#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 1.92 0.09 2.12 0.04 -1.26 -4.94 135.00 132.97 1tl5 s PRO 2 Ca 0.00 -0.06 0.07 0.00 0.04 0.00 0.00 61.00 61.04 1tl5 s PRO 2 Cb 0.00 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 1tl5 s PRO 2 CO 0.00 -1.56 -0.10 0.21 0.04 0.00 0.00 177.00 175.60 1tl5 s LYS 3 N -5.50 2.19 0.03 4.56 2.20 0.12 -3.49 119.74 119.85 1tl5 s LYS 3 Ca 0.62 -0.98 -0.01 0.00 -0.36 0.00 0.00 55.97 55.24 1tl5 s LYS 3 Cb -0.10 -2.33 -0.03 0.00 -1.51 0.00 0.00 37.83 33.86 1tl5 s LYS 3 CO 0.48 0.52 -0.00 -1.01 -0.36 0.00 0.00 175.35 174.98 1tl5 s HIS 4 N -1.18 0.34 0.10 4.03 3.76 0.46 -0.76 115.29 122.05 1tl5 s HIS 4 Ca 0.21 -0.72 0.08 0.00 -0.15 0.00 0.00 55.06 54.48 1tl5 s HIS 4 Cb -0.11 -0.25 -0.04 0.00 1.11 0.00 0.00 32.58 33.29 1tl5 s HIS 4 CO 0.13 -0.29 -0.21 -1.21 -0.85 0.00 0.00 174.74 172.30 1tl5 s GLU 5 N -2.58 1.15 -0.05 1.40 2.02 -1.13 -0.57 118.70 118.94 1tl5 s GLU 5 Ca -0.05 -1.17 -0.03 0.00 0.02 0.00 0.00 54.97 53.74 1tl5 s GLU 5 Cb -0.02 -1.43 0.02 0.00 0.10 0.00 0.00 34.13 32.80 1tl5 s GLU 5 CO -0.05 0.33 0.11 -0.06 0.02 0.00 0.00 175.26 175.62 1tl5 s PHE 6 N -1.14 -0.12 0.39 1.61 0.40 0.66 -0.51 117.98 119.26 1tl5 s PHE 6 Ca 0.07 0.34 -0.23 0.00 -0.60 0.00 0.00 56.93 56.51 1tl5 s PHE 6 Cb -0.10 -0.03 -0.10 0.00 0.51 0.00 0.00 43.02 43.30 1tl5 s PHE 6 CO 0.04 -0.10 0.96 -1.12 0.70 0.00 0.00 175.22 175.70 1tl5 s SER 7 N 0.58 7.04 0.26 1.36 0.01 0.31 -0.31 113.70 122.95 1tl5 s SER 7 Ca -0.04 1.80 0.03 0.00 1.31 0.00 0.00 55.95 59.04 1tl5 s SER 7 Cb -0.06 -2.56 -0.05 0.00 0.21 0.00 0.00 66.02 63.56 1tl5 s SER 7 CO -0.02 -0.28 0.05 -0.69 0.41 0.00 0.00 173.24 172.70 1tl5 s VAL 8 N -1.90 0.85 -0.39 3.43 1.01 -0.08 -0.43 120.40 122.90 1tl5 s VAL 8 Ca 0.57 -2.01 0.02 0.00 0.00 0.00 0.00 61.98 60.56 1tl5 s VAL 8 Cb -0.14 -2.55 0.12 0.00 0.00 0.00 0.00 36.38 33.80 1tl5 s VAL 8 CO 0.19 -0.13 0.15 -0.62 0.00 0.00 0.00 175.10 174.69 1tl5 s ASP 9 N -3.34 4.12 -1.20 3.32 -1.08 -1.26 -4.57 116.67 112.67 1tl5 s ASP 9 Ca 0.34 -2.26 -0.20 0.00 -0.52 0.00 0.00 52.55 49.90 1tl5 s ASP 9 Cb 0.07 -1.20 0.03 0.00 -1.46 0.00 0.00 42.92 40.36 1tl5 s ASP 9 CO 0.12 -0.33 1.74 -0.04 0.52 0.00 0.00 175.17 177.17 1tl5 s MET 10 N 0.79 3.51 0.28 4.34 -1.94 -1.26 -4.72 119.30 120.30 1tl5 s MET 10 Ca 0.14 -1.55 0.26 0.00 -1.71 0.00 0.00 55.69 52.82 1tl5 s MET 10 Cb -0.21 -5.41 0.79 0.00 2.01 0.00 0.00 34.83 32.00 1tl5 s MET 10 CO -0.10 -2.68 1.75 1.79 -0.01 0.00 0.00 175.02 175.77 1tl5 h THR 11 N 6.04 0.00 -3.74 2.05 1.35 -1.98 -3.42 112.91 113.21 1tl5 h THR 11 Ca 0.33 -0.53 -0.14 0.00 -0.55 0.00 0.00 66.41 65.52 1tl5 h THR 11 Cb 0.92 1.48 -0.19 0.00 -1.73 0.00 0.00 68.15 68.63 1tl5 h THR 11 CO 1.39 0.00 -0.55 0.00 -0.25 0.00 0.00 175.52 176.11 1tl5 h GLY 13 N 4.09 1.85 1.60 0.00 0.00 -2.00 0.77 103.07 109.37 1tl5 h GLY 13 Ca -0.32 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.76 1tl5 h GLY 13 CO 0.45 -0.31 0.20 -1.33 0.00 0.00 0.00 176.54 175.55 1tl5 h GLY 14 N 0.47 0.00 0.32 4.60 0.00 -1.96 0.86 103.07 107.37 1tl5 h GLY 14 Ca 0.65 0.00 0.13 0.00 0.00 0.00 0.00 47.33 48.11 1tl5 h GLY 14 CO -0.53 0.00 0.45 0.00 0.00 0.00 0.00 176.54 176.46 1tl5 h ALA 16 N 1.52 0.71 -0.37 0.00 0.00 -1.00 -0.20 119.26 119.93 1tl5 h ALA 16 Ca 0.44 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.27 1tl5 h ALA 16 Cb 0.56 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1tl5 h ALA 16 CO -0.32 0.27 0.12 0.93 0.00 0.00 0.00 179.25 180.25 1tl5 h GLU 17 N 0.74 0.26 0.10 0.00 5.08 -1.40 0.13 114.58 119.49 1tl5 h GLU 17 Ca 0.19 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1tl5 h GLU 17 Cb 0.12 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 1tl5 h GLU 17 CO -0.02 0.17 -0.13 0.00 -1.00 0.00 0.00 179.01 178.03 1tl5 h ALA 18 N 1.24 -0.23 -0.04 3.43 0.00 0.08 0.19 119.26 123.93 1tl5 h ALA 18 Ca 0.17 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1tl5 h ALA 18 Cb 0.15 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1tl5 h ALA 18 CO -0.18 -0.65 0.02 0.28 0.00 0.00 0.00 179.25 178.72 1tl5 h VAL 19 N -0.27 1.10 -0.08 0.00 2.07 -0.98 -0.19 116.25 117.89 1tl5 h VAL 19 Ca 0.01 -0.28 0.04 0.00 0.82 0.00 0.00 66.70 67.30 1tl5 h VAL 19 Cb 0.28 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.20 1tl5 h VAL 19 CO -0.06 0.08 -0.27 -1.28 0.02 0.00 0.00 177.57 176.06 1tl5 h SER 20 N -0.04 -0.84 -0.35 0.57 0.87 -0.48 -0.20 113.55 113.08 1tl5 h SER 20 Ca 0.01 0.12 0.02 0.00 -1.23 0.00 0.00 61.79 60.72 1tl5 h SER 20 Cb 0.11 0.35 -0.03 0.00 -0.44 0.00 0.00 62.40 62.40 1tl5 h SER 20 CO -0.00 -0.33 0.19 0.03 -0.53 0.00 0.00 176.83 176.19 1tl5 h ARG 21 N -0.37 0.38 -0.41 2.24 3.08 -0.51 0.14 114.38 118.92 1tl5 h ARG 21 Ca 0.09 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1tl5 h ARG 21 Cb 0.50 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 1tl5 h ARG 21 CO -0.29 0.25 0.26 -0.24 -1.07 0.00 0.00 179.97 178.88 1tl5 h VAL 22 N 0.39 1.12 0.28 2.04 3.04 -0.69 0.17 116.25 122.60 1tl5 h VAL 22 Ca 0.14 -0.25 -0.01 0.00 -1.01 0.00 0.00 66.70 65.57 1tl5 h VAL 22 Cb 0.03 0.55 0.00 0.00 -2.01 0.00 0.00 31.29 29.87 1tl5 h VAL 22 CO -0.08 0.12 -0.13 -0.07 -1.01 0.00 0.00 177.57 176.39 1tl5 h LEU 23 N 0.54 -0.32 -0.78 3.16 -0.00 -0.65 -2.52 115.31 114.74 1tl5 h LEU 23 Ca 0.15 -0.06 0.18 0.00 -0.00 0.00 0.00 57.88 58.15 1tl5 h LEU 23 Cb -0.03 0.08 -0.14 0.00 -0.00 0.00 0.00 40.66 40.58 1tl5 h LEU 23 CO -0.03 -0.14 0.02 -1.13 -0.00 0.00 0.00 178.44 177.16 1tl5 h ASN 24 N -0.48 -0.34 -0.63 -0.43 -1.24 -0.60 0.13 115.58 111.99 1tl5 h ASN 24 Ca -0.04 0.20 0.11 0.00 0.71 0.00 0.00 56.30 57.28 1tl5 h ASN 24 Cb 0.36 0.35 -0.04 0.00 0.73 0.00 0.00 38.32 39.72 1tl5 h ASN 24 CO 0.06 -0.19 0.42 0.11 -1.29 0.00 0.00 177.43 176.54 1tl5 h LYS 25 N 0.10 0.40 -0.54 6.67 1.79 -0.33 -1.43 116.57 123.23 1tl5 h LYS 25 Ca 0.43 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.88 1tl5 h LYS 25 Cb 0.78 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 31.31 1tl5 h LYS 25 CO -0.68 0.26 0.35 1.25 -1.08 0.00 0.00 179.45 179.54 1tl5 h LEU 26 N 0.41 0.63 0.00 2.94 7.12 -0.31 -3.49 115.31 122.61 1tl5 h LEU 26 Ca 0.29 -0.03 0.00 0.00 0.13 0.00 0.00 57.88 58.27 1tl5 h LEU 26 Cb 0.60 -0.16 0.00 0.00 -0.53 0.00 0.00 40.66 40.57 1tl5 h LEU 26 CO -0.08 0.48 0.00 0.61 -0.13 0.00 0.00 178.44 179.31 1tl5 n GLY 27 N -1.20 -1.26 2.52 3.75 0.00 -0.54 -5.01 105.19 103.45 1tl5 n GLY 27 Ca 0.03 0.45 -0.18 0.00 0.00 0.00 0.00 46.02 46.32 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 3.75 3.49 -0.02 0.00 -1.26 -4.84 105.19 106.30 1tl5 n GLY 28 Ca 0.00 -1.95 -0.37 0.00 0.00 0.00 0.00 46.02 43.70 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 -3.51 4.57 -0.67 1.61 0.11 -1.26 -4.80 120.40 116.44 1tl5 s VAL 29 Ca 0.39 -0.08 -0.27 0.00 -2.93 0.00 0.00 61.98 59.08 1tl5 s VAL 29 Cb 0.38 -3.15 0.03 0.00 -1.53 0.00 0.00 36.38 32.11 1tl5 s VAL 29 CO -0.07 0.32 1.30 -0.75 -3.33 0.00 0.00 175.10 172.57 1tl5 s LYS 30 N 1.60 3.26 0.12 1.54 2.47 -1.26 -4.80 119.74 122.67 1tl5 s LYS 30 Ca 0.06 -0.00 0.05 0.00 -1.56 0.00 0.00 55.97 54.52 1tl5 s LYS 30 Cb -0.15 -4.14 -0.04 0.00 -1.46 0.00 0.00 37.83 32.04 1tl5 s LYS 30 CO 0.05 -2.04 0.04 1.52 0.16 0.00 0.00 175.35 175.08 1tl5 s TYR 31 N 5.74 3.01 -0.04 4.03 -0.85 -1.26 -1.21 117.35 126.77 1tl5 s TYR 31 Ca 0.40 -0.04 -0.02 0.00 -0.52 0.00 0.00 57.07 56.90 1tl5 s TYR 31 Cb -0.08 -1.50 0.03 0.00 0.38 0.00 0.00 41.96 40.78 1tl5 s TYR 31 CO 0.19 0.50 0.07 -0.51 -1.52 0.00 0.00 175.55 174.28 1tl5 s ASP 32 N -2.64 0.74 -0.20 -0.18 1.01 0.47 -4.98 116.67 110.89 1tl5 s ASP 32 Ca 0.28 0.11 -0.07 0.00 0.71 0.00 0.00 52.55 53.58 1tl5 s ASP 32 Cb -0.11 -0.05 -0.03 0.00 1.01 0.00 0.00 42.92 43.73 1tl5 s ASP 32 CO 0.20 -0.21 0.05 -0.63 0.21 0.00 0.00 175.17 174.78 1tl5 s ILE 33 N 1.84 4.45 -0.36 0.77 1.09 -1.26 -0.85 121.20 126.88 1tl5 s ILE 33 Ca 0.00 -0.14 -0.08 0.00 -1.10 0.00 0.00 60.65 59.33 1tl5 s ILE 33 Cb -0.12 -3.02 0.04 0.00 -1.06 0.00 0.00 42.46 38.30 1tl5 s ILE 33 CO -0.03 0.42 0.15 -0.62 -0.10 0.00 0.00 174.94 174.76 1tl5 s ASP 34 N 0.79 5.48 -0.08 3.58 -1.08 0.60 -5.00 116.67 120.96 1tl5 s ASP 34 Ca 0.03 -1.13 -0.17 0.00 -0.52 0.00 0.00 52.55 50.75 1tl5 s ASP 34 Cb -0.14 -1.93 -0.13 0.00 -1.46 0.00 0.00 42.92 39.26 1tl5 s ASP 34 CO 0.02 -0.37 0.60 -0.07 0.52 0.00 0.00 175.17 175.87 1tl5 h LEU 35 N 8.30 -0.12 -0.58 -1.34 4.07 -1.96 0.32 115.31 123.99 1tl5 h LEU 35 Ca -0.24 -0.36 0.09 0.00 0.08 0.00 0.00 57.88 57.45 1tl5 h LEU 35 Cb 1.09 0.03 -0.07 0.00 1.08 0.00 0.00 40.66 42.79 1tl5 h LEU 35 CO 0.64 0.50 0.21 1.55 -1.08 0.00 0.00 178.44 180.25 1tl5 h PRO 36 N -0.95 0.37 -0.00 1.13 0.13 -1.95 -0.18 132.00 130.54 1tl5 h PRO 36 Ca -0.01 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1tl5 h PRO 36 Cb 0.48 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.52 1tl5 h PRO 36 CO 0.02 0.24 -0.11 0.09 -0.23 0.00 0.00 178.00 178.01 1tl5 n ASN 37 N -5.01 0.35 -3.07 1.44 3.02 -1.26 -4.95 115.26 105.78 1tl5 n ASN 37 Ca 0.08 -0.37 -0.14 0.00 -0.03 0.00 0.00 54.58 54.12 1tl5 n ASN 37 Cb 0.26 -0.12 0.07 0.00 -0.61 0.00 0.00 39.78 39.38 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 -1.11 -5.01 -4.10 3.52 5.02 -0.08 -4.94 118.16 111.46 1tl5 n LYS 38 Ca 0.13 0.73 -0.08 0.00 -2.02 0.00 0.00 58.31 57.07 1tl5 n LYS 38 Cb 0.28 -5.36 -0.10 0.00 -0.02 0.00 0.00 35.03 29.83 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 -4.99 0.65 -0.02 1.97 1.02 0.05 -0.90 119.74 117.52 1tl5 s LYS 39 Ca 0.07 -1.22 0.07 0.00 0.02 0.00 0.00 55.97 54.91 1tl5 s LYS 39 Cb -0.01 0.11 -0.02 0.00 -0.52 0.00 0.00 37.83 37.40 1tl5 s LYS 39 CO 0.63 -0.09 -0.23 0.08 -0.92 0.00 0.00 175.35 174.82 1tl5 s VAL 40 N -3.75 1.83 0.14 3.17 1.01 0.58 -0.29 120.40 123.09 1tl5 s VAL 40 Ca 0.07 -0.98 0.10 0.00 0.00 0.00 0.00 61.98 61.17 1tl5 s VAL 40 Cb 0.07 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 1tl5 s VAL 40 CO -0.08 0.52 -0.23 0.00 0.00 0.00 0.00 175.10 175.30 1tl5 s ILE 42 N -1.26 0.23 -0.37 0.00 1.01 0.26 -0.39 121.20 120.67 1tl5 s ILE 42 Ca 0.17 -0.12 0.02 0.00 0.00 0.00 0.00 60.65 60.73 1tl5 s ILE 42 Cb -0.10 -0.20 0.15 0.00 0.01 0.00 0.00 42.46 42.33 1tl5 s ILE 42 CO 0.08 0.07 0.33 -0.70 0.00 0.00 0.00 174.94 174.72 1tl5 s GLU 43 N -0.03 0.64 0.13 2.79 2.12 -0.35 -0.40 118.70 123.60 1tl5 s GLU 43 Ca 0.01 -1.11 -0.20 0.00 0.36 0.00 0.00 54.97 54.02 1tl5 s GLU 43 Cb -0.02 -0.94 0.05 0.00 0.26 0.00 0.00 34.13 33.49 1tl5 s GLU 43 CO -0.00 -1.22 0.51 0.45 -0.54 0.00 0.00 175.26 174.46 1tl5 s SER 44 N 1.19 -0.41 0.00 -1.70 0.15 -1.23 -4.41 113.70 107.29 1tl5 s SER 44 Ca 0.19 -0.09 0.23 0.00 0.70 0.00 0.00 55.95 56.97 1tl5 s SER 44 Cb -0.16 0.53 1.09 0.00 -1.71 0.00 0.00 66.02 65.77 1tl5 s SER 44 CO -0.02 -0.88 1.74 -0.62 1.20 0.00 0.00 173.24 174.65 1tl5 n GLU 45 N -0.18 1.36 -2.04 5.44 1.02 -1.26 -4.41 120.64 120.57 1tl5 n GLU 45 Ca -0.17 -0.54 -0.42 0.00 -0.02 0.00 0.00 57.16 56.01 1tl5 n GLU 45 Cb 0.64 -1.39 -0.03 0.00 -0.02 0.00 0.00 31.44 30.64 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 -1.93 3.14 0.29 -0.32 3.76 -1.26 -4.94 115.29 114.04 1tl5 s HIS 46 Ca 0.34 0.79 -0.30 0.00 -0.15 0.00 0.00 55.06 55.74 1tl5 s HIS 46 Cb 0.17 -3.81 -0.13 0.00 1.11 0.00 0.00 32.58 29.92 1tl5 s HIS 46 CO 0.27 -2.93 1.39 0.45 -0.85 0.00 0.00 174.74 173.07 1tl5 n SER 47 N 3.90 2.92 -0.34 1.40 2.88 -1.26 -4.83 113.62 118.30 1tl5 n SER 47 Ca 0.13 1.17 -0.01 0.00 -1.33 0.00 0.00 58.87 58.83 1tl5 n SER 47 Cb 0.40 -1.48 0.05 0.00 -0.75 0.00 0.00 64.21 62.43 1tl5 n SER 47 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 1tl5 h MET 48 N 3.61 -0.03 0.16 -1.46 4.05 -1.92 -1.70 114.93 117.63 1tl5 h MET 48 Ca -0.46 0.00 0.01 0.00 -0.28 0.00 0.00 59.70 58.98 1tl5 h MET 48 Cb 1.27 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 32.05 1tl5 h MET 48 CO 0.71 -0.02 -0.27 0.22 0.23 0.00 0.00 176.91 177.77 1tl5 h ASP 49 N -0.03 -0.76 -0.58 1.39 3.58 -1.98 0.14 116.42 118.18 1tl5 h ASP 49 Ca 0.34 0.08 0.11 0.00 0.42 0.00 0.00 57.03 57.99 1tl5 h ASP 49 Cb 0.60 0.28 -0.11 0.00 1.72 0.00 0.00 39.33 41.82 1tl5 h ASP 49 CO -0.92 -0.37 -0.20 0.74 -2.88 0.00 0.00 179.24 175.61 1tl5 h THR 50 N -0.51 0.33 0.96 2.25 2.02 -1.77 0.33 112.91 116.52 1tl5 h THR 50 Ca 0.02 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.15 1tl5 h THR 50 Cb 0.51 0.33 0.01 0.00 -1.74 0.00 0.00 68.15 67.26 1tl5 h THR 50 CO -0.13 0.00 -0.46 -0.07 0.37 0.00 0.00 175.52 175.23 1tl5 h LEU 51 N -0.06 -1.09 -1.90 2.58 3.38 -0.73 -0.58 115.31 116.90 1tl5 h LEU 51 Ca 0.27 0.04 0.16 0.00 0.09 0.00 0.00 57.88 58.44 1tl5 h LEU 51 Cb 0.48 0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1tl5 h LEU 51 CO -0.63 -0.76 0.44 0.25 0.09 0.00 0.00 178.44 177.83 1tl5 h LEU 52 N -1.34 0.09 -0.01 1.67 6.46 -0.09 0.21 115.31 122.31 1tl5 h LEU 52 Ca -0.13 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.62 1tl5 h LEU 52 Cb 0.99 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.91 1tl5 h LEU 52 CO 0.22 0.05 -0.04 0.00 -0.62 0.00 0.00 178.44 178.05 1tl5 h ALA 53 N 1.70 0.01 0.57 1.25 0.00 -0.33 -3.25 119.26 119.22 1tl5 h ALA 53 Ca 0.30 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1tl5 h ALA 53 Cb 1.04 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1tl5 h ALA 53 CO -0.03 -0.12 -0.33 1.15 0.00 0.00 0.00 179.25 179.91 1tl5 h THR 54 N -0.62 0.00 -0.09 0.00 2.02 0.80 -3.24 112.91 111.79 1tl5 h THR 54 Ca -0.00 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.20 1tl5 h THR 54 Cb 0.71 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1tl5 h THR 54 CO 0.01 0.00 0.06 0.17 0.37 0.00 0.00 175.52 176.13 1tl5 h LEU 55 N -0.84 0.00 -0.97 2.58 8.10 -0.89 -1.51 115.31 121.78 1tl5 h LEU 55 Ca -0.08 0.00 0.33 0.00 0.11 0.00 0.00 57.88 58.24 1tl5 h LEU 55 Cb 0.67 0.00 -0.18 0.00 -0.44 0.00 0.00 40.66 40.71 1tl5 h LEU 55 CO 0.09 0.00 0.25 1.17 -4.11 0.00 0.00 178.44 175.84 1tl5 n LYS 56 N -4.50 -0.07 0.30 0.17 4.81 -1.22 -1.02 118.16 116.63 1tl5 n LYS 56 Ca -0.01 1.40 0.19 0.00 -0.87 0.00 0.00 58.31 59.03 1tl5 n LYS 56 Cb 0.17 -2.35 1.03 0.00 0.02 0.00 0.00 35.03 33.90 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 -0.12 1.64 1.57 -1.42 0.56 116.57 118.81 1tl5 h LYS 57 Ca 0.69 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.44 1tl5 h LYS 57 Cb 1.65 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.95 1tl5 h LYS 57 CO -0.84 0.00 -0.10 1.79 -0.57 0.00 0.00 179.45 179.73 1tl5 h THR 58 N 0.00 1.15 -5.53 -0.16 1.35 -1.31 -3.47 112.91 104.94 1tl5 h THR 58 Ca 0.00 -0.63 -0.36 0.00 -0.55 0.00 0.00 66.41 64.86 1tl5 h THR 58 Cb 0.10 1.18 0.14 0.00 -1.73 0.00 0.00 68.15 67.84 1tl5 h THR 58 CO 0.00 0.20 -0.66 0.61 -0.25 0.00 0.00 175.52 175.42 1tl5 n GLY 59 N -1.01 -0.43 3.80 5.82 0.00 0.19 -5.04 105.19 108.52 1tl5 n GLY 59 Ca -0.01 0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 1tl5 n GLY 59 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tl5 n LYS 60 N -4.59 0.68 -0.08 1.61 4.76 -1.26 -5.01 118.16 114.27 1tl5 n LYS 60 Ca -0.05 -3.44 0.00 0.00 -2.87 0.00 0.00 58.31 51.95 1tl5 n LYS 60 Cb 0.58 0.37 0.00 0.00 -1.84 0.00 0.00 35.03 34.14 1tl5 n LYS 60 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1tl5 n THR 61 N -1.78 0.72 -2.47 -0.18 -1.04 -1.26 -4.76 114.28 103.52 1tl5 n THR 61 Ca -0.02 -0.08 -0.39 0.00 -2.04 0.00 0.00 64.05 61.52 1tl5 n THR 61 Cb 0.63 -0.93 -0.03 0.00 -1.82 0.00 0.00 70.33 68.18 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 0.57 3.84 0.05 12.58 0.11 -1.26 -3.97 120.40 132.32 1tl5 s VAL 62 Ca 0.00 -0.74 0.03 0.00 -2.93 0.00 0.00 61.98 58.34 1tl5 s VAL 62 Cb 0.00 -4.88 -0.04 0.00 -1.53 0.00 0.00 36.38 29.93 1tl5 s VAL 62 CO 0.00 -1.77 0.01 -0.94 -3.33 0.00 0.00 175.10 169.08 1tl5 s SER 63 N 5.48 5.14 -0.21 3.54 1.04 0.43 -4.91 113.70 124.21 1tl5 s SER 63 Ca 0.51 -0.08 -0.09 0.00 0.48 0.00 0.00 55.95 56.77 1tl5 s SER 63 Cb -0.01 -1.30 -0.05 0.00 0.10 0.00 0.00 66.02 64.76 1tl5 s SER 63 CO -0.08 0.22 0.12 -0.47 0.98 0.00 0.00 173.24 174.02 1tl5 s TYR 64 N -1.22 3.32 -0.44 5.02 5.04 -1.26 -0.53 117.35 127.28 1tl5 s TYR 64 Ca 0.23 0.18 0.06 0.00 -2.44 0.00 0.00 57.07 55.11 1tl5 s TYR 64 Cb -0.12 -2.19 0.18 0.00 0.35 0.00 0.00 41.96 40.18 1tl5 s TYR 64 CO 0.15 0.13 0.58 -0.48 -1.34 0.00 0.00 175.55 174.59 1tl5 s LEU 65 N 0.70 -0.90 0.00 6.97 -0.00 0.33 -4.91 118.68 120.87 1tl5 s LEU 65 Ca 0.06 -1.49 0.00 0.00 -0.00 0.00 0.00 54.13 52.71 1tl5 s LEU 65 Cb -0.13 1.40 0.00 0.00 -0.00 0.00 0.00 46.19 47.47 1tl5 s LEU 65 CO 0.01 -0.15 0.00 0.61 -0.00 0.00 0.00 176.35 176.82 1tl5 n GLY 66 N 3.76 4.26 2.86 -3.48 0.00 -1.14 -4.21 105.19 107.24 1tl5 n GLY 66 Ca 0.15 -0.45 -0.14 0.00 0.00 0.00 0.00 46.02 45.58 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 1.22 0.00 0.99 2.34 -1.26 -2.84 118.68 119.13 1tl5 s LEU 67 Ca 0.00 0.13 0.00 0.00 0.06 0.00 0.00 54.13 54.32 1tl5 s LEU 67 Cb 0.00 0.13 0.00 0.00 -0.56 0.00 0.00 46.19 45.76 1tl5 s LEU 67 CO 0.00 -0.10 0.00 -0.62 -1.06 0.00 0.00 176.35 174.57