#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 2.05 0.18 0.03 0.04 -1.26 -4.94 135.00 131.10 1tl5 s PRO 2 Ca 0.00 1.63 0.08 0.00 0.04 0.00 0.00 61.00 62.74 1tl5 s PRO 2 Cb 0.00 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.66 1tl5 s PRO 2 CO 0.00 -1.87 -0.02 -1.59 0.04 0.00 0.00 177.00 173.56 1tl5 s LYS 3 N -4.14 2.33 -0.14 4.56 -2.85 0.49 -4.46 119.74 115.53 1tl5 s LYS 3 Ca 0.71 -1.15 -0.03 0.00 -1.00 0.00 0.00 55.97 54.50 1tl5 s LYS 3 Cb -0.26 -2.31 -0.03 0.00 -2.06 0.00 0.00 37.83 33.17 1tl5 s LYS 3 CO 0.48 0.45 -0.05 -1.01 0.10 0.00 0.00 175.35 175.32 1tl5 s HIS 4 N -1.75 3.00 0.17 1.78 3.76 0.58 -0.63 115.29 122.20 1tl5 s HIS 4 Ca 0.27 -0.29 -0.14 0.00 -0.15 0.00 0.00 55.06 54.76 1tl5 s HIS 4 Cb -0.09 -1.92 -0.07 0.00 1.11 0.00 0.00 32.58 31.61 1tl5 s HIS 4 CO 0.18 -0.00 0.56 -1.21 -0.85 0.00 0.00 174.74 173.42 1tl5 s GLU 5 N 0.21 3.95 -0.07 1.40 0.41 0.32 -0.74 118.70 124.19 1tl5 s GLU 5 Ca -0.03 0.47 -0.05 0.00 -0.41 0.00 0.00 54.97 54.95 1tl5 s GLU 5 Cb -0.14 -2.85 0.02 0.00 -1.78 0.00 0.00 34.13 29.38 1tl5 s GLU 5 CO 0.03 0.43 0.17 -0.06 -0.49 0.00 0.00 175.26 175.34 1tl5 s PHE 6 N -1.56 -0.19 -0.09 1.61 0.40 0.85 -0.45 117.98 118.55 1tl5 s PHE 6 Ca 0.40 0.49 -0.02 0.00 -0.60 0.00 0.00 56.93 57.21 1tl5 s PHE 6 Cb -0.14 0.03 -0.03 0.00 0.51 0.00 0.00 43.02 43.38 1tl5 s PHE 6 CO 0.20 -0.12 -0.01 -1.12 0.70 0.00 0.00 175.22 174.87 1tl5 s SER 7 N 0.47 5.14 0.21 1.36 0.01 -0.97 -0.81 113.70 119.11 1tl5 s SER 7 Ca -0.03 0.11 0.06 0.00 1.31 0.00 0.00 55.95 57.39 1tl5 s SER 7 Cb -0.05 -1.46 -0.05 0.00 0.21 0.00 0.00 66.02 64.67 1tl5 s SER 7 CO -0.02 0.36 -0.08 -0.69 0.41 0.00 0.00 173.24 173.21 1tl5 s VAL 8 N -0.77 1.43 0.09 3.43 1.01 0.22 -0.28 120.40 125.53 1tl5 s VAL 8 Ca 0.12 -2.12 0.09 0.00 0.00 0.00 0.00 61.98 60.07 1tl5 s VAL 8 Cb -0.11 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 1tl5 s VAL 8 CO 0.02 -0.51 -0.23 -0.62 0.00 0.00 0.00 175.10 173.77 1tl5 s ASP 9 N -3.31 3.51 -0.24 3.32 2.15 -1.23 -4.68 116.67 116.19 1tl5 s ASP 9 Ca 0.24 -0.60 -0.04 0.00 0.43 0.00 0.00 52.55 52.58 1tl5 s ASP 9 Cb 0.02 -0.39 0.09 0.00 -0.30 0.00 0.00 42.92 42.35 1tl5 s ASP 9 CO 0.07 0.22 0.16 -0.04 -0.17 0.00 0.00 175.17 175.41 1tl5 s MET 10 N -1.74 0.18 0.07 4.34 -1.94 -1.26 -4.60 119.30 114.34 1tl5 s MET 10 Ca 0.14 -0.21 -0.08 0.00 -1.71 0.00 0.00 55.69 53.83 1tl5 s MET 10 Cb -0.10 -1.27 -0.28 0.00 2.01 0.00 0.00 34.83 35.18 1tl5 s MET 10 CO 0.06 -0.86 1.12 1.79 -0.01 0.00 0.00 175.02 177.12 1tl5 h THR 11 N 6.37 1.42 -3.57 2.05 1.35 -2.00 -3.46 112.91 115.08 1tl5 h THR 11 Ca -0.17 -2.87 -0.41 0.00 -0.55 0.00 0.00 66.41 62.41 1tl5 h THR 11 Cb 1.08 2.90 -0.18 0.00 -1.73 0.00 0.00 68.15 70.23 1tl5 h THR 11 CO 0.35 0.85 -0.76 0.00 -0.25 0.00 0.00 175.52 175.71 1tl5 h GLY 13 N 3.49 1.76 1.83 0.00 0.00 -2.02 0.91 103.07 109.04 1tl5 h GLY 13 Ca -0.40 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 46.66 1tl5 h GLY 13 CO 0.51 -0.25 0.06 -1.33 0.00 0.00 0.00 176.54 175.54 1tl5 h GLY 14 N 0.51 0.00 0.93 4.60 0.00 -1.99 0.18 103.07 107.30 1tl5 h GLY 14 Ca 0.65 0.00 0.02 0.00 0.00 0.00 0.00 47.33 48.00 1tl5 h GLY 14 CO -0.45 0.00 0.63 0.00 0.00 0.00 0.00 176.54 176.72 1tl5 h ALA 16 N 1.37 0.90 -0.20 0.00 0.00 -0.82 -0.34 119.26 120.17 1tl5 h ALA 16 Ca 0.37 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.23 1tl5 h ALA 16 Cb -0.06 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.40 1tl5 h ALA 16 CO -0.10 0.38 -0.12 0.93 0.00 0.00 0.00 179.25 180.34 1tl5 h GLU 17 N 0.96 -0.10 -0.27 0.00 5.08 -1.44 0.38 114.58 119.19 1tl5 h GLU 17 Ca 0.25 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.68 1tl5 h GLU 17 Cb -0.01 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.19 1tl5 h GLU 17 CO -0.04 -0.07 -0.26 0.00 -1.00 0.00 0.00 179.01 177.63 1tl5 h ALA 18 N 1.05 -0.15 -0.12 3.43 0.00 0.52 0.26 119.26 124.26 1tl5 h ALA 18 Ca 0.11 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.15 1tl5 h ALA 18 Cb 0.28 0.55 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 1tl5 h ALA 18 CO -0.27 -0.69 -0.33 0.28 0.00 0.00 0.00 179.25 178.24 1tl5 h VAL 19 N -0.26 0.27 -0.66 0.00 2.07 -0.95 -2.45 116.25 114.28 1tl5 h VAL 19 Ca 0.14 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.80 1tl5 h VAL 19 Cb 0.48 0.27 -0.10 0.00 -1.52 0.00 0.00 31.29 30.43 1tl5 h VAL 19 CO -0.42 0.00 0.15 -1.28 0.02 0.00 0.00 177.57 176.04 1tl5 h SER 20 N -0.41 0.00 0.32 0.57 0.87 0.10 -0.51 113.55 114.48 1tl5 h SER 20 Ca 0.09 0.13 -0.01 0.00 -1.23 0.00 0.00 61.79 60.77 1tl5 h SER 20 Cb 0.56 0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.69 1tl5 h SER 20 CO -0.35 -0.01 -0.19 0.03 -0.53 0.00 0.00 176.83 175.77 1tl5 h ARG 21 N 0.27 -0.47 -0.59 2.24 3.08 -0.09 0.17 114.38 118.98 1tl5 h ARG 21 Ca 0.36 0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.39 1tl5 h ARG 21 Cb 0.56 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 1tl5 h ARG 21 CO -0.45 -0.32 0.16 -0.24 -1.07 0.00 0.00 179.97 178.06 1tl5 h VAL 22 N -0.49 1.25 -0.79 2.04 3.04 -1.28 -0.11 116.25 119.91 1tl5 h VAL 22 Ca -0.03 -0.86 -0.04 0.00 -1.01 0.00 0.00 66.70 64.75 1tl5 h VAL 22 Cb 0.41 0.69 -0.04 0.00 -2.01 0.00 0.00 31.29 30.34 1tl5 h VAL 22 CO 0.03 0.32 0.33 -0.07 -1.01 0.00 0.00 177.57 177.18 1tl5 h LEU 23 N 0.84 1.07 -1.17 3.16 -0.00 -0.85 0.80 115.31 119.16 1tl5 h LEU 23 Ca 0.19 -0.16 -0.06 0.00 -0.00 0.00 0.00 57.88 57.85 1tl5 h LEU 23 Cb 0.32 -0.28 -0.02 0.00 -0.00 0.00 0.00 40.66 40.69 1tl5 h LEU 23 CO -0.00 0.94 -0.04 0.78 -0.00 0.00 0.00 178.44 180.12 1tl5 h ASN 24 N 1.14 0.50 -0.74 -0.43 2.35 -0.36 0.12 115.58 118.17 1tl5 h ASN 24 Ca 0.27 -0.10 0.02 0.00 -0.55 0.00 0.00 56.30 55.93 1tl5 h ASN 24 Cb 0.19 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.39 1tl5 h ASN 24 CO -0.02 0.60 0.48 0.11 -1.65 0.00 0.00 177.43 176.94 1tl5 h LYS 25 N 0.50 0.94 -0.39 0.81 6.56 0.02 -3.04 116.57 121.97 1tl5 h LYS 25 Ca 0.10 -0.06 -0.03 0.00 -1.06 0.00 0.00 60.65 59.61 1tl5 h LYS 25 Cb 0.38 -0.21 -0.02 0.00 -0.57 0.00 0.00 32.23 31.81 1tl5 h LYS 25 CO 0.02 0.62 0.12 1.25 -2.06 0.00 0.00 179.45 179.40 1tl5 h LEU 26 N 0.97 0.56 0.00 2.94 7.12 0.35 -3.47 115.31 123.77 1tl5 h LEU 26 Ca 0.28 -0.20 0.00 0.00 0.13 0.00 0.00 57.88 58.09 1tl5 h LEU 26 Cb -0.07 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 39.92 1tl5 h LEU 26 CO -0.08 0.61 0.00 0.61 -0.13 0.00 0.00 178.44 179.46 1tl5 n GLY 27 N -0.66 2.33 2.28 3.75 0.00 0.30 -4.88 105.19 108.31 1tl5 n GLY 27 Ca -0.01 -0.69 -0.32 0.00 0.00 0.00 0.00 46.02 45.01 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 4.14 3.11 -0.02 0.00 -1.26 -4.86 105.19 106.29 1tl5 n GLY 28 Ca 0.00 -1.56 -0.14 0.00 0.00 0.00 0.00 46.02 44.32 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 1.01 0.75 -0.16 1.61 0.11 -1.26 -4.59 120.40 117.87 1tl5 s VAL 29 Ca 0.66 -1.27 0.01 0.00 -2.93 0.00 0.00 61.98 58.45 1tl5 s VAL 29 Cb 0.23 -0.89 0.01 0.00 -1.53 0.00 0.00 36.38 34.19 1tl5 s VAL 29 CO -0.06 -0.40 -0.18 -0.75 -3.33 0.00 0.00 175.10 170.38 1tl5 s LYS 30 N -1.93 3.10 -0.38 1.54 2.47 -0.26 -5.04 119.74 119.24 1tl5 s LYS 30 Ca -0.05 -0.80 0.03 0.00 -1.56 0.00 0.00 55.97 53.59 1tl5 s LYS 30 Cb -0.08 -2.56 0.11 0.00 -1.46 0.00 0.00 37.83 33.84 1tl5 s LYS 30 CO 0.01 -0.06 0.13 1.52 0.16 0.00 0.00 175.35 177.10 1tl5 s TYR 31 N 0.96 2.98 -0.31 4.03 1.13 -1.26 -0.46 117.35 124.43 1tl5 s TYR 31 Ca -0.03 -2.70 -0.21 0.00 -1.41 0.00 0.00 57.07 52.73 1tl5 s TYR 31 Cb -0.15 -2.52 -0.01 0.00 -1.10 0.00 0.00 41.96 38.19 1tl5 s TYR 31 CO -0.04 -0.87 0.65 -0.51 -2.51 0.00 0.00 175.55 172.27 1tl5 s ASP 32 N 0.74 6.51 -0.23 -0.18 1.01 0.66 -4.91 116.67 120.28 1tl5 s ASP 32 Ca 0.13 0.45 -0.08 0.00 0.71 0.00 0.00 52.55 53.76 1tl5 s ASP 32 Cb -0.21 -2.34 -0.04 0.00 1.01 0.00 0.00 42.92 41.35 1tl5 s ASP 32 CO -0.09 -0.49 0.08 -0.63 0.21 0.00 0.00 175.17 174.24 1tl5 s ILE 33 N 2.65 4.57 -0.29 0.77 1.09 -1.26 -0.76 121.20 127.96 1tl5 s ILE 33 Ca 0.26 -0.09 -0.20 0.00 -1.10 0.00 0.00 60.65 59.51 1tl5 s ILE 33 Cb -0.15 -3.11 -0.01 0.00 -1.06 0.00 0.00 42.46 38.13 1tl5 s ILE 33 CO 0.12 0.38 0.64 -0.62 -0.10 0.00 0.00 174.94 175.35 1tl5 s ASP 34 N 1.15 6.53 -0.07 3.58 -1.08 0.65 -4.99 116.67 122.44 1tl5 s ASP 34 Ca 0.05 0.52 -0.05 0.00 -0.52 0.00 0.00 52.55 52.54 1tl5 s ASP 34 Cb -0.14 -2.34 -0.03 0.00 -1.46 0.00 0.00 42.92 38.95 1tl5 s ASP 34 CO 0.03 -0.45 0.23 0.25 0.52 0.00 0.00 175.17 175.75 1tl5 h LEU 35 N 9.11 -0.16 -0.40 -1.34 5.85 -1.96 -0.28 115.31 126.11 1tl5 h LEU 35 Ca -0.27 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.53 1tl5 h LEU 35 Cb 1.12 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 42.13 1tl5 h LEU 35 CO 0.80 0.28 0.06 1.55 -0.34 0.00 0.00 178.44 180.78 1tl5 h PRO 36 N -0.98 0.18 -0.00 5.25 0.13 -1.97 -1.05 132.00 133.56 1tl5 h PRO 36 Ca -0.02 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1tl5 h PRO 36 Cb 0.15 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.24 1tl5 h PRO 36 CO 0.03 0.12 -0.03 0.09 -0.23 0.00 0.00 178.00 177.98 1tl5 n ASN 37 N -5.12 0.13 -3.39 1.44 3.02 -1.26 -4.95 115.26 105.13 1tl5 n ASN 37 Ca 0.03 -0.40 -0.18 0.00 -0.03 0.00 0.00 54.58 54.00 1tl5 n ASN 37 Cb 0.19 -0.18 0.04 0.00 -0.61 0.00 0.00 39.78 39.22 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 -1.15 -1.65 -4.11 3.52 5.02 -0.40 -4.85 118.16 114.55 1tl5 n LYS 38 Ca 0.16 0.87 -0.12 0.00 -2.02 0.00 0.00 58.31 57.20 1tl5 n LYS 38 Cb 0.23 -5.01 -0.11 0.00 -0.02 0.00 0.00 35.03 30.13 1tl5 n LYS 38 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1tl5 s LYS 39 N -4.63 0.67 -0.03 1.97 1.02 -0.14 -0.61 119.74 117.98 1tl5 s LYS 39 Ca 0.33 -1.03 0.02 0.00 0.02 0.00 0.00 55.97 55.31 1tl5 s LYS 39 Cb -0.08 -0.24 0.01 0.00 -0.52 0.00 0.00 37.83 37.00 1tl5 s LYS 39 CO 0.79 0.01 -0.08 0.08 -0.92 0.00 0.00 175.35 175.24 1tl5 s VAL 40 N -2.47 0.71 -0.06 3.17 1.01 0.01 -0.25 120.40 122.52 1tl5 s VAL 40 Ca 0.00 -0.30 0.04 0.00 0.00 0.00 0.00 61.98 61.73 1tl5 s VAL 40 Cb -0.03 -0.65 -0.00 0.00 0.00 0.00 0.00 36.38 35.70 1tl5 s VAL 40 CO -0.02 0.24 -0.19 0.00 0.00 0.00 0.00 175.10 175.12 1tl5 s ILE 42 N 0.16 1.37 -0.20 0.00 1.01 0.08 -0.25 121.20 123.38 1tl5 s ILE 42 Ca -0.08 -0.55 -0.04 0.00 0.00 0.00 0.00 60.65 59.98 1tl5 s ILE 42 Cb -0.14 -1.28 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 1tl5 s ILE 42 CO 0.04 0.42 -0.04 -0.70 0.00 0.00 0.00 174.94 174.66 1tl5 s GLU 43 N 1.17 3.45 0.35 2.79 -6.30 0.39 -0.31 118.70 120.24 1tl5 s GLU 43 Ca -0.03 -0.60 -0.15 0.00 -2.50 0.00 0.00 54.97 51.69 1tl5 s GLU 43 Cb -0.14 -2.97 0.04 0.00 0.00 0.00 0.00 34.13 31.05 1tl5 s GLU 43 CO -0.04 -0.07 0.71 0.45 0.02 0.00 0.00 175.26 176.34 1tl5 s SER 44 N 1.15 0.06 0.45 -1.70 0.15 -1.26 -1.11 113.70 111.44 1tl5 s SER 44 Ca 0.02 -1.06 0.25 0.00 0.70 0.00 0.00 55.95 55.87 1tl5 s SER 44 Cb -0.15 0.78 0.59 0.00 -1.71 0.00 0.00 66.02 65.53 1tl5 s SER 44 CO -0.00 -1.52 1.70 -0.33 1.20 0.00 0.00 173.24 174.28 1tl5 h GLU 45 N 2.03 0.00 -6.47 5.44 5.08 -1.94 -3.46 114.58 115.26 1tl5 h GLU 45 Ca -0.28 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.54 1tl5 h GLU 45 Cb 1.25 0.00 0.04 0.00 0.50 0.00 0.00 28.75 30.53 1tl5 h GLU 45 CO 0.36 0.00 1.13 0.72 -1.00 0.00 0.00 179.01 180.22 1tl5 n HIS 46 N -3.06 2.58 -1.71 4.33 8.25 -1.26 -4.90 115.22 119.45 1tl5 n HIS 46 Ca 0.03 -0.18 -0.40 0.00 -0.26 0.00 0.00 57.72 56.92 1tl5 n HIS 46 Cb 0.47 -2.74 0.02 0.00 1.12 0.00 0.00 29.99 28.87 1tl5 n HIS 46 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1tl5 n SER 47 N 5.99 2.51 -0.36 0.41 2.88 -1.26 -4.75 113.62 119.04 1tl5 n SER 47 Ca 0.19 1.05 0.03 0.00 -1.33 0.00 0.00 58.87 58.81 1tl5 n SER 47 Cb 0.37 -1.52 0.10 0.00 -0.75 0.00 0.00 64.21 62.41 1tl5 n SER 47 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 1tl5 n MET 48 N -0.31 -0.14 -0.12 -1.46 1.56 -1.26 -1.19 117.12 114.20 1tl5 n MET 48 Ca 0.08 1.50 -0.11 0.00 -0.27 0.00 0.00 57.70 58.90 1tl5 n MET 48 Cb 0.42 -2.23 -0.02 0.00 2.15 0.00 0.00 33.22 33.53 1tl5 n MET 48 CO 0.00 0.00 0.00 0.22 -0.73 0.00 0.00 175.97 175.46 1tl5 h ASP 49 N 0.00 0.60 -0.53 6.12 3.58 -1.98 0.19 116.42 124.40 1tl5 h ASP 49 Ca 0.42 -0.30 0.09 0.00 0.42 0.00 0.00 57.03 57.66 1tl5 h ASP 49 Cb 0.66 -0.16 -0.07 0.00 1.72 0.00 0.00 39.33 41.47 1tl5 h ASP 49 CO -0.98 0.75 0.11 0.74 -2.88 0.00 0.00 179.24 176.99 1tl5 h THR 50 N 0.43 0.70 0.46 2.25 2.02 -1.53 0.22 112.91 117.46 1tl5 h THR 50 Ca 0.10 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 1tl5 h THR 50 Cb 0.44 0.43 -0.00 0.00 -1.74 0.00 0.00 68.15 67.28 1tl5 h THR 50 CO 0.02 0.05 -0.30 -0.07 0.37 0.00 0.00 175.52 175.58 1tl5 h LEU 51 N 0.25 -0.78 -0.84 2.58 3.38 -0.87 -2.15 115.31 116.89 1tl5 h LEU 51 Ca 0.27 0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.36 1tl5 h LEU 51 Cb 0.37 0.23 -0.10 0.00 0.09 0.00 0.00 40.66 41.25 1tl5 h LEU 51 CO -0.34 -0.45 -0.49 -0.11 0.09 0.00 0.00 178.44 177.13 1tl5 n LEU 52 N -4.23 -0.89 -0.35 1.67 0.00 0.03 -0.40 117.00 112.83 1tl5 n LEU 52 Ca -0.09 1.57 0.08 0.00 0.00 0.00 0.00 56.01 57.57 1tl5 n LEU 52 Cb 0.30 -0.23 0.26 0.00 0.00 0.00 0.00 43.42 43.75 1tl5 n LEU 52 CO 0.20 -1.25 1.23 0.00 0.00 0.00 0.00 177.39 177.57 1tl5 h ALA 53 N 0.34 1.55 0.29 1.96 0.00 -0.64 0.11 119.26 122.88 1tl5 h ALA 53 Ca 0.13 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1tl5 h ALA 53 Cb 0.34 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1tl5 h ALA 53 CO -0.79 0.20 -0.14 1.15 0.00 0.00 0.00 179.25 179.67 1tl5 h THR 54 N 0.96 0.00 0.00 0.00 2.02 -0.03 -3.36 112.91 112.51 1tl5 h THR 54 Ca 0.49 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 67.53 1tl5 h THR 54 Cb 0.52 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1tl5 h THR 54 CO -0.26 0.00 -0.10 0.17 0.37 0.00 0.00 175.52 175.70 1tl5 h LEU 55 N -0.52 0.00 -0.98 2.58 8.10 -0.43 -0.76 115.31 123.30 1tl5 h LEU 55 Ca -0.04 0.00 0.32 0.00 0.11 0.00 0.00 57.88 58.27 1tl5 h LEU 55 Cb 0.30 0.00 -0.18 0.00 -0.44 0.00 0.00 40.66 40.35 1tl5 h LEU 55 CO 0.07 0.10 0.25 0.11 -4.11 0.00 0.00 178.44 174.86 1tl5 h LYS 56 N 0.00 0.04 0.00 0.17 1.57 -0.92 -0.49 116.57 116.93 1tl5 h LYS 56 Ca -0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1tl5 h LYS 56 Cb 0.19 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1tl5 h LYS 56 CO 0.01 0.03 0.00 1.63 -0.57 0.00 0.00 179.45 180.55 1tl5 n LYS 57 N -5.36 0.01 0.20 3.15 5.02 -0.29 -0.71 118.16 120.18 1tl5 n LYS 57 Ca 0.28 0.39 0.05 0.00 -2.02 0.00 0.00 58.31 57.01 1tl5 n LYS 57 Cb 0.94 -1.52 0.48 0.00 -0.02 0.00 0.00 35.03 34.91 1tl5 n LYS 57 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1tl5 h THR 58 N 0.00 1.14 -4.73 -0.18 1.35 -1.28 -3.47 112.91 105.74 1tl5 h THR 58 Ca 0.00 -0.63 -0.38 0.00 -0.55 0.00 0.00 66.41 64.85 1tl5 h THR 58 Cb 0.12 1.29 0.09 0.00 -1.73 0.00 0.00 68.15 67.92 1tl5 h THR 58 CO 0.00 0.18 -0.60 0.61 -0.25 0.00 0.00 175.52 175.46 1tl5 n GLY 59 N -1.01 -0.46 3.90 5.82 0.00 0.12 -5.03 105.19 108.52 1tl5 n GLY 59 Ca -0.02 0.13 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 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 -5.86 2.45 0.00 1.61 -0.14 -1.26 -5.01 119.74 111.52 1tl5 s LYS 60 Ca 0.39 -1.66 0.00 0.00 -1.36 0.00 0.00 55.97 53.34 1tl5 s LYS 60 Cb -0.17 -2.34 0.00 0.00 -1.68 0.00 0.00 37.83 33.64 1tl5 s LYS 60 CO 0.48 -0.36 1.32 2.41 -0.76 0.00 0.00 175.35 178.44 1tl5 n THR 61 N -1.67 1.32 -2.52 2.17 -1.04 -1.26 -4.77 114.28 106.51 1tl5 n THR 61 Ca 0.04 -0.32 -0.40 0.00 -2.04 0.00 0.00 64.05 61.33 1tl5 n THR 61 Cb 0.62 -1.31 -0.03 0.00 -1.82 0.00 0.00 70.33 67.79 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 0.62 3.90 0.63 12.58 0.11 -1.26 -3.53 120.40 133.46 1tl5 s VAL 62 Ca 0.00 -0.82 -0.08 0.00 -2.93 0.00 0.00 61.98 58.15 1tl5 s VAL 62 Cb 0.00 -4.99 0.01 0.00 -1.53 0.00 0.00 36.38 29.86 1tl5 s VAL 62 CO 0.00 -1.87 0.98 -0.55 -3.33 0.00 0.00 175.10 170.33 1tl5 s SER 63 N 5.15 5.60 -0.17 3.54 0.15 0.62 -4.90 113.70 123.68 1tl5 s SER 63 Ca 0.48 0.93 -0.00 0.00 0.70 0.00 0.00 55.95 58.06 1tl5 s SER 63 Cb -0.00 -1.86 0.00 0.00 -1.71 0.00 0.00 66.02 62.45 1tl5 s SER 63 CO -0.08 -1.14 -0.14 -0.47 1.20 0.00 0.00 173.24 172.61 1tl5 s TYR 64 N -3.14 2.82 -0.45 3.44 5.04 -1.26 -2.28 117.35 121.52 1tl5 s TYR 64 Ca 0.55 -1.17 0.07 0.00 -2.44 0.00 0.00 57.07 54.08 1tl5 s TYR 64 Cb -0.11 -1.94 0.18 0.00 0.35 0.00 0.00 41.96 40.44 1tl5 s TYR 64 CO 0.48 -0.57 0.61 -0.48 -1.34 0.00 0.00 175.55 174.25 1tl5 s LEU 65 N 1.07 -1.05 0.00 6.97 -0.00 0.40 -4.97 118.68 121.11 1tl5 s LEU 65 Ca -0.00 -1.48 0.00 0.00 -0.00 0.00 0.00 54.13 52.64 1tl5 s LEU 65 Cb -0.14 1.54 0.00 0.00 -0.00 0.00 0.00 46.19 47.59 1tl5 s LEU 65 CO -0.04 -0.13 0.00 0.61 -0.00 0.00 0.00 176.35 176.79 1tl5 n GLY 66 N 3.65 2.35 3.42 -3.48 0.00 -1.25 -4.52 105.19 105.36 1tl5 n GLY 66 Ca 0.16 -2.14 -0.16 0.00 0.00 0.00 0.00 46.02 43.87 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 -0.10 0.00 0.99 2.34 -1.26 -0.52 118.68 120.14 1tl5 s LEU 67 Ca 0.00 0.51 0.00 0.00 0.06 0.00 0.00 54.13 54.70 1tl5 s LEU 67 Cb 0.00 2.06 0.00 0.00 -0.56 0.00 0.00 46.19 47.69 1tl5 s LEU 67 CO 0.00 -0.54 0.00 1.21 -1.06 0.00 0.00 176.35 175.96