 s ILE 33 Cb -0.09 -0.27 0.03 0.00 0.01 0.00 0.00 42.46 42.14 1tl4 s ILE 33 CO 0.14 0.19 -0.06 -0.62 0.00 0.00 0.00 174.94 174.58 1tl4 s ASP 34 N 1.77 4.33 -0.05 3.58 -1.08 0.13 -5.01 116.67 120.34 1tl4 s ASP 34 Ca 0.00 -0.88 -0.06 0.00 -0.52 0.00 0.00 52.55 51.10 1tl4 s ASP 34 Cb -0.12 -1.67 -0.03 0.00 -1.46 0.00 0.00 42.92 39.64 1tl4 s ASP 34 CO -0.03 -0.13 0.29 -0.07 0.52 0.00 0.00 175.17 175.75 1tl4 h LEU 35 N 8.01 -0.18 -1.85 -1.34 4.07 -1.96 0.36 115.31 122.43 1tl4 h LEU 35 Ca -0.32 0.01 0.17 0.00 0.08 0.00 0.00 57.88 57.81 1tl4 h LEU 35 Cb 1.11 0.05 -0.03 0.00 1.08 0.00 0.00 40.66 42.86 1tl4 h LEU 35 CO 0.57 0.17 0.46 1.55 -1.08 0.00 0.00 178.44 180.11 1tl4 h PRO 36 N -0.81 0.14 -0.55 1.13 0.13 -1.93 -0.07 132.00 130.04 1tl4 h PRO 36 Ca -0.02 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1tl4 h PRO 36 Cb 0.16 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.26 1tl4 h PRO 36 CO 0.04 0.09 0.00 0.09 -0.23 0.00 0.00 178.00 177.99 1tl4 n ASN 37 N -4.40 3.76 -3.56 1.44 3.02 -1.26 -5.01 115.26 109.24 1tl4 n ASN 37 Ca 0.13 -2.16 -0.26 0.00 -0.03 0.00 0.00 54.58 52.25 1tl4 n ASN 37 Cb 0.63 -0.42 0.05 0.00 -0.61 0.00 0.00 39.78 39.43 1tl4 n ASN 37 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1tl4 n LYS 38 N 0.99 -1.73 -3.91 3.52 4.01 -0.04 -4.89 118.16 116.11 1tl4 n LYS 38 Ca 0.20 0.58 -0.10 0.00 -0.51 0.00 0.00 58.31 58.48 1tl4 n LYS 38 Cb 0.63 -4.66 -0.09 0.00 -0.51 0.00 0.00 35.03 30.39 1tl4 n LYS 38 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1tl4 s LYS 39 N -5.54 0.57 -0.03 1.97 1.02 0.08 -0.68 119.74 117.12 1tl4 s LYS 39 Ca 0.44 -0.65 0.01 0.00 0.02 0.00 0.00 55.97 55.79 1tl4 s LYS 39 Cb -0.13 0.23 0.02 0.00 -0.52 0.00 0.00 37.83 37.43 1tl4 s LYS 39 CO 0.83 -0.14 -0.02 0.08 -0.92 0.00 0.00 175.35 175.18 1tl4 s VAL 40 N -2.26 0.30 -0.16 3.17 1.01 0.44 -0.69 120.40 122.20 1tl4 s VAL 40 Ca -0.08 0.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.85 1tl4 s VAL 40 Cb -0.03 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 1tl4 s VAL 40 CO -0.03 0.17 0.04 0.00 0.00 0.00 0.00 175.10 175.28 1tl4 s ILE 42 N 0.18 1.09 -0.21 0.00 1.01 0.42 -0.51 121.20 123.18 1tl4 s ILE 42 Ca 0.03 -0.43 0.00 0.00 0.00 0.00 0.00 60.65 60.25 1tl4 s ILE 42 Cb -0.13 -1.01 0.02 0.00 0.01 0.00 0.00 42.46 41.36 1tl4 s ILE 42 CO 0.01 0.35 -0.15 -1.61 0.00 0.00 0.00 174.94 173.54 1tl4 s GLU 43 N 0.81 2.91 0.15 2.79 8.01 0.14 -0.37 118.70 133.14 1tl4 s GLU 43 Ca -0.12 -0.90 -0.22 0.00 0.01 0.00 0.00 54.97 53.74 1tl4 s GLU 43 Cb -0.15 -2.73 0.06 0.00 -4.31 0.00 0.00 34.13 27.00 1tl4 s GLU 43 CO 0.02 -0.29 0.56 0.45 0.01 0.00 0.00 175.26 176.01 1tl4 s SER 44 N 1.29 -0.50 0.48 -0.19 0.15 -1.24 -2.16 113.70 111.54 1tl4 s SER 44 Ca 0.02 -0.05 0.25 0.00 0.70 0.00 0.00 55.95 56.87 1tl4 s SER 44 Cb -0.15 0.57 1.22 0.00 -1.71 0.00 0.00 66.02 65.96 1tl4 s SER 44 CO -0.09 -0.94 1.98 -0.33 1.20 0.00 0.00 173.24 175.05 1tl4 h GLU 45 N 2.09 0.00 -5.84 5.44 5.08 -1.89 -3.42 114.58 116.04 1tl4 h GLU 45 Ca -0.34 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.49 1tl4 h GLU 45 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1tl4 h GLU 45 CO 0.40 0.18 1.54 -1.01 -1.00 0.00 0.00 179.01 179.11 1tl4 s HIS 46 N -4.04 1.18 0.47 4.33 3.76 -1.26 -4.93 115.29 114.81 1tl4 s HIS 46 Ca -0.02 1.02 -0.21 0.00 -0.15 0.00 0.00 55.06 55.70 1tl4 s HIS 46 Cb 0.12 -3.79 -0.11 0.00 1.11 0.00 0.00 32.58 29.91 1tl4 s HIS 46 CO 0.61 -3.23 0.61 0.45 -0.85 0.00 0.00 174.74 172.34 1tl4 n SER 47 N 13.58 -0.60 -0.40 1.40 2.88 -1.26 -4.58 113.62 124.64 1tl4 n SER 47 Ca 0.32 0.87 0.35 0.00 -1.33 0.00 0.00 58.87 59.08 1tl4 n SER 47 Cb 0.50 -1.17 0.62 0.00 -0.75 0.00 0.00 64.21 63.41 1tl4 n SER 47 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1tl4 h MET 48 N 0.73 0.05 -0.25 -1.46 -0.00 -1.92 0.76 114.93 112.84 1tl4 h MET 48 Ca -0.43 -0.00 0.05 0.00 -0.00 0.00 0.00 59.70 59.32 1tl4 h MET 48 Cb 1.39 -0.01 -0.05 0.00 -0.00 0.00 0.00 31.60 32.93 1tl4 h MET 48 CO 0.51 0.04 -0.04 -0.44 -0.00 0.00 0.00 176.91 176.97 1tl4 h ASP 49 N 0.06 -0.19 -0.02 -0.10 5.19 -1.99 0.36 116.42 119.72 1tl4 h ASP 49 Ca 0.84 0.07 -0.17 0.00 -0.62 0.00 0.00 57.03 57.15 1tl4 h ASP 49 Cb 2.45 0.14 -0.00 0.00 0.18 0.00 0.00 39.33 42.09 1tl4 h ASP 49 CO -0.58 -0.06 -0.55 0.74 -3.12 0.00 0.00 179.24 175.67 1tl4 h THR 50 N 0.02 1.31 0.31 0.35 2.02 -1.17 -2.51 112.91 113.24 1tl4 h THR 50 Ca 0.12 -1.79 -0.01 0.00 0.77 0.00 0.00 66.41 65.49 1tl4 h THR 50 Cb 0.18 1.76 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 1tl4 h THR 50 CO -0.24 0.56 -0.17 -0.07 0.37 0.00 0.00 175.52 175.97 1tl4 h LEU 51 N 0.47 -0.41 -0.20 2.58 3.38 -1.01 -3.01 115.31 117.10 1tl4 h LEU 51 Ca 0.01 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1tl4 h LEU 51 Cb 1.11 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.95 1tl4 h LEU 51 CO 0.11 -0.27 -0.12 0.18 0.09 0.00 0.00 178.44 178.43 1tl4 n LEU 52 N -3.27 -0.21 0.27 1.67 4.32 0.12 0.11 117.00 120.01 1tl4 n LEU 52 Ca -0.05 0.71 0.12 0.00 -0.02 0.00 0.00 56.01 56.77 1tl4 n LEU 52 Cb 0.18 -0.22 0.75 0.00 -1.62 0.00 0.00 43.42 42.50 1tl4 n LEU 52 CO 0.13 -0.47 1.02 0.00 -1.22 0.00 0.00 177.39 176.85 1tl4 h ALA 53 N -0.25 1.48 0.00 -1.18 0.00 -1.53 0.34 119.26 118.12 1tl4 h ALA 53 Ca 0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1tl4 h ALA 53 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1tl4 h ALA 53 CO -0.19 0.10 -0.04 1.15 0.00 0.00 0.00 179.25 180.27 1tl4 h THR 54 N 0.00 1.63 -0.62 0.00 2.02 -0.26 -3.36 112.91 112.33 1tl4 h THR 54 Ca -0.00 -1.92 -0.02 0.00 0.77 0.00 0.00 66.41 65.25 1tl4 h THR 54 Cb 0.20 2.92 -0.03 0.00 -1.74 0.00 0.00 68.15 69.50 1tl4 h THR 54 CO 0.01 0.50 0.32 0.25 0.37 0.00 0.00 175.52 176.97 1tl4 h LEU 55 N -0.76 0.77 -1.83 2.58 6.46 0.88 -0.68 115.31 122.73 1tl4 h LEU 55 Ca -0.01 -0.07 0.22 0.00 -0.12 0.00 0.00 57.88 57.91 1tl4 h LEU 55 Cb 0.85 -0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.55 1tl4 h LEU 55 CO 0.01 0.64 0.70 0.11 -0.62 0.00 0.00 178.44 179.28 1tl4 h LYS 56 N 0.87 0.00 0.00 1.25 1.57 -0.52 -0.21 116.57 119.53 1tl4 h LYS 56 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1tl4 h LYS 56 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1tl4 h LYS 56 CO -0.03 0.00 0.00 0.87 -0.57 0.00 0.00 179.45 179.72 1tl4 h LYS 57 N 0.00 0.00 -0.86 3.15 1.79 -1.27 0.32 116.57 119.70 1tl4 h LYS 57 Ca 0.36 0.00 0.11 0.00 -2.18 0.00 0.00 60.65 58.95 1tl4 h LYS 57 Cb 1.76 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 32.33 1tl4 h LYS 57 CO -0.00 0.00 0.48 1.79 -1.08 0.00 0.00 179.45 180.64 1tl4 h THR 58 N 0.00 0.86 -3.26 -0.16 1.35 -1.23 -3.47 112.91 107.00 1tl4 h THR 58 Ca 0.00 -0.26 -0.35 0.00 -0.55 0.00 0.00 66.41 65.24 1tl4 h THR 58 Cb 0.12 0.02 0.02 0.00 -1.73 0.00 0.00 68.15 66.58 1tl4 h THR 58 CO 0.00 0.14 -0.49 0.61 -0.25 0.00 0.00 175.52 175.53 1tl4 n GLY 59 N -1.32 -0.35 0.00 5.82 0.00 0.11 -5.02 105.19 104.43 1tl4 n GLY 59 Ca 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 -3.17 2.38 -0.89 1.61 5.02 -1.26 -5.00 118.16 116.86 1tl4 n LYS 60 Ca -0.15 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.01 1tl4 n LYS 60 Cb 0.63 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.51 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 -0.24 2.70 -2.43 -0.18 -1.04 -1.26 -4.86 114.28 106.98 1tl4 n THR 61 Ca 0.00 -1.40 -0.39 0.00 -2.04 0.00 0.00 64.05 60.22 1tl4 n THR 61 Cb 0.00 -1.99 -0.03 0.00 -1.82 0.00 0.00 70.33 66.48 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 1.45 3.70 -0.28 12.58 0.11 -1.26 -4.12 120.40 132.58 1tl4 s VAL 62 Ca 0.58 -0.04 -0.06 0.00 -2.93 0.00 0.00 61.98 59.53 1tl4 s VAL 62 Cb 0.26 -4.72 0.01 0.00 -1.53 0.00 0.00 36.38 30.39 1tl4 s VAL 62 CO -0.01 -1.65 0.05 -0.44 -3.33 0.00 0.00 175.10 169.72 1tl4 s SER 63 N 5.17 4.96 0.28 3.54 0.01 0.51 -4.98 113.70 123.19 1tl4 s SER 63 Ca 0.46 -0.65 -0.28 0.00 1.31 0.00 0.00 55.95 56.79 1tl4 s SER 63 Cb -0.06 -1.85 -0.09 0.00 0.21 0.00 0.00 66.02 64.23 1tl4 s SER 63 CO 0.07 -0.15 0.98 -0.47 0.41 0.00 0.00 173.24 174.08 1tl4 s TYR 64 N 1.49 3.77 0.56 2.43 5.04 -1.26 -0.49 117.35 128.88 1tl4 s TYR 64 Ca 0.03 1.82 0.06 0.00 -2.44 0.00 0.00 57.07 56.54 1tl4 s TYR 64 Cb -0.17 -3.04 0.05 0.00 0.35 0.00 0.00 41.96 39.16 1tl4 s TYR 64 CO 0.01 0.10 0.51 -0.51 -1.34 0.00 0.00 175.55 174.32 1tl4 s LEU 65 N -1.60 2.77 0.77 6.97 1.02 0.33 -4.89 118.68 124.06 1tl4 s LEU 65 Ca 0.46 -1.17 -0.15 0.00 0.02 0.00 0.00 54.13 53.29 1tl4 s LEU 65 Cb -0.25 -1.26 0.02 0.00 0.02 0.00 0.00 46.19 44.72 1tl4 s LEU 65 CO 0.31 -1.19 0.88 0.61 0.02 0.00 0.00 176.35 176.98 1tl4 n GLY 66 N -1.90 -0.72 3.78 -3.19 0.00 -1.26 -4.57 105.19 97.31 1tl4 n GLY 66 Ca 0.03 -0.44 -0.37 0.00 0.00 0.00 0.00 46.02 45.24 1tl4 n GLY 66 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1tl4 s LEU 67 N -3.00 4.36 0.00 0.99 2.96 -1.26 -4.19 118.68 118.53 1tl4 s LEU 67 Ca 0.70 1.87 0.00 0.00 -0.22 0.00 0.00 54.13 56.48 1tl4 s LEU 67 Cb -0.32 -3.98 0.00 0.00 0.50 0.00 0.00 46.19 42.39 1tl4 s LEU 67 CO 0.54 -0.08 0.49 -0.62 -1.32 0.00 0.00 176.35 175.36