#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tl5 n PRO 2 N 0.00 0.29 -3.85 0.03 -0.04 -1.22 -4.42 135.00 125.79 1tl5 n PRO 2 Ca 0.00 -0.61 -0.12 0.00 -0.04 0.00 0.00 63.50 62.72 1tl5 n PRO 2 Cb 0.00 -2.66 -0.14 0.00 -0.04 0.00 0.00 33.50 30.66 1tl5 n PRO 2 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1tl5 s LYS 3 N 7.98 0.04 -0.23 0.54 2.20 0.98 -0.91 119.74 130.34 1tl5 s LYS 3 Ca 0.98 0.07 -0.09 0.00 -0.36 0.00 0.00 55.97 56.56 1tl5 s LYS 3 Cb -0.34 -0.00 0.10 0.00 -1.51 0.00 0.00 37.83 36.07 1tl5 s LYS 3 CO 0.25 -0.02 0.52 -3.38 -0.36 0.00 0.00 175.35 172.35 1tl5 s HIS 4 N 0.12 -0.96 0.09 4.03 -3.43 0.31 -0.26 115.29 115.19 1tl5 s HIS 4 Ca -0.01 1.80 0.04 0.00 -0.80 0.00 0.00 55.06 56.08 1tl5 s HIS 4 Cb -0.01 0.48 -0.04 0.00 -1.43 0.00 0.00 32.58 31.58 1tl5 s HIS 4 CO -0.00 -0.52 0.06 -1.21 -2.00 0.00 0.00 174.74 171.07 1tl5 s GLU 5 N 2.41 2.79 -0.00 -0.38 2.02 -1.17 -0.52 118.70 123.84 1tl5 s GLU 5 Ca -0.05 -0.75 0.01 0.00 0.02 0.00 0.00 54.97 54.20 1tl5 s GLU 5 Cb -0.11 -2.67 -0.00 0.00 0.10 0.00 0.00 34.13 31.46 1tl5 s GLU 5 CO -0.15 0.55 -0.02 -0.06 0.02 0.00 0.00 175.26 175.60 1tl5 s PHE 6 N -1.39 0.19 -0.00 1.61 0.40 0.34 -0.31 117.98 118.82 1tl5 s PHE 6 Ca 0.28 -0.03 -0.21 0.00 -0.60 0.00 0.00 56.93 56.38 1tl5 s PHE 6 Cb -0.12 -0.13 -0.05 0.00 0.51 0.00 0.00 43.02 43.23 1tl5 s PHE 6 CO 0.21 -0.01 0.60 0.45 0.70 0.00 0.00 175.22 177.17 1tl5 s SER 7 N 0.00 6.98 -0.05 1.36 0.15 -0.35 -0.65 113.70 121.14 1tl5 s SER 7 Ca 0.00 1.17 -0.01 0.00 0.70 0.00 0.00 55.95 57.81 1tl5 s SER 7 Cb -0.01 -2.37 0.03 0.00 -1.71 0.00 0.00 66.02 61.96 1tl5 s SER 7 CO -0.00 0.10 0.01 -0.69 1.20 0.00 0.00 173.24 173.86 1tl5 s VAL 8 N -0.19 0.26 -1.07 4.45 1.01 0.08 -0.92 120.40 124.01 1tl5 s VAL 8 Ca 0.31 0.15 -0.25 0.00 0.00 0.00 0.00 61.98 62.19 1tl5 s VAL 8 Cb -0.18 -0.41 -0.15 0.00 0.00 0.00 0.00 36.38 35.64 1tl5 s VAL 8 CO 0.17 0.22 2.07 -0.62 0.00 0.00 0.00 175.10 176.94 1tl5 s ASP 9 N 1.72 4.24 -1.11 3.32 2.15 -1.26 -4.40 116.67 121.33 1tl5 s ASP 9 Ca 0.01 -1.08 -0.13 0.00 0.43 0.00 0.00 52.55 51.78 1tl5 s ASP 9 Cb -0.13 -2.59 0.21 0.00 -0.30 0.00 0.00 42.92 40.11 1tl5 s ASP 9 CO -0.04 -3.85 1.23 -0.04 -0.17 0.00 0.00 175.17 172.30 1tl5 s MET 10 N 7.64 4.02 0.16 4.34 -1.94 -1.26 -4.79 119.30 127.46 1tl5 s MET 10 Ca 0.77 -2.68 0.07 0.00 -1.71 0.00 0.00 55.69 52.14 1tl5 s MET 10 Cb -0.05 -4.82 -0.07 0.00 2.01 0.00 0.00 34.83 31.90 1tl5 s MET 10 CO 0.13 -1.55 1.36 1.15 -0.01 0.00 0.00 175.02 176.10 1tl5 h THR 11 N 4.49 1.64 -3.13 2.05 2.02 -1.97 -3.46 112.91 114.53 1tl5 h THR 11 Ca 0.23 -3.07 -0.09 0.00 0.77 0.00 0.00 66.41 64.25 1tl5 h THR 11 Cb 0.91 2.67 -0.17 0.00 -1.74 0.00 0.00 68.15 69.82 1tl5 h THR 11 CO 1.10 0.88 -0.19 0.00 0.37 0.00 0.00 175.52 177.69 1tl5 n GLY 13 N 0.65 -1.74 0.28 0.00 0.00 -1.26 -0.25 105.19 102.88 1tl5 n GLY 13 Ca -0.19 1.00 0.15 0.00 0.00 0.00 0.00 46.02 46.99 1tl5 n GLY 13 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1tl5 h GLY 14 N 0.00 0.00 0.56 -0.02 0.00 -1.99 0.17 103.07 101.78 1tl5 h GLY 14 Ca 0.37 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.79 1tl5 h GLY 14 CO -0.92 0.00 0.51 0.00 0.00 0.00 0.00 176.54 176.13 1tl5 h ALA 16 N 1.46 0.92 -0.37 0.00 0.00 -0.84 -0.59 119.26 119.83 1tl5 h ALA 16 Ca 0.41 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.25 1tl5 h ALA 16 Cb 0.34 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1tl5 h ALA 16 CO -0.23 0.43 0.14 0.93 0.00 0.00 0.00 179.25 180.51 1tl5 h GLU 17 N 0.98 0.29 -0.13 0.00 5.08 -1.38 0.94 114.58 120.36 1tl5 h GLU 17 Ca 0.25 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.63 1tl5 h GLU 17 Cb 0.04 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 1tl5 h GLU 17 CO -0.04 0.19 -0.13 0.00 -1.00 0.00 0.00 179.01 178.02 1tl5 h ALA 18 N 1.24 -0.04 0.45 3.43 0.00 0.20 0.19 119.26 124.72 1tl5 h ALA 18 Ca 0.17 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1tl5 h ALA 18 Cb 0.14 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1tl5 h ALA 18 CO -0.17 -0.58 -0.40 0.28 0.00 0.00 0.00 179.25 178.37 1tl5 h VAL 19 N -0.16 0.19 -0.25 0.00 2.07 -0.99 -1.45 116.25 115.66 1tl5 h VAL 19 Ca 0.09 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.66 1tl5 h VAL 19 Cb 0.30 0.19 -0.05 0.00 -1.52 0.00 0.00 31.29 30.20 1tl5 h VAL 19 CO -0.23 0.00 -0.08 -1.28 0.02 0.00 0.00 177.57 176.01 1tl5 h SER 20 N -0.86 -0.27 0.25 0.57 0.87 -0.36 0.68 113.55 114.44 1tl5 h SER 20 Ca -0.04 0.08 0.01 0.00 -1.23 0.00 0.00 61.79 60.60 1tl5 h SER 20 Cb 0.75 0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 62.84 1tl5 h SER 20 CO -0.04 -0.10 -0.47 0.03 -0.53 0.00 0.00 176.83 175.73 1tl5 h ARG 21 N -0.02 -0.76 -0.38 2.24 3.08 -0.57 0.79 114.38 118.76 1tl5 h ARG 21 Ca 0.12 0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 1tl5 h ARG 21 Cb 0.21 0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1tl5 h ARG 21 CO -0.27 -0.51 0.20 -0.24 -1.07 0.00 0.00 179.97 178.08 1tl5 h VAL 22 N -0.79 1.15 0.09 2.04 3.04 -0.86 1.00 116.25 121.92 1tl5 h VAL 22 Ca -0.01 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 65.28 1tl5 h VAL 22 Cb 0.76 0.73 -0.01 0.00 -2.01 0.00 0.00 31.29 30.76 1tl5 h VAL 22 CO -0.19 0.16 -0.07 -0.07 -1.01 0.00 0.00 177.57 176.38 1tl5 h LEU 23 N 0.48 -0.19 -0.46 3.16 -0.00 -0.76 -1.05 115.31 116.47 1tl5 h LEU 23 Ca 0.13 0.02 0.01 0.00 -0.00 0.00 0.00 57.88 58.04 1tl5 h LEU 23 Cb 0.07 0.07 -0.03 0.00 -0.00 0.00 0.00 40.66 40.77 1tl5 h LEU 23 CO -0.02 -0.12 0.30 0.78 -0.00 0.00 0.00 178.44 179.38 1tl5 h ASN 24 N -0.17 0.50 -1.00 -0.43 2.35 -0.70 -2.12 115.58 114.00 1tl5 h ASN 24 Ca -0.00 -0.01 0.23 0.00 -0.55 0.00 0.00 56.30 55.97 1tl5 h ASN 24 Cb 0.16 -0.12 -0.10 0.00 0.05 0.00 0.00 38.32 38.31 1tl5 h ASN 24 CO -0.01 0.36 0.63 0.11 -1.65 0.00 0.00 177.43 176.86 1tl5 h LYS 25 N 0.60 0.55 -0.77 0.81 1.79 -0.45 0.13 116.57 119.23 1tl5 h LYS 25 Ca 0.18 -0.03 0.15 0.00 -2.18 0.00 0.00 60.65 58.76 1tl5 h LYS 25 Cb -0.04 -0.12 -0.10 0.00 -1.58 0.00 0.00 32.23 30.39 1tl5 h LYS 25 CO -0.05 0.36 0.31 1.25 -1.08 0.00 0.00 179.45 180.24 1tl5 h LEU 26 N 0.57 0.28 0.00 2.94 7.12 -0.48 -3.48 115.31 122.26 1tl5 h LEU 26 Ca 0.58 0.11 0.00 0.00 0.13 0.00 0.00 57.88 58.70 1tl5 h LEU 26 Cb 1.19 0.09 0.00 0.00 -0.53 0.00 0.00 40.66 41.41 1tl5 h LEU 26 CO -0.34 0.09 0.00 0.61 -0.13 0.00 0.00 178.44 178.67 1tl5 n GLY 27 N -1.33 -1.80 2.58 3.75 0.00 0.45 -4.99 105.19 103.84 1tl5 n GLY 27 Ca 0.15 0.63 -0.03 0.00 0.00 0.00 0.00 46.02 46.77 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 1.48 3.77 -0.02 0.00 -1.26 -4.88 105.19 104.28 1tl5 n GLY 28 Ca 0.00 -0.14 -0.39 0.00 0.00 0.00 0.00 46.02 45.49 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 0.13 3.20 -0.67 1.61 0.11 -1.26 -4.99 120.40 118.53 1tl5 s VAL 29 Ca 0.11 1.08 -0.22 0.00 -2.93 0.00 0.00 61.98 60.02 1tl5 s VAL 29 Cb 0.38 -3.64 0.08 0.00 -1.53 0.00 0.00 36.38 31.67 1tl5 s VAL 29 CO -0.10 0.16 0.94 -0.75 -3.33 0.00 0.00 175.10 172.02 1tl5 s LYS 30 N -2.03 3.14 0.16 1.54 2.47 -1.26 -4.87 119.74 118.88 1tl5 s LYS 30 Ca 0.53 -0.97 0.05 0.00 -1.56 0.00 0.00 55.97 54.01 1tl5 s LYS 30 Cb -0.32 -4.29 -0.04 0.00 -1.46 0.00 0.00 37.83 31.72 1tl5 s LYS 30 CO 0.41 -1.78 0.15 1.52 0.16 0.00 0.00 175.35 175.80 1tl5 s TYR 31 N 3.78 3.19 0.09 4.03 1.13 -1.26 -1.06 117.35 127.25 1tl5 s TYR 31 Ca 0.22 0.01 0.04 0.00 -1.41 0.00 0.00 57.07 55.92 1tl5 s TYR 31 Cb -0.17 -1.54 -0.03 0.00 -1.10 0.00 0.00 41.96 39.12 1tl5 s TYR 31 CO 0.08 0.52 -0.11 0.34 -2.51 0.00 0.00 175.55 173.87 1tl5 s ASP 32 N -3.06 1.47 -0.34 -0.18 2.15 0.11 -4.96 116.67 111.87 1tl5 s ASP 32 Ca 0.31 -0.78 0.03 0.00 0.43 0.00 0.00 52.55 52.54 1tl5 s ASP 32 Cb -0.10 -0.00 0.10 0.00 -0.30 0.00 0.00 42.92 42.62 1tl5 s ASP 32 CO 0.24 -0.23 0.07 -0.63 -0.17 0.00 0.00 175.17 174.44 1tl5 s ILE 33 N -2.25 1.94 -1.12 4.11 1.09 -1.26 -0.86 121.20 122.86 1tl5 s ILE 33 Ca 0.04 -2.15 -0.21 0.00 -1.10 0.00 0.00 60.65 57.23 1tl5 s ILE 33 Cb -0.04 -2.44 0.07 0.00 -1.06 0.00 0.00 42.46 38.98 1tl5 s ILE 33 CO 0.00 -0.63 1.53 -0.62 -0.10 0.00 0.00 174.94 175.13 1tl5 s ASP 34 N 1.03 6.64 0.20 3.58 -1.08 0.96 -4.80 116.67 123.20 1tl5 s ASP 34 Ca 0.11 -1.88 0.05 0.00 -0.52 0.00 0.00 52.55 50.31 1tl5 s ASP 34 Cb -0.19 -2.56 0.11 0.00 -1.46 0.00 0.00 42.92 38.82 1tl5 s ASP 34 CO -0.12 -1.34 1.46 0.25 0.52 0.00 0.00 175.17 175.94 1tl5 h LEU 35 N 12.49 0.20 0.30 -1.34 5.85 -1.97 0.16 115.31 130.99 1tl5 h LEU 35 Ca 0.29 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 1tl5 h LEU 35 Cb 0.96 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.93 1tl5 h LEU 35 CO 1.42 0.89 -0.15 1.55 -0.34 0.00 0.00 178.44 181.80 1tl5 h PRO 36 N 0.10 -0.40 -0.01 5.25 0.13 -1.95 -3.33 132.00 131.79 1tl5 h PRO 36 Ca -0.02 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1tl5 h PRO 36 Cb 1.35 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.57 1tl5 h PRO 36 CO 0.11 -0.27 -0.35 0.09 -0.23 0.00 0.00 178.00 177.35 1tl5 n ASN 37 N -5.27 0.98 -2.02 1.44 3.02 -1.18 -4.95 115.26 107.27 1tl5 n ASN 37 Ca -0.10 -0.79 -0.09 0.00 -0.03 0.00 0.00 54.58 53.57 1tl5 n ASN 37 Cb 0.19 0.22 0.04 0.00 -0.61 0.00 0.00 39.78 39.61 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 -0.83 -3.19 -4.21 3.52 4.01 0.43 -4.95 118.16 112.94 1tl5 n LYS 38 Ca 0.10 0.38 -0.14 0.00 -0.51 0.00 0.00 58.31 58.14 1tl5 n LYS 38 Cb 0.35 -4.02 -0.10 0.00 -0.51 0.00 0.00 35.03 30.75 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 -4.96 0.96 -0.06 1.97 1.02 -0.54 -0.75 119.74 117.38 1tl5 s LYS 39 Ca 0.09 -1.30 0.05 0.00 0.02 0.00 0.00 55.97 54.84 1tl5 s LYS 39 Cb -0.04 -0.59 -0.01 0.00 -0.52 0.00 0.00 37.83 36.66 1tl5 s LYS 39 CO 0.33 0.08 -0.22 0.08 -0.92 0.00 0.00 175.35 174.70 1tl5 s VAL 40 N -2.85 2.29 -0.21 3.17 1.01 0.17 -0.03 120.40 123.95 1tl5 s VAL 40 Ca 0.11 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.12 1tl5 s VAL 40 Cb -0.00 -1.85 0.03 0.00 0.00 0.00 0.00 36.38 34.56 1tl5 s VAL 40 CO 0.00 0.57 -0.17 0.00 0.00 0.00 0.00 175.10 175.51 1tl5 s ILE 42 N 1.24 3.77 -0.36 0.00 1.01 0.32 0.10 121.20 127.27 1tl5 s ILE 42 Ca 0.01 -0.45 0.01 0.00 0.00 0.00 0.00 60.65 60.22 1tl5 s ILE 42 Cb -0.15 -2.56 0.15 0.00 0.01 0.00 0.00 42.46 39.91 1tl5 s ILE 42 CO -0.10 0.59 0.24 -0.70 0.00 0.00 0.00 174.94 174.96 1tl5 s GLU 43 N -0.67 0.62 -0.25 2.79 2.12 -0.22 -0.53 118.70 122.56 1tl5 s GLU 43 Ca 0.10 -1.48 -0.09 0.00 0.36 0.00 0.00 54.97 53.86 1tl5 s GLU 43 Cb -0.11 -1.33 0.11 0.00 0.26 0.00 0.00 34.13 33.06 1tl5 s GLU 43 CO 0.02 -1.24 0.55 0.45 -0.54 0.00 0.00 175.26 174.50 1tl5 s SER 44 N 0.87 -0.76 -1.20 -1.70 0.15 -0.09 -4.45 113.70 106.52 1tl5 s SER 44 Ca 0.21 1.32 -0.17 0.00 0.70 0.00 0.00 55.95 58.01 1tl5 s SER 44 Cb -0.18 1.84 -0.03 0.00 -1.71 0.00 0.00 66.02 65.93 1tl5 s SER 44 CO -0.03 -0.22 2.11 1.21 1.20 0.00 0.00 173.24 177.51 1tl5 n GLU 45 N 5.34 2.34 -4.12 5.44 2.13 -1.26 -4.76 120.64 125.75 1tl5 n GLU 45 Ca -0.11 -2.32 -0.14 0.00 0.66 0.00 0.00 57.16 55.25 1tl5 n GLU 45 Cb 0.50 -3.15 -0.06 0.00 0.27 0.00 0.00 31.44 29.00 1tl5 n GLU 45 CO 0.00 0.00 0.00 -3.38 -0.41 0.00 0.00 177.13 173.34 1tl5 s HIS 46 N 3.91 1.08 0.22 4.31 -3.43 -1.26 -5.14 115.29 114.98 1tl5 s HIS 46 Ca 0.51 -1.27 -0.32 0.00 -0.80 0.00 0.00 55.06 53.18 1tl5 s HIS 46 Cb 0.14 -0.21 -0.13 0.00 -1.43 0.00 0.00 32.58 30.95 1tl5 s HIS 46 CO -0.01 -0.99 1.58 0.45 -2.00 0.00 0.00 174.74 173.77 1tl5 n SER 47 N -1.09 3.42 -0.02 7.38 2.88 -1.26 -4.90 113.62 120.04 1tl5 n SER 47 Ca 0.02 1.11 -0.10 0.00 -1.33 0.00 0.00 58.87 58.56 1tl5 n SER 47 Cb 0.62 -1.50 0.04 0.00 -0.75 0.00 0.00 64.21 62.62 1tl5 n SER 47 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 1tl5 h MET 48 N 5.47 0.63 -0.19 -1.46 2.86 -2.01 -3.25 114.93 116.98 1tl5 h MET 48 Ca -0.45 -0.38 0.05 0.00 -2.06 0.00 0.00 59.70 56.86 1tl5 h MET 48 Cb 1.24 0.04 -0.05 0.00 0.06 0.00 0.00 31.60 32.89 1tl5 h MET 48 CO 0.85 0.99 -0.13 0.22 1.06 0.00 0.00 176.91 179.91 1tl5 h ASP 49 N 0.49 -0.42 -0.53 1.22 3.58 -1.99 -0.34 116.42 118.43 1tl5 h ASP 49 Ca 0.02 0.09 0.09 0.00 0.42 0.00 0.00 57.03 57.65 1tl5 h ASP 49 Cb 1.07 0.22 -0.11 0.00 1.72 0.00 0.00 39.33 42.24 1tl5 h ASP 49 CO 0.10 -0.17 -0.35 0.74 -2.88 0.00 0.00 179.24 176.68 1tl5 h THR 50 N -0.13 0.17 0.40 2.25 2.02 -1.96 0.15 112.91 115.81 1tl5 h THR 50 Ca 0.11 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.28 1tl5 h THR 50 Cb 0.30 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 1tl5 h THR 50 CO -0.27 0.00 -0.25 -0.07 0.37 0.00 0.00 175.52 175.29 1tl5 h LEU 51 N -0.21 -0.64 -0.53 2.58 3.38 -1.43 -0.59 115.31 117.88 1tl5 h LEU 51 Ca 0.20 0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.32 1tl5 h LEU 51 Cb 0.55 0.19 -0.11 0.00 0.09 0.00 0.00 40.66 41.39 1tl5 h LEU 51 CO -0.64 -0.40 -0.19 0.25 0.09 0.00 0.00 178.44 177.56 1tl5 h LEU 52 N -0.63 -0.66 -1.17 1.67 6.46 -0.29 0.22 115.31 120.90 1tl5 h LEU 52 Ca -0.04 0.18 -0.03 0.00 -0.12 0.00 0.00 57.88 57.87 1tl5 h LEU 52 Cb 0.52 0.39 -0.03 0.00 -0.73 0.00 0.00 40.66 40.82 1tl5 h LEU 52 CO 0.04 -0.22 0.23 0.00 -0.62 0.00 0.00 178.44 177.87 1tl5 h ALA 53 N 1.38 1.35 0.24 1.25 0.00 -0.55 -1.63 119.26 121.31 1tl5 h ALA 53 Ca 0.25 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1tl5 h ALA 53 Cb 0.45 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1tl5 h ALA 53 CO -0.58 0.49 -0.12 1.15 0.00 0.00 0.00 179.25 180.20 1tl5 h THR 54 N 0.80 0.00 -0.21 0.00 2.02 0.41 -3.38 112.91 112.55 1tl5 h THR 54 Ca 0.19 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 67.23 1tl5 h THR 54 Cb 0.15 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.55 1tl5 h THR 54 CO -0.02 0.00 0.06 0.17 0.37 0.00 0.00 175.52 176.10 1tl5 h LEU 55 N -0.45 0.27 -0.87 2.58 8.10 -0.61 0.24 115.31 124.57 1tl5 h LEU 55 Ca -0.03 -0.02 0.30 0.00 0.11 0.00 0.00 57.88 58.24 1tl5 h LEU 55 Cb 0.25 -0.07 -0.16 0.00 -0.44 0.00 0.00 40.66 40.24 1tl5 h LEU 55 CO 0.05 0.27 0.24 0.29 -4.11 0.00 0.00 178.44 175.19 1tl5 n LYS 56 N -4.42 -0.06 0.05 0.17 5.02 -0.62 -1.22 118.16 117.09 1tl5 n LYS 56 Ca 0.00 1.26 0.06 0.00 -2.02 0.00 0.00 58.31 57.61 1tl5 n LYS 56 Cb 0.14 -2.12 0.28 0.00 -0.02 0.00 0.00 35.03 33.31 1tl5 n LYS 56 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1tl5 n LYS 57 N -5.12 0.06 0.11 1.97 5.02 0.07 -0.57 118.16 119.69 1tl5 n LYS 57 Ca 0.27 0.45 0.10 0.00 -2.02 0.00 0.00 58.31 57.11 1tl5 n LYS 57 Cb 0.90 -1.65 0.58 0.00 -0.02 0.00 0.00 35.03 34.84 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 0.96 -0.37 -0.18 1.35 -1.36 -3.46 112.91 109.85 1tl5 h THR 58 Ca 0.00 -0.06 -0.16 0.00 -0.55 0.00 0.00 66.41 65.64 1tl5 h THR 58 Cb 0.12 0.76 -0.06 0.00 -1.73 0.00 0.00 68.15 67.24 1tl5 h THR 58 CO 0.00 0.03 -0.14 0.61 -0.25 0.00 0.00 175.52 175.77 1tl5 n GLY 59 N -1.54 0.95 3.89 5.82 0.00 0.26 -5.04 105.19 109.53 1tl5 n GLY 59 Ca 0.02 -0.70 -0.29 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.66 2.27 0.00 1.61 -0.14 -1.26 -4.94 119.74 114.62 1tl5 s LYS 60 Ca 0.00 0.24 -0.02 0.00 -1.36 0.00 0.00 55.97 54.83 1tl5 s LYS 60 Cb 0.00 -1.97 -0.09 0.00 -1.68 0.00 0.00 37.83 34.09 1tl5 s LYS 60 CO 0.00 -1.40 1.90 2.41 -0.76 0.00 0.00 175.35 177.49 1tl5 n THR 61 N -3.21 1.59 -2.76 2.17 -1.04 -1.26 -4.91 114.28 104.85 1tl5 n THR 61 Ca 0.08 -0.65 -0.38 0.00 -2.04 0.00 0.00 64.05 61.05 1tl5 n THR 61 Cb 0.60 -1.58 -0.06 0.00 -1.82 0.00 0.00 70.33 67.46 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 1.29 4.13 0.25 12.58 0.11 -1.26 -4.09 120.40 133.41 1tl5 s VAL 62 Ca 0.23 1.94 -0.03 0.00 -2.93 0.00 0.00 61.98 61.18 1tl5 s VAL 62 Cb 0.11 -4.15 -0.02 0.00 -1.53 0.00 0.00 36.38 30.78 1tl5 s VAL 62 CO 0.00 0.30 0.28 -0.55 -3.33 0.00 0.00 175.10 171.81 1tl5 s SER 63 N -1.41 0.38 -0.19 3.54 0.15 -0.10 -5.01 113.70 111.06 1tl5 s SER 63 Ca 0.46 -1.33 -0.03 0.00 0.70 0.00 0.00 55.95 55.75 1tl5 s SER 63 Cb -0.22 0.49 -0.01 0.00 -1.71 0.00 0.00 66.02 64.57 1tl5 s SER 63 CO 0.28 -1.00 -0.07 -0.47 1.20 0.00 0.00 173.24 173.18 1tl5 s TYR 64 N -3.89 2.93 -0.43 3.44 5.04 -1.26 -1.22 117.35 121.96 1tl5 s TYR 64 Ca 0.34 -0.84 0.05 0.00 -2.44 0.00 0.00 57.07 54.18 1tl5 s TYR 64 Cb 0.04 -2.03 0.17 0.00 0.35 0.00 0.00 41.96 40.49 1tl5 s TYR 64 CO 0.14 -0.43 0.51 -0.48 -1.34 0.00 0.00 175.55 173.95 1tl5 s LEU 65 N 1.11 -0.35 0.00 6.97 -0.00 0.58 -4.93 118.68 122.06 1tl5 s LEU 65 Ca 0.01 -1.88 0.00 0.00 -0.00 0.00 0.00 54.13 52.26 1tl5 s LEU 65 Cb -0.15 0.93 0.00 0.00 -0.00 0.00 0.00 46.19 46.98 1tl5 s LEU 65 CO -0.01 -0.16 0.00 0.61 -0.00 0.00 0.00 176.35 176.79 1tl5 n GLY 66 N 3.53 4.46 3.44 -3.48 0.00 -1.21 -4.27 105.19 107.66 1tl5 n GLY 66 Ca 0.18 -0.64 -0.08 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.58 0.00 0.99 2.96 -1.25 -3.03 118.68 117.77 1tl5 s LEU 67 Ca 0.00 1.20 0.00 0.00 -0.22 0.00 0.00 54.13 55.11 1tl5 s LEU 67 Cb 0.00 1.82 0.00 0.00 0.50 0.00 0.00 46.19 48.51 1tl5 s LEU 67 CO 0.00 -0.22 0.00 1.21 -1.32 0.00 0.00 176.35 176.02