#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tl5 s PRO 2 N 0.00 2.04 0.18 0.03 0.04 -1.26 -4.82 135.00 131.21 1tl5 s PRO 2 Ca 0.00 0.53 0.03 0.00 0.04 0.00 0.00 61.00 61.60 1tl5 s PRO 2 Cb 0.00 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.58 1tl5 s PRO 2 CO 0.00 -1.63 0.32 -1.59 0.04 0.00 0.00 177.00 174.14 1tl5 s LYS 3 N -5.22 3.45 -0.11 4.56 -2.85 0.76 -3.78 119.74 116.54 1tl5 s LYS 3 Ca 0.61 -0.61 0.03 0.00 -1.00 0.00 0.00 55.97 55.01 1tl5 s LYS 3 Cb -0.14 -2.93 0.00 0.00 -2.06 0.00 0.00 37.83 32.71 1tl5 s LYS 3 CO 0.53 0.48 -0.23 -1.01 0.10 0.00 0.00 175.35 175.23 1tl5 s HIS 4 N -1.83 2.52 -0.12 1.78 3.76 0.43 -0.67 115.29 121.18 1tl5 s HIS 4 Ca 0.35 -1.10 -0.02 0.00 -0.15 0.00 0.00 55.06 54.14 1tl5 s HIS 4 Cb -0.10 -1.70 -0.03 0.00 1.11 0.00 0.00 32.58 31.86 1tl5 s HIS 4 CO 0.29 -0.47 -0.05 -1.21 -0.85 0.00 0.00 174.74 172.45 1tl5 s GLU 5 N 0.50 3.27 -0.01 1.40 2.02 0.34 -0.69 118.70 125.53 1tl5 s GLU 5 Ca -0.15 -0.53 0.02 0.00 0.02 0.00 0.00 54.97 54.33 1tl5 s GLU 5 Cb -0.17 -2.77 -0.00 0.00 0.10 0.00 0.00 34.13 31.29 1tl5 s GLU 5 CO 0.06 0.43 -0.07 -0.06 0.02 0.00 0.00 175.26 175.64 1tl5 s PHE 6 N -0.17 0.69 -0.09 1.61 0.08 0.26 -0.46 117.98 119.90 1tl5 s PHE 6 Ca 0.03 -0.14 -0.10 0.00 0.12 0.00 0.00 56.93 56.84 1tl5 s PHE 6 Cb -0.13 -0.47 -0.05 0.00 -0.57 0.00 0.00 43.02 41.80 1tl5 s PHE 6 CO 0.03 -0.04 0.23 0.45 -0.10 0.00 0.00 175.22 175.79 1tl5 s SER 7 N -0.02 6.51 0.17 1.36 0.15 -0.97 -0.59 113.70 120.31 1tl5 s SER 7 Ca 0.01 0.60 0.10 0.00 0.70 0.00 0.00 55.95 57.36 1tl5 s SER 7 Cb -0.05 -2.13 -0.04 0.00 -1.71 0.00 0.00 66.02 62.09 1tl5 s SER 7 CO -0.00 0.35 -0.21 -0.69 1.20 0.00 0.00 173.24 173.89 1tl5 s VAL 8 N -0.87 2.06 -0.94 4.45 1.01 0.35 -0.60 120.40 125.86 1tl5 s VAL 8 Ca 0.17 -1.95 -0.15 0.00 0.00 0.00 0.00 61.98 60.06 1tl5 s VAL 8 Cb -0.13 -1.95 0.19 0.00 0.00 0.00 0.00 36.38 34.49 1tl5 s VAL 8 CO 0.06 -0.21 1.00 -0.62 0.00 0.00 0.00 175.10 175.34 1tl5 s ASP 9 N -2.62 6.83 -1.14 3.32 2.15 -1.24 -4.73 116.67 119.24 1tl5 s ASP 9 Ca 0.17 -2.64 -0.21 0.00 0.43 0.00 0.00 52.55 50.30 1tl5 s ASP 9 Cb -0.07 -2.29 0.06 0.00 -0.30 0.00 0.00 42.92 40.31 1tl5 s ASP 9 CO 0.08 -0.71 1.58 -0.04 -0.17 0.00 0.00 175.17 175.91 1tl5 s MET 10 N 0.92 3.73 0.38 4.34 -1.94 -1.26 -4.79 119.30 120.69 1tl5 s MET 10 Ca 0.27 -1.48 0.20 0.00 -1.71 0.00 0.00 55.69 52.98 1tl5 s MET 10 Cb -0.08 -5.43 0.53 0.00 2.01 0.00 0.00 34.83 31.86 1tl5 s MET 10 CO -0.08 -2.27 1.66 1.15 -0.01 0.00 0.00 175.02 175.47 1tl5 h THR 11 N 6.28 0.62 -3.50 2.05 2.02 -1.98 -3.44 112.91 114.96 1tl5 h THR 11 Ca 0.30 -1.53 -0.11 0.00 0.77 0.00 0.00 66.41 65.84 1tl5 h THR 11 Cb 0.95 2.04 -0.18 0.00 -1.74 0.00 0.00 68.15 69.23 1tl5 h THR 11 CO 1.44 0.30 -0.38 0.00 0.37 0.00 0.00 175.52 177.25 1tl5 h GLY 13 N 3.50 1.71 1.53 0.00 0.00 -2.01 0.13 103.07 107.94 1tl5 h GLY 13 Ca -0.32 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1tl5 h GLY 13 CO 0.47 -0.35 0.23 -1.33 0.00 0.00 0.00 176.54 175.56 1tl5 h GLY 14 N 0.36 0.00 0.66 4.60 0.00 -1.97 0.17 103.07 106.88 1tl5 h GLY 14 Ca 0.62 0.00 0.06 0.00 0.00 0.00 0.00 47.33 48.01 1tl5 h GLY 14 CO -0.57 0.00 0.29 0.00 0.00 0.00 0.00 176.54 176.26 1tl5 h ALA 16 N 1.32 0.69 -0.27 0.00 0.00 -0.83 -0.19 119.26 120.00 1tl5 h ALA 16 Ca 0.26 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1tl5 h ALA 16 Cb 0.19 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1tl5 h ALA 16 CO -0.19 0.31 -0.03 0.93 0.00 0.00 0.00 179.25 180.27 1tl5 h GLU 17 N 0.72 0.04 -0.03 0.00 5.08 -1.43 0.64 114.58 119.60 1tl5 h GLU 17 Ca 0.18 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.56 1tl5 h GLU 17 Cb 0.21 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1tl5 h GLU 17 CO -0.01 0.02 -0.10 0.00 -1.00 0.00 0.00 179.01 177.92 1tl5 h ALA 18 N 1.25 -0.09 -0.13 3.43 0.00 -0.06 0.96 119.26 124.62 1tl5 h ALA 18 Ca 0.13 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1tl5 h ALA 18 Cb 0.18 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 1tl5 h ALA 18 CO -0.25 -0.58 -0.28 0.28 0.00 0.00 0.00 179.25 178.42 1tl5 h VAL 19 N -0.16 0.34 -0.42 0.00 2.07 -0.87 -1.12 116.25 116.09 1tl5 h VAL 19 Ca 0.05 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.66 1tl5 h VAL 19 Cb 0.22 0.34 -0.09 0.00 -1.52 0.00 0.00 31.29 30.25 1tl5 h VAL 19 CO -0.12 0.00 -0.18 -1.28 0.02 0.00 0.00 177.57 176.01 1tl5 h SER 20 N -0.36 -0.62 0.16 0.57 0.87 -0.05 0.52 113.55 114.63 1tl5 h SER 20 Ca 0.10 0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 1tl5 h SER 20 Cb 0.51 0.35 0.00 0.00 -0.44 0.00 0.00 62.40 62.82 1tl5 h SER 20 CO -0.33 -0.21 -0.08 0.03 -0.53 0.00 0.00 176.83 175.71 1tl5 h ARG 21 N -0.09 -0.21 -0.52 2.24 3.08 -0.28 0.11 114.38 118.70 1tl5 h ARG 21 Ca 0.21 0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.21 1tl5 h ARG 21 Cb 0.41 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 1tl5 h ARG 21 CO -0.49 -0.11 0.11 -0.24 -1.07 0.00 0.00 179.97 178.18 1tl5 h VAL 22 N -0.27 1.25 -0.17 2.04 3.04 -0.89 0.15 116.25 121.41 1tl5 h VAL 22 Ca -0.02 -0.90 -0.00 0.00 -1.01 0.00 0.00 66.70 64.76 1tl5 h VAL 22 Cb 0.21 0.83 -0.01 0.00 -2.01 0.00 0.00 31.29 30.30 1tl5 h VAL 22 CO 0.04 0.33 0.10 -0.07 -1.01 0.00 0.00 177.57 176.95 1tl5 h LEU 23 N 0.74 0.20 -0.51 3.16 -0.00 -0.83 -0.89 115.31 117.18 1tl5 h LEU 23 Ca 0.16 -0.05 0.10 0.00 -0.00 0.00 0.00 57.88 58.09 1tl5 h LEU 23 Cb 0.37 -0.05 -0.09 0.00 -0.00 0.00 0.00 40.66 40.89 1tl5 h LEU 23 CO 0.01 0.20 -0.06 -1.13 -0.00 0.00 0.00 178.44 177.46 1tl5 h ASN 24 N 0.19 -0.34 -0.69 -0.43 -1.24 -0.57 -1.67 115.58 110.84 1tl5 h ASN 24 Ca 0.06 0.14 0.07 0.00 0.71 0.00 0.00 56.30 57.28 1tl5 h ASN 24 Cb 0.03 0.26 -0.04 0.00 0.73 0.00 0.00 38.32 39.30 1tl5 h ASN 24 CO -0.01 -0.12 0.45 0.11 -1.29 0.00 0.00 177.43 176.57 1tl5 h LYS 25 N 0.06 0.64 -0.53 6.67 1.79 -0.04 -1.25 116.57 123.90 1tl5 h LYS 25 Ca 0.26 -0.04 0.09 0.00 -2.18 0.00 0.00 60.65 58.77 1tl5 h LYS 25 Cb 0.39 -0.14 -0.07 0.00 -1.58 0.00 0.00 32.23 30.83 1tl5 h LYS 25 CO -0.48 0.42 0.15 1.25 -1.08 0.00 0.00 179.45 179.72 1tl5 h LEU 26 N 0.66 0.10 0.00 2.94 7.12 -0.19 -3.48 115.31 122.46 1tl5 h LEU 26 Ca 0.30 0.08 0.00 0.00 0.13 0.00 0.00 57.88 58.39 1tl5 h LEU 26 Cb 0.33 0.09 0.00 0.00 -0.53 0.00 0.00 40.66 40.55 1tl5 h LEU 26 CO -0.10 0.08 0.00 0.61 -0.13 0.00 0.00 178.44 178.90 1tl5 n GLY 27 N -1.28 0.25 2.69 3.75 0.00 -0.47 -5.01 105.19 105.12 1tl5 n GLY 27 Ca 0.07 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1tl5 n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tl5 n GLY 28 N 0.00 5.27 3.03 -0.02 0.00 -1.26 -4.85 105.19 107.36 1tl5 n GLY 28 Ca 0.00 -2.76 -0.26 0.00 0.00 0.00 0.00 46.02 43.00 1tl5 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tl5 s VAL 29 N -3.44 1.24 -0.61 1.61 0.11 -1.26 -4.72 120.40 113.32 1tl5 s VAL 29 Ca 0.43 -0.52 -0.21 0.00 -2.93 0.00 0.00 61.98 58.75 1tl5 s VAL 29 Cb 0.20 -1.14 0.07 0.00 -1.53 0.00 0.00 36.38 33.98 1tl5 s VAL 29 CO -0.06 0.38 0.85 -0.75 -3.33 0.00 0.00 175.10 172.20 1tl5 s LYS 30 N 0.81 3.12 -0.08 1.54 2.36 -0.19 -4.86 119.74 122.45 1tl5 s LYS 30 Ca -0.11 -0.91 -0.24 0.00 -2.55 0.00 0.00 55.97 52.15 1tl5 s LYS 30 Cb -0.15 -4.21 -0.03 0.00 -1.05 0.00 0.00 37.83 32.39 1tl5 s LYS 30 CO 0.02 -1.64 0.74 1.52 1.55 0.00 0.00 175.35 177.53 1tl5 s TYR 31 N 3.52 3.55 -0.13 4.03 -0.85 -1.26 -0.73 117.35 125.48 1tl5 s TYR 31 Ca 0.19 1.27 -0.01 0.00 -0.52 0.00 0.00 57.07 58.01 1tl5 s TYR 31 Cb -0.19 -2.86 -0.02 0.00 0.38 0.00 0.00 41.96 39.28 1tl5 s TYR 31 CO 0.10 0.02 -0.11 -0.51 -1.52 0.00 0.00 175.55 173.53 1tl5 s ASP 32 N 0.88 4.19 -0.30 -0.18 1.01 0.10 -5.01 116.67 117.36 1tl5 s ASP 32 Ca 0.38 -0.27 0.00 0.00 0.71 0.00 0.00 52.55 53.37 1tl5 s ASP 32 Cb -0.18 -1.60 0.10 0.00 1.01 0.00 0.00 42.92 42.24 1tl5 s ASP 32 CO 0.18 0.18 0.08 -0.63 0.21 0.00 0.00 175.17 175.18 1tl5 s ILE 33 N 0.28 1.17 -0.25 0.77 1.01 -1.26 -0.85 121.20 122.07 1tl5 s ILE 33 Ca -0.08 -1.53 -0.18 0.00 0.00 0.00 0.00 60.65 58.86 1tl5 s ILE 33 Cb -0.15 -1.84 -0.03 0.00 0.01 0.00 0.00 42.46 40.45 1tl5 s ILE 33 CO 0.05 -0.60 0.51 -0.62 0.00 0.00 0.00 174.94 174.28 1tl5 s ASP 34 N 1.48 6.44 -0.08 3.58 -1.08 0.85 -5.00 116.67 122.87 1tl5 s ASP 34 Ca 0.08 0.53 -0.14 0.00 -0.52 0.00 0.00 52.55 52.50 1tl5 s ASP 34 Cb -0.18 -2.28 -0.11 0.00 -1.46 0.00 0.00 42.92 38.89 1tl5 s ASP 34 CO -0.20 -0.27 0.53 -0.07 0.52 0.00 0.00 175.17 175.68 1tl5 h LEU 35 N 8.65 -0.14 -0.85 -1.34 -0.00 -1.96 -1.42 115.31 118.25 1tl5 h LEU 35 Ca -0.30 -0.28 0.07 0.00 -0.00 0.00 0.00 57.88 57.38 1tl5 h LEU 35 Cb 1.14 0.04 -0.07 0.00 -0.00 0.00 0.00 40.66 41.77 1tl5 h LEU 35 CO 0.72 0.44 0.52 1.55 -0.00 0.00 0.00 178.44 181.67 1tl5 h PRO 36 N -0.98 0.89 0.00 1.13 0.13 -1.96 -1.40 132.00 129.81 1tl5 h PRO 36 Ca -0.02 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 1tl5 h PRO 36 Cb 0.41 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 31.34 1tl5 h PRO 36 CO 0.03 0.59 -0.39 0.09 -0.23 0.00 0.00 178.00 178.09 1tl5 n ASN 37 N -4.65 0.64 -3.64 1.44 3.02 -1.26 -4.96 115.26 105.84 1tl5 n ASN 37 Ca 0.13 0.22 -0.22 0.00 -0.03 0.00 0.00 54.58 54.68 1tl5 n ASN 37 Cb 0.21 -0.13 0.04 0.00 -0.61 0.00 0.00 39.78 39.29 1tl5 n ASN 37 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1tl5 n LYS 38 N -2.01 -3.96 -4.39 3.52 4.01 -0.53 -4.86 118.16 109.94 1tl5 n LYS 38 Ca 0.04 0.62 -0.24 0.00 -0.51 0.00 0.00 58.31 58.23 1tl5 n LYS 38 Cb 0.41 -5.07 -0.11 0.00 -0.51 0.00 0.00 35.03 29.75 1tl5 n LYS 38 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1tl5 s LYS 39 N -5.79 1.44 -0.01 1.97 1.02 -0.59 -0.49 119.74 117.29 1tl5 s LYS 39 Ca 0.14 -1.54 0.04 0.00 0.02 0.00 0.00 55.97 54.63 1tl5 s LYS 39 Cb -0.04 -1.57 -0.01 0.00 -0.52 0.00 0.00 37.83 35.70 1tl5 s LYS 39 CO 0.81 0.32 -0.14 0.08 -0.92 0.00 0.00 175.35 175.50 1tl5 s VAL 40 N -2.10 1.09 -0.07 3.17 1.01 0.25 -0.10 120.40 123.65 1tl5 s VAL 40 Ca 0.21 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.61 1tl5 s VAL 40 Cb -0.06 -0.91 0.02 0.00 0.00 0.00 0.00 36.38 35.43 1tl5 s VAL 40 CO 0.09 0.31 -0.07 0.00 0.00 0.00 0.00 175.10 175.44 1tl5 s ILE 42 N 1.10 1.35 -0.22 0.00 1.01 0.14 -0.72 121.20 123.85 1tl5 s ILE 42 Ca -0.08 -0.51 -0.08 0.00 0.00 0.00 0.00 60.65 59.99 1tl5 s ILE 42 Cb -0.14 -1.29 -0.04 0.00 0.01 0.00 0.00 42.46 41.00 1tl5 s ILE 42 CO -0.01 0.42 0.09 -0.70 0.00 0.00 0.00 174.94 174.74 1tl5 s GLU 43 N 1.45 3.87 0.39 2.79 -6.30 0.09 -0.43 118.70 120.55 1tl5 s GLU 43 Ca 0.02 -0.38 -0.14 0.00 -2.50 0.00 0.00 54.97 51.97 1tl5 s GLU 43 Cb -0.13 -3.33 0.05 0.00 0.00 0.00 0.00 34.13 30.72 1tl5 s GLU 43 CO -0.08 0.04 0.77 0.45 0.02 0.00 0.00 175.26 176.46 1tl5 s SER 44 N 1.02 0.10 0.00 -1.70 0.15 -1.25 -1.02 113.70 111.01 1tl5 s SER 44 Ca 0.05 -1.21 0.25 0.00 0.70 0.00 0.00 55.95 55.74 1tl5 s SER 44 Cb -0.14 0.84 0.39 0.00 -1.71 0.00 0.00 66.02 65.41 1tl5 s SER 44 CO 0.03 -1.68 1.36 -0.62 1.20 0.00 0.00 173.24 173.54 1tl5 n GLU 45 N -0.54 1.94 -1.94 5.44 1.02 -1.26 0.37 120.64 125.67 1tl5 n GLU 45 Ca -0.08 -1.50 -0.42 0.00 -0.02 0.00 0.00 57.16 55.14 1tl5 n GLU 45 Cb 0.60 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.52 1tl5 n GLU 45 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1tl5 s HIS 46 N -2.09 2.78 0.46 -0.32 3.76 -1.26 -4.94 115.29 113.68 1tl5 s HIS 46 Ca 0.29 0.50 -0.24 0.00 -0.15 0.00 0.00 55.06 55.45 1tl5 s HIS 46 Cb 0.20 -3.94 -0.07 0.00 1.11 0.00 0.00 32.58 29.88 1tl5 s HIS 46 CO 0.36 -3.59 1.32 0.45 -0.85 0.00 0.00 174.74 172.43 1tl5 s SER 47 N 1.71 5.91 0.24 1.40 0.15 -1.26 -4.78 113.70 117.07 1tl5 s SER 47 Ca 0.72 2.68 -0.12 0.00 0.70 0.00 0.00 55.95 59.92 1tl5 s SER 47 Cb -0.42 -2.63 0.32 0.00 -1.71 0.00 0.00 66.02 61.58 1tl5 s SER 47 CO 0.32 -1.12 1.59 -0.03 1.20 0.00 0.00 173.24 175.19 1tl5 h MET 48 N 2.17 -0.02 -0.66 5.44 4.05 -1.95 -0.19 114.93 123.77 1tl5 h MET 48 Ca -0.50 0.00 0.06 0.00 -0.28 0.00 0.00 59.70 58.98 1tl5 h MET 48 Cb 1.26 0.00 -0.08 0.00 -0.80 0.00 0.00 31.60 31.99 1tl5 h MET 48 CO 0.60 -0.01 -0.43 0.22 0.23 0.00 0.00 176.91 177.52 1tl5 h ASP 49 N -0.02 -1.56 -0.18 1.39 3.58 -1.99 0.45 116.42 118.09 1tl5 h ASP 49 Ca 0.37 0.23 -0.02 0.00 0.42 0.00 0.00 57.03 58.04 1tl5 h ASP 49 Cb 0.60 0.68 -0.01 0.00 1.72 0.00 0.00 39.33 42.32 1tl5 h ASP 49 CO -0.84 -0.19 0.04 0.74 -2.88 0.00 0.00 179.24 176.10 1tl5 h THR 50 N -0.05 1.21 -0.17 2.25 2.02 -1.47 0.77 112.91 117.47 1tl5 h THR 50 Ca 0.11 -0.67 0.05 0.00 0.77 0.00 0.00 66.41 66.67 1tl5 h THR 50 Cb 0.33 1.31 -0.06 0.00 -1.74 0.00 0.00 68.15 67.99 1tl5 h THR 50 CO -0.65 0.20 -0.22 -0.07 0.37 0.00 0.00 175.52 175.16 1tl5 h LEU 51 N 0.09 -0.68 0.21 2.58 3.38 -0.88 0.34 115.31 120.35 1tl5 h LEU 51 Ca 0.06 0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.15 1tl5 h LEU 51 Cb 0.28 0.31 -0.04 0.00 0.09 0.00 0.00 40.66 41.30 1tl5 h LEU 51 CO 0.00 -0.26 -0.48 0.25 0.09 0.00 0.00 178.44 178.04 1tl5 h LEU 52 N -0.26 -1.39 -1.59 1.67 7.12 -0.20 0.11 115.31 120.78 1tl5 h LEU 52 Ca 0.11 0.14 0.03 0.00 0.13 0.00 0.00 57.88 58.30 1tl5 h LEU 52 Cb 0.43 0.50 -0.03 0.00 -0.53 0.00 0.00 40.66 41.03 1tl5 h LEU 52 CO -0.32 -0.55 0.33 0.00 -0.13 0.00 0.00 178.44 177.77 1tl5 h ALA 53 N -0.45 1.79 0.52 1.25 0.00 -0.57 0.66 119.26 122.45 1tl5 h ALA 53 Ca -0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1tl5 h ALA 53 Cb 0.75 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.40 1tl5 h ALA 53 CO -0.22 0.15 -0.25 1.15 0.00 0.00 0.00 179.25 180.09 1tl5 h THR 54 N 0.54 0.00 -0.36 0.00 2.02 -0.64 -3.37 112.91 111.11 1tl5 h THR 54 Ca 0.20 -0.29 -0.04 0.00 0.77 0.00 0.00 66.41 67.05 1tl5 h THR 54 Cb 0.12 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.52 1tl5 h THR 54 CO -0.05 0.00 0.04 0.17 0.37 0.00 0.00 175.52 176.05 1tl5 h LEU 55 N -0.98 0.49 -0.67 2.58 8.10 -0.10 -2.85 115.31 121.89 1tl5 h LEU 55 Ca -0.07 -0.08 0.26 0.00 0.11 0.00 0.00 57.88 58.10 1tl5 h LEU 55 Cb 0.53 -0.13 -0.12 0.00 -0.44 0.00 0.00 40.66 40.50 1tl5 h LEU 55 CO 0.12 0.53 0.29 1.17 -4.11 0.00 0.00 178.44 176.44 1tl5 n LYS 56 N -4.31 -0.04 0.22 0.17 4.81 0.16 -0.87 118.16 118.30 1tl5 n LYS 56 Ca 0.02 0.94 0.13 0.00 -0.87 0.00 0.00 58.31 58.53 1tl5 n LYS 56 Cb 0.22 -1.64 0.70 0.00 0.02 0.00 0.00 35.03 34.32 1tl5 n LYS 56 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 1tl5 h LYS 57 N 0.00 0.00 -0.34 1.64 1.57 -1.72 0.27 116.57 117.99 1tl5 h LYS 57 Ca 0.54 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 59.40 1tl5 h LYS 57 Cb 1.37 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.67 1tl5 h LYS 57 CO -0.54 0.00 0.24 1.79 -0.57 0.00 0.00 179.45 180.38 1tl5 h THR 58 N 0.00 0.86 -4.60 -0.16 1.35 -1.27 -3.46 112.91 105.62 1tl5 h THR 58 Ca 0.00 -0.02 -0.26 0.00 -0.55 0.00 0.00 66.41 65.58 1tl5 h THR 58 Cb 0.19 0.80 0.11 0.00 -1.73 0.00 0.00 68.15 67.52 1tl5 h THR 58 CO 0.00 0.01 -0.53 0.61 -0.25 0.00 0.00 175.52 175.36 1tl5 n GLY 59 N -1.59 -0.14 3.40 5.82 0.00 0.08 -5.04 105.19 107.73 1tl5 n GLY 59 Ca 0.05 -0.03 -0.20 0.00 0.00 0.00 0.00 46.02 45.84 1tl5 n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tl5 s LYS 60 N -5.40 1.52 0.00 1.61 -0.14 -1.26 -5.04 119.74 111.03 1tl5 s LYS 60 Ca 0.18 -1.81 -0.02 0.00 -1.36 0.00 0.00 55.97 52.96 1tl5 s LYS 60 Cb -0.08 -0.81 -0.10 0.00 -1.68 0.00 0.00 37.83 35.16 1tl5 s LYS 60 CO 0.53 -0.12 2.09 2.41 -0.76 0.00 0.00 175.35 179.50 1tl5 n THR 61 N -0.57 1.76 -2.57 2.17 -1.04 -1.26 -4.80 114.28 107.96 1tl5 n THR 61 Ca -0.04 -0.73 -0.41 0.00 -2.04 0.00 0.00 64.05 60.83 1tl5 n THR 61 Cb 0.65 -1.63 -0.03 0.00 -1.82 0.00 0.00 70.33 67.51 1tl5 n THR 61 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1tl5 s VAL 62 N 1.20 3.94 0.63 12.58 0.11 -1.26 -3.72 120.40 133.89 1tl5 s VAL 62 Ca 0.26 -0.83 -0.04 0.00 -2.93 0.00 0.00 61.98 58.44 1tl5 s VAL 62 Cb 0.12 -5.06 0.04 0.00 -1.53 0.00 0.00 36.38 29.96 1tl5 s VAL 62 CO 0.00 -1.94 0.92 -0.55 -3.33 0.00 0.00 175.10 170.20 1tl5 s SER 63 N 4.92 5.09 -0.23 3.54 0.15 0.23 -4.92 113.70 122.47 1tl5 s SER 63 Ca 0.46 0.34 -0.06 0.00 0.70 0.00 0.00 55.95 57.39 1tl5 s SER 63 Cb 0.00 -1.13 -0.02 0.00 -1.71 0.00 0.00 66.02 63.16 1tl5 s SER 63 CO -0.09 -1.36 0.03 -0.47 1.20 0.00 0.00 173.24 172.55 1tl5 s TYR 64 N -3.04 3.05 -0.45 3.44 5.04 -1.26 -2.30 117.35 121.82 1tl5 s TYR 64 Ca 0.58 -0.51 0.06 0.00 -2.44 0.00 0.00 57.07 54.75 1tl5 s TYR 64 Cb -0.11 -2.17 0.18 0.00 0.35 0.00 0.00 41.96 40.21 1tl5 s TYR 64 CO 0.43 -0.35 0.57 -0.48 -1.34 0.00 0.00 175.55 174.38 1tl5 s LEU 65 N 1.40 -0.64 0.00 6.97 -0.00 0.40 -4.94 118.68 121.87 1tl5 s LEU 65 Ca 0.05 -1.84 0.00 0.00 -0.00 0.00 0.00 54.13 52.34 1tl5 s LEU 65 Cb -0.15 1.20 0.00 0.00 -0.00 0.00 0.00 46.19 47.24 1tl5 s LEU 65 CO 0.02 -0.13 0.00 0.61 -0.00 0.00 0.00 176.35 176.85 1tl5 n GLY 66 N 3.37 4.01 3.08 -3.48 0.00 -1.18 -4.47 105.19 106.51 1tl5 n GLY 66 Ca 0.18 -1.51 -0.12 0.00 0.00 0.00 0.00 46.02 44.57 1tl5 n GLY 66 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1tl5 s LEU 67 N 0.00 0.03 0.00 0.99 2.34 -1.26 -0.50 118.68 120.28 1tl5 s LEU 67 Ca 0.00 0.63 0.00 0.00 0.06 0.00 0.00 54.13 54.82 1tl5 s LEU 67 Cb 0.00 0.84 0.00 0.00 -0.56 0.00 0.00 46.19 46.47 1tl5 s LEU 67 CO 0.00 -0.20 0.00 1.21 -1.06 0.00 0.00 176.35 176.30