#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 4.17 0.14 0.03 0.04 -1.26 -4.92 135.00 133.19 1tl5 s PRO 2 Ca 0.00 2.48 -0.14 0.00 0.04 0.00 0.00 61.00 63.38 1tl5 s PRO 2 Cb 0.00 -3.24 0.02 0.00 0.04 0.00 0.00 34.50 31.32 1tl5 s PRO 2 CO 0.00 -0.71 0.38 -1.59 0.04 0.00 0.00 177.00 175.12 1tl5 s LYS 3 N 1.56 1.10 -0.20 4.56 -2.85 0.14 -4.23 119.74 119.82 1tl5 s LYS 3 Ca 0.74 -0.83 -0.01 0.00 -1.00 0.00 0.00 55.97 54.87 1tl5 s LYS 3 Cb -0.46 0.45 0.06 0.00 -2.06 0.00 0.00 37.83 35.82 1tl5 s LYS 3 CO 0.32 -0.43 -0.01 -1.01 0.10 0.00 0.00 175.35 174.33 1tl5 s HIS 4 N -3.84 1.61 -0.00 1.78 3.76 0.58 -1.82 115.29 117.35 1tl5 s HIS 4 Ca 0.06 -1.20 -0.12 0.00 -0.15 0.00 0.00 55.06 53.66 1tl5 s HIS 4 Cb 0.02 -1.26 -0.05 0.00 1.11 0.00 0.00 32.58 32.40 1tl5 s HIS 4 CO -0.09 -0.66 0.35 -1.21 -0.85 0.00 0.00 174.74 172.28 1tl5 s GLU 5 N 1.66 3.77 -0.00 1.40 0.41 0.05 -0.82 118.70 125.17 1tl5 s GLU 5 Ca -0.02 0.22 0.01 0.00 -0.41 0.00 0.00 54.97 54.77 1tl5 s GLU 5 Cb -0.17 -3.15 -0.00 0.00 -1.78 0.00 0.00 34.13 29.02 1tl5 s GLU 5 CO -0.07 0.67 -0.04 -0.06 -0.49 0.00 0.00 175.26 175.27 1tl5 s PHE 6 N -1.17 0.38 -0.14 1.61 0.40 0.45 -0.23 117.98 119.27 1tl5 s PHE 6 Ca 0.25 -0.10 -0.13 0.00 -0.60 0.00 0.00 56.93 56.35 1tl5 s PHE 6 Cb -0.15 -0.24 -0.05 0.00 0.51 0.00 0.00 43.02 43.09 1tl5 s PHE 6 CO 0.13 -0.01 0.28 0.45 0.70 0.00 0.00 175.22 176.77 1tl5 s SER 7 N -0.20 6.46 -0.16 1.36 0.15 -0.57 -0.56 113.70 120.18 1tl5 s SER 7 Ca 0.01 0.54 -0.03 0.00 0.70 0.00 0.00 55.95 57.17 1tl5 s SER 7 Cb -0.02 -2.17 0.05 0.00 -1.71 0.00 0.00 66.02 62.17 1tl5 s SER 7 CO -0.00 0.17 0.04 -0.69 1.20 0.00 0.00 173.24 173.95 1tl5 s VAL 8 N 0.09 0.37 -1.16 4.45 1.01 0.24 -0.53 120.40 124.88 1tl5 s VAL 8 Ca 0.17 -0.31 -0.23 0.00 0.00 0.00 0.00 61.98 61.61 1tl5 s VAL 8 Cb -0.13 -0.82 -0.11 0.00 0.00 0.00 0.00 36.38 35.32 1tl5 s VAL 8 CO 0.05 -0.10 1.96 -0.62 0.00 0.00 0.00 175.10 176.39 1tl5 s ASP 9 N 1.94 4.77 -1.30 3.32 -1.08 -0.39 -4.04 116.67 119.90 1tl5 s ASP 9 Ca 0.01 -1.54 -0.18 0.00 -0.52 0.00 0.00 52.55 50.32 1tl5 s ASP 9 Cb -0.16 -2.59 0.05 0.00 -1.46 0.00 0.00 42.92 38.76 1tl5 s ASP 9 CO -0.07 -3.35 1.81 0.23 0.52 0.00 0.00 175.17 174.30 1tl5 n MET 10 N 8.28 2.98 0.11 4.34 2.81 -1.26 -4.72 117.12 129.66 1tl5 n MET 10 Ca 0.44 -3.12 -0.02 0.00 -1.81 0.00 0.00 57.70 53.20 1tl5 n MET 10 Cb 0.47 -3.50 0.04 0.00 -0.71 0.00 0.00 33.22 29.52 1tl5 n MET 10 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1tl5 h THR 11 N 5.49 1.36 -3.99 2.03 2.02 -1.95 -3.44 112.91 114.43 1tl5 h THR 11 Ca 0.43 -2.60 -0.45 0.00 0.77 0.00 0.00 66.41 64.56 1tl5 h THR 11 Cb 0.86 2.47 -0.23 0.00 -1.74 0.00 0.00 68.15 69.50 1tl5 h THR 11 CO 1.48 0.70 -0.79 0.00 0.37 0.00 0.00 175.52 177.28 1tl5 h GLY 13 N 4.54 1.45 2.00 0.00 0.00 -2.01 0.12 103.07 109.18 1tl5 h GLY 13 Ca -0.41 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1tl5 h GLY 13 CO 0.42 -0.38 0.00 -1.33 0.00 0.00 0.00 176.54 175.24 1tl5 h GLY 14 N 0.22 0.00 0.57 4.60 0.00 -1.97 0.12 103.07 106.61 1tl5 h GLY 14 Ca 0.58 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.97 1tl5 h GLY 14 CO -0.65 0.00 0.25 0.00 0.00 0.00 0.00 176.54 176.14 1tl5 h ALA 16 N 1.34 1.02 -0.16 0.00 0.00 -0.88 -0.73 119.26 119.85 1tl5 h ALA 16 Ca 0.26 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 55.00 1tl5 h ALA 16 Cb 0.25 -0.28 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 1tl5 h ALA 16 CO -0.23 0.66 -0.20 0.93 0.00 0.00 0.00 179.25 180.41 1tl5 h GLU 17 N 1.08 -0.23 0.14 0.00 5.08 -1.29 0.17 114.58 119.53 1tl5 h GLU 17 Ca 0.23 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.62 1tl5 h GLU 17 Cb 0.31 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 1tl5 h GLU 17 CO -0.01 -0.15 -0.26 0.00 -1.00 0.00 0.00 179.01 177.59 1tl5 h ALA 18 N 0.80 -0.46 0.16 3.43 0.00 -0.06 0.13 119.26 123.26 1tl5 h ALA 18 Ca 0.11 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1tl5 h ALA 18 Cb 0.39 0.42 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1tl5 h ALA 18 CO -0.29 -0.81 -0.38 0.28 0.00 0.00 0.00 179.25 178.05 1tl5 h VAL 19 N -0.49 0.22 -0.19 0.00 2.07 -1.09 -1.79 116.25 114.98 1tl5 h VAL 19 Ca 0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.60 1tl5 h VAL 19 Cb 0.50 0.22 -0.07 0.00 -1.52 0.00 0.00 31.29 30.42 1tl5 h VAL 19 CO -0.13 0.00 -0.32 -1.28 0.02 0.00 0.00 177.57 175.86 1tl5 h SER 20 N -0.64 -1.01 -0.53 0.57 0.87 -0.32 -0.81 113.55 111.67 1tl5 h SER 20 Ca 0.02 0.15 0.02 0.00 -1.23 0.00 0.00 61.79 60.75 1tl5 h SER 20 Cb 0.65 0.44 -0.03 0.00 -0.44 0.00 0.00 62.40 63.02 1tl5 h SER 20 CO -0.20 -0.35 0.32 0.03 -0.53 0.00 0.00 176.83 176.11 1tl5 h ARG 21 N -0.36 0.63 -0.57 2.24 3.08 -0.57 0.18 114.38 119.00 1tl5 h ARG 21 Ca 0.11 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 60.04 1tl5 h ARG 21 Cb 0.54 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1tl5 h ARG 21 CO -0.39 0.42 0.03 -0.24 -1.07 0.00 0.00 179.97 178.72 1tl5 h VAL 22 N 0.65 1.26 -0.38 2.04 3.04 -0.94 0.11 116.25 122.03 1tl5 h VAL 22 Ca 0.21 -1.08 -0.01 0.00 -1.01 0.00 0.00 66.70 64.81 1tl5 h VAL 22 Cb 0.01 0.83 -0.02 0.00 -2.01 0.00 0.00 31.29 30.10 1tl5 h VAL 22 CO -0.09 0.39 0.18 -0.07 -1.01 0.00 0.00 177.57 176.97 1tl5 h LEU 23 N 0.88 0.49 -0.96 3.16 -0.00 -0.54 0.96 115.31 119.30 1tl5 h LEU 23 Ca 0.17 -0.13 0.22 0.00 -0.00 0.00 0.00 57.88 58.14 1tl5 h LEU 23 Cb 0.50 -0.13 -0.12 0.00 -0.00 0.00 0.00 40.66 40.92 1tl5 h LEU 23 CO 0.02 0.48 0.53 -1.13 -0.00 0.00 0.00 178.44 178.34 1tl5 h ASN 24 N 0.47 0.58 -0.58 -0.43 -1.24 -0.50 0.14 115.58 114.02 1tl5 h ASN 24 Ca 0.13 0.13 -0.11 0.00 0.71 0.00 0.00 56.30 57.16 1tl5 h ASN 24 Cb 0.12 0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.19 1tl5 h ASN 24 CO -0.02 0.11 -0.06 0.11 -1.29 0.00 0.00 177.43 176.29 1tl5 h LYS 25 N 0.56 1.07 -0.33 6.67 1.79 0.37 -3.12 116.57 123.58 1tl5 h LYS 25 Ca 0.59 -0.37 0.07 0.00 -2.18 0.00 0.00 60.65 58.76 1tl5 h LYS 25 Cb 1.08 -0.08 -0.06 0.00 -1.58 0.00 0.00 32.23 31.58 1tl5 h LYS 25 CO -0.47 1.07 -0.08 1.25 -1.08 0.00 0.00 179.45 180.14 1tl5 h LEU 26 N 0.96 -0.31 0.00 2.94 7.12 0.11 -3.48 115.31 122.65 1tl5 h LEU 26 Ca 0.16 0.10 0.00 0.00 0.13 0.00 0.00 57.88 58.27 1tl5 h LEU 26 Cb 0.63 0.20 0.00 0.00 -0.53 0.00 0.00 40.66 40.96 1tl5 h LEU 26 CO 0.04 -0.11 0.00 0.61 -0.13 0.00 0.00 178.44 178.85 1tl5 n GLY 27 N -1.27 -0.81 2.80 3.75 0.00 -0.72 -5.02 105.19 103.91 1tl5 n GLY 27 Ca 0.01 0.30 -0.25 0.00 0.00 0.00 0.00 46.02 46.07 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 5.30 3.16 -0.02 0.00 -1.26 -4.76 105.19 107.62 1tl5 n GLY 28 Ca 0.00 -2.61 -0.33 0.00 0.00 0.00 0.00 46.02 43.08 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 -4.24 2.34 -0.89 1.61 0.11 -1.26 -4.74 120.40 113.32 1tl5 s VAL 29 Ca 0.47 -0.85 -0.25 0.00 -2.93 0.00 0.00 61.98 58.43 1tl5 s VAL 29 Cb 0.30 -2.00 0.04 0.00 -1.53 0.00 0.00 36.38 33.19 1tl5 s VAL 29 CO -0.13 0.52 1.39 -0.75 -3.33 0.00 0.00 175.10 172.80 1tl5 s LYS 30 N 1.29 3.39 -0.15 1.54 2.36 -1.26 -4.89 119.74 122.00 1tl5 s LYS 30 Ca 0.04 -0.71 -0.20 0.00 -2.55 0.00 0.00 55.97 52.56 1tl5 s LYS 30 Cb -0.13 -4.84 -0.03 0.00 -1.05 0.00 0.00 37.83 31.77 1tl5 s LYS 30 CO -0.10 -2.21 0.56 1.52 1.55 0.00 0.00 175.35 176.67 1tl5 s TYR 31 N 5.45 3.45 0.22 4.03 1.13 -1.26 -0.99 117.35 129.38 1tl5 s TYR 31 Ca 0.42 0.92 0.06 0.00 -1.41 0.00 0.00 57.07 57.06 1tl5 s TYR 31 Cb -0.04 -2.69 -0.04 0.00 -1.10 0.00 0.00 41.96 38.10 1tl5 s TYR 31 CO 0.01 -0.01 0.19 0.34 -2.51 0.00 0.00 175.55 173.58 1tl5 s ASP 32 N 0.95 5.62 -0.08 -0.18 -1.08 0.40 -4.96 116.67 117.33 1tl5 s ASP 32 Ca 0.28 -0.17 -0.02 0.00 -0.52 0.00 0.00 52.55 52.12 1tl5 s ASP 32 Cb -0.16 -1.47 0.03 0.00 -1.46 0.00 0.00 42.92 39.86 1tl5 s ASP 32 CO 0.11 -0.00 0.03 -0.63 0.52 0.00 0.00 175.17 175.20 1tl5 s ILE 33 N -1.99 0.19 -0.39 4.11 1.01 -1.26 -0.81 121.20 122.05 1tl5 s ILE 33 Ca 0.32 0.14 -0.03 0.00 0.00 0.00 0.00 60.65 61.08 1tl5 s ILE 33 Cb -0.09 -0.45 0.10 0.00 0.01 0.00 0.00 42.46 42.03 1tl5 s ILE 33 CO 0.25 0.14 0.18 -0.62 0.00 0.00 0.00 174.94 174.89 1tl5 s ASP 34 N 2.04 5.23 -0.00 3.58 -1.08 0.38 -5.00 116.67 121.83 1tl5 s ASP 34 Ca 0.04 -1.86 -0.21 0.00 -0.52 0.00 0.00 52.55 50.00 1tl5 s ASP 34 Cb -0.13 -1.82 -0.21 0.00 -1.46 0.00 0.00 42.92 39.29 1tl5 s ASP 34 CO -0.05 -0.50 1.13 0.25 0.52 0.00 0.00 175.17 176.52 1tl5 h LEU 35 N 8.07 0.44 -0.76 -1.34 7.12 -1.97 -0.34 115.31 126.54 1tl5 h LEU 35 Ca -0.15 -0.71 -0.02 0.00 0.13 0.00 0.00 57.88 57.13 1tl5 h LEU 35 Cb 1.05 -0.13 -0.04 0.00 -0.53 0.00 0.00 40.66 41.02 1tl5 h LEU 35 CO 0.68 1.09 0.41 1.55 -0.13 0.00 0.00 178.44 182.03 1tl5 h PRO 36 N -0.17 1.06 -0.28 5.25 0.13 -1.94 -3.10 132.00 132.95 1tl5 h PRO 36 Ca -0.04 -0.13 -0.12 0.00 -0.87 0.00 0.00 66.00 64.85 1tl5 h PRO 36 Cb 1.12 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 1tl5 h PRO 36 CO 0.09 0.79 -0.31 -0.91 -0.23 0.00 0.00 178.00 177.43 1tl5 h ASN 37 N 1.05 0.61 -3.92 1.44 -0.26 -1.96 -3.47 115.58 109.06 1tl5 h ASN 37 Ca 0.27 -0.24 -0.15 0.00 -0.56 0.00 0.00 56.30 55.62 1tl5 h ASN 37 Cb 0.04 -0.17 0.09 0.00 -1.06 0.00 0.00 38.32 37.22 1tl5 h ASN 37 CO -0.04 0.88 -0.39 0.29 -1.06 0.00 0.00 177.43 177.11 1tl5 n LYS 38 N -4.08 -2.46 -4.04 0.81 4.01 -0.22 -4.94 118.16 107.23 1tl5 n LYS 38 Ca -0.01 0.42 -0.12 0.00 -0.51 0.00 0.00 58.31 58.09 1tl5 n LYS 38 Cb 0.46 -3.95 -0.12 0.00 -0.51 0.00 0.00 35.03 30.91 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 -4.31 0.45 -0.02 1.97 1.02 -0.70 -0.59 119.74 117.56 1tl5 s LYS 39 Ca 0.08 -0.64 0.04 0.00 0.02 0.00 0.00 55.97 55.48 1tl5 s LYS 39 Cb -0.01 -0.20 -0.01 0.00 -0.52 0.00 0.00 37.83 37.09 1tl5 s LYS 39 CO 0.36 0.03 -0.15 0.08 -0.92 0.00 0.00 175.35 174.75 1tl5 s VAL 40 N -1.22 1.21 -0.26 3.17 1.01 0.27 -0.47 120.40 124.12 1tl5 s VAL 40 Ca -0.10 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 1tl5 s VAL 40 Cb -0.09 -1.02 0.08 0.00 0.00 0.00 0.00 36.38 35.35 1tl5 s VAL 40 CO -0.00 0.35 0.03 0.00 0.00 0.00 0.00 175.10 175.48 1tl5 s ILE 42 N 1.59 4.85 -0.43 0.00 1.01 -0.00 -0.46 121.20 127.77 1tl5 s ILE 42 Ca 0.02 0.01 0.02 0.00 0.00 0.00 0.00 60.65 60.70 1tl5 s ILE 42 Cb -0.18 -3.26 0.14 0.00 0.01 0.00 0.00 42.46 39.17 1tl5 s ILE 42 CO -0.14 0.34 0.26 -0.70 0.00 0.00 0.00 174.94 174.70 1tl5 s GLU 43 N 1.30 1.13 0.10 2.79 2.12 -0.16 -0.30 118.70 125.69 1tl5 s GLU 43 Ca 0.06 -1.92 -0.22 0.00 0.36 0.00 0.00 54.97 53.25 1tl5 s GLU 43 Cb -0.15 -2.05 0.06 0.00 0.26 0.00 0.00 34.13 32.25 1tl5 s GLU 43 CO 0.05 -1.20 0.54 0.45 -0.54 0.00 0.00 175.26 174.56 1tl5 s SER 44 N 0.40 -0.46 -1.33 -1.70 0.15 -1.26 -4.29 113.70 105.21 1tl5 s SER 44 Ca 0.20 0.03 -0.11 0.00 0.70 0.00 0.00 55.95 56.76 1tl5 s SER 44 Cb -0.20 0.54 -0.06 0.00 -1.71 0.00 0.00 66.02 64.58 1tl5 s SER 44 CO -0.02 -0.85 2.50 -0.62 1.20 0.00 0.00 173.24 175.45 1tl5 n GLU 45 N -0.03 2.90 -4.18 5.44 1.02 -1.26 -4.77 120.64 119.76 1tl5 n GLU 45 Ca -0.17 -2.06 -0.17 0.00 -0.02 0.00 0.00 57.16 54.74 1tl5 n GLU 45 Cb 0.63 -2.83 -0.15 0.00 -0.02 0.00 0.00 31.44 29.07 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 2.98 0.55 0.41 -0.32 3.76 -1.26 -5.08 115.29 116.34 1tl5 s HIS 46 Ca 0.56 -0.11 -0.26 0.00 -0.15 0.00 0.00 55.06 55.10 1tl5 s HIS 46 Cb 0.15 -0.40 -0.09 0.00 1.11 0.00 0.00 32.58 33.35 1tl5 s HIS 46 CO -0.04 -0.05 1.39 0.45 -0.85 0.00 0.00 174.74 175.64 1tl5 s SER 47 N 0.10 6.17 0.15 1.40 0.15 -1.26 -4.83 113.70 115.58 1tl5 s SER 47 Ca -0.01 2.83 -0.20 0.00 0.70 0.00 0.00 55.95 59.28 1tl5 s SER 47 Cb -0.05 -2.65 0.05 0.00 -1.71 0.00 0.00 66.02 61.66 1tl5 s SER 47 CO -0.00 -0.96 1.21 0.80 1.20 0.00 0.00 173.24 175.49 1tl5 n MET 48 N 0.10 -0.28 0.35 5.44 1.56 -1.26 -1.13 117.12 121.91 1tl5 n MET 48 Ca 0.03 1.20 -0.18 0.00 -0.27 0.00 0.00 57.70 58.49 1tl5 n MET 48 Cb 0.42 -1.77 -0.09 0.00 2.15 0.00 0.00 33.22 33.93 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 -0.86 -0.55 6.12 3.58 -1.98 0.62 116.42 123.35 1tl5 h ASP 49 Ca 0.19 0.04 0.11 0.00 0.42 0.00 0.00 57.03 57.79 1tl5 h ASP 49 Cb 0.39 0.24 -0.11 0.00 1.72 0.00 0.00 39.33 41.57 1tl5 h ASP 49 CO -0.76 -0.56 -0.18 0.74 -2.88 0.00 0.00 179.24 175.60 1tl5 h THR 50 N -0.91 0.38 0.49 2.25 2.02 -1.80 0.23 112.91 115.57 1tl5 h THR 50 Ca -0.08 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 1tl5 h THR 50 Cb 0.72 0.38 -0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1tl5 h THR 50 CO 0.11 0.00 -0.30 -0.07 0.37 0.00 0.00 175.52 175.62 1tl5 h LEU 51 N -0.05 -0.77 -0.28 2.58 3.38 -0.92 -2.14 115.31 117.11 1tl5 h LEU 51 Ca 0.26 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.32 1tl5 h LEU 51 Cb 0.45 0.22 -0.08 0.00 0.09 0.00 0.00 40.66 41.34 1tl5 h LEU 51 CO -0.59 -0.47 -0.50 0.25 0.09 0.00 0.00 178.44 177.23 1tl5 h LEU 52 N -0.75 -1.61 -0.83 1.67 6.46 -0.12 0.10 115.31 120.23 1tl5 h LEU 52 Ca -0.07 0.21 0.09 0.00 -0.12 0.00 0.00 57.88 58.00 1tl5 h LEU 52 Cb 0.60 0.66 -0.07 0.00 -0.73 0.00 0.00 40.66 41.12 1tl5 h LEU 52 CO 0.07 -0.42 0.49 0.00 -0.62 0.00 0.00 178.44 177.95 1tl5 h ALA 53 N 0.04 1.19 0.61 1.25 0.00 -0.66 0.72 119.26 122.42 1tl5 h ALA 53 Ca 0.08 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1tl5 h ALA 53 Cb 0.63 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.27 1tl5 h ALA 53 CO -0.51 0.13 -0.29 1.15 0.00 0.00 0.00 179.25 179.73 1tl5 h THR 54 N 0.83 0.00 -0.23 0.00 2.02 -0.54 -3.29 112.91 111.70 1tl5 h THR 54 Ca 0.40 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.50 1tl5 h THR 54 Cb 0.33 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.73 1tl5 h THR 54 CO -0.23 0.00 0.15 0.17 0.37 0.00 0.00 175.52 175.98 1tl5 h LEU 55 N -0.91 0.26 -0.98 2.58 8.10 -0.55 -0.91 115.31 122.91 1tl5 h LEU 55 Ca -0.08 -0.01 0.40 0.00 0.11 0.00 0.00 57.88 58.30 1tl5 h LEU 55 Cb 0.63 -0.06 -0.18 0.00 -0.44 0.00 0.00 40.66 40.61 1tl5 h LEU 55 CO 0.14 0.19 0.48 1.17 -4.11 0.00 0.00 178.44 176.31 1tl5 n LYS 56 N -4.50 -0.06 0.21 0.17 4.81 0.22 -1.18 118.16 117.83 1tl5 n LYS 56 Ca 0.00 1.36 0.14 0.00 -0.87 0.00 0.00 58.31 58.95 1tl5 n LYS 56 Cb 0.07 -2.41 0.77 0.00 0.02 0.00 0.00 35.03 33.48 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 -0.97 1.64 1.57 -1.28 0.14 116.57 117.67 1tl5 h LYS 57 Ca 0.81 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 59.65 1tl5 h LYS 57 Cb 2.11 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 34.36 1tl5 h LYS 57 CO -0.77 0.00 0.63 1.79 -0.57 0.00 0.00 179.45 180.53 1tl5 h THR 58 N 0.00 1.10 -0.12 -0.16 1.35 -1.36 -3.46 112.91 110.25 1tl5 h THR 58 Ca 0.00 -0.39 -0.05 0.00 -0.55 0.00 0.00 66.41 65.41 1tl5 h THR 58 Cb 0.01 -0.15 -0.02 0.00 -1.73 0.00 0.00 68.15 66.26 1tl5 h THR 58 CO 0.00 0.21 -0.05 0.61 -0.25 0.00 0.00 175.52 176.04 1tl5 n GLY 59 N -1.38 0.58 3.98 5.82 0.00 0.48 -5.04 105.19 109.64 1tl5 n GLY 59 Ca 0.15 -0.46 -0.22 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.50 2.21 -0.96 1.61 3.01 -1.26 -4.97 119.74 117.88 1tl5 s LYS 60 Ca 0.00 -0.97 -0.07 0.00 -1.01 0.00 0.00 55.97 53.92 1tl5 s LYS 60 Cb 0.00 -2.44 -0.06 0.00 -1.01 0.00 0.00 37.83 34.32 1tl5 s LYS 60 CO 0.00 -0.99 2.16 2.41 0.51 0.00 0.00 175.35 179.43 1tl5 n THR 61 N -2.51 2.53 -3.30 2.17 -1.04 -1.26 -4.81 114.28 106.05 1tl5 n THR 61 Ca 0.11 -1.55 -0.43 0.00 -2.04 0.00 0.00 64.05 60.14 1tl5 n THR 61 Cb 0.60 -2.18 -0.09 0.00 -1.82 0.00 0.00 70.33 66.85 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 3.42 5.07 0.15 12.58 0.11 -1.26 -1.26 120.40 139.20 1tl5 s VAL 62 Ca 0.43 -0.30 0.04 0.00 -2.93 0.00 0.00 61.98 59.22 1tl5 s VAL 62 Cb 0.11 -4.05 -0.04 0.00 -1.53 0.00 0.00 36.38 30.87 1tl5 s VAL 62 CO -0.03 -0.43 0.19 -0.55 -3.33 0.00 0.00 175.10 170.95 1tl5 s SER 63 N 1.82 5.88 -0.19 3.54 0.15 0.31 -5.00 113.70 120.20 1tl5 s SER 63 Ca 0.13 0.01 -0.05 0.00 0.70 0.00 0.00 55.95 56.74 1tl5 s SER 63 Cb -0.17 -1.65 -0.03 0.00 -1.71 0.00 0.00 66.02 62.47 1tl5 s SER 63 CO 0.14 0.07 0.00 -0.47 1.20 0.00 0.00 173.24 174.19 1tl5 s TYR 64 N -1.71 3.06 -0.44 3.44 5.04 -1.26 -1.51 117.35 123.97 1tl5 s TYR 64 Ca 0.32 -0.36 0.06 0.00 -2.44 0.00 0.00 57.07 54.65 1tl5 s TYR 64 Cb -0.11 -2.07 0.18 0.00 0.35 0.00 0.00 41.96 40.31 1tl5 s TYR 64 CO 0.25 -0.16 0.54 -0.48 -1.34 0.00 0.00 175.55 174.36 1tl5 s LEU 65 N 0.83 -0.49 0.00 6.97 -0.00 0.67 -4.93 118.68 121.74 1tl5 s LEU 65 Ca 0.01 -1.83 0.00 0.00 -0.00 0.00 0.00 54.13 52.30 1tl5 s LEU 65 Cb -0.14 1.06 0.00 0.00 -0.00 0.00 0.00 46.19 47.11 1tl5 s LEU 65 CO 0.02 -0.15 0.00 0.61 -0.00 0.00 0.00 176.35 176.83 1tl5 n GLY 66 N 3.50 2.83 3.74 -3.48 0.00 -1.19 -4.45 105.19 106.14 1tl5 n GLY 66 Ca 0.18 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 1tl5 n GLY 66 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1tl5 s LEU 67 N 0.00 4.35 0.00 0.99 2.96 -1.26 -0.77 118.68 124.95 1tl5 s LEU 67 Ca 0.00 1.06 0.00 0.00 -0.22 0.00 0.00 54.13 54.97 1tl5 s LEU 67 Cb 0.00 -2.88 0.00 0.00 0.50 0.00 0.00 46.19 43.81 1tl5 s LEU 67 CO 0.00 0.03 0.00 1.21 -1.32 0.00 0.00 176.35 176.27