#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tl4 h PRO 2 N 0.00 0.40 -6.58 0.03 0.13 -1.43 -3.38 132.00 121.18 1tl4 h PRO 2 Ca 0.00 -0.02 -0.69 0.00 -0.87 0.00 0.00 66.00 64.42 1tl4 h PRO 2 Cb 0.00 -0.09 -0.24 0.00 0.13 0.00 0.00 31.00 30.80 1tl4 h PRO 2 CO 0.00 0.26 -0.82 0.15 -0.23 0.00 0.00 178.00 177.36 1tl4 s LYS 3 N -5.39 2.08 -0.26 0.86 1.02 -0.07 -0.59 119.74 117.38 1tl4 s LYS 3 Ca -0.07 -0.97 -0.05 0.00 0.02 0.00 0.00 55.97 54.90 1tl4 s LYS 3 Cb 0.17 -2.16 0.14 0.00 -0.52 0.00 0.00 37.83 35.46 1tl4 s LYS 3 CO 0.72 0.55 0.52 -3.38 -0.92 0.00 0.00 175.35 172.84 1tl4 s HIS 4 N -0.86 -1.18 0.28 3.18 -3.43 0.32 -0.48 115.29 113.11 1tl4 s HIS 4 Ca 0.13 1.64 -0.29 0.00 -0.80 0.00 0.00 55.06 55.75 1tl4 s HIS 4 Cb -0.10 0.45 -0.09 0.00 -1.43 0.00 0.00 32.58 31.40 1tl4 s HIS 4 CO 0.04 -0.70 0.97 -1.21 -2.00 0.00 0.00 174.74 171.84 1tl4 s GLU 5 N 2.75 4.71 -0.03 -0.38 2.02 -0.31 -0.58 118.70 126.88 1tl4 s GLU 5 Ca 0.07 1.49 0.04 0.00 0.02 0.00 0.00 54.97 56.60 1tl4 s GLU 5 Cb -0.14 -3.09 -0.00 0.00 0.10 0.00 0.00 34.13 30.99 1tl4 s GLU 5 CO -0.17 0.37 -0.15 -0.06 0.02 0.00 0.00 175.26 175.27 1tl4 s PHE 6 N -1.32 1.47 0.00 1.61 0.40 0.48 -0.41 117.98 120.21 1tl4 s PHE 6 Ca 0.45 -0.37 -0.04 0.00 -0.60 0.00 0.00 56.93 56.37 1tl4 s PHE 6 Cb -0.25 -0.99 -0.04 0.00 0.51 0.00 0.00 43.02 42.25 1tl4 s PHE 6 CO 0.31 -0.11 0.22 0.45 0.70 0.00 0.00 175.22 176.79 1tl4 s SER 7 N -0.07 6.42 0.33 1.36 0.15 0.01 -0.32 113.70 121.57 1tl4 s SER 7 Ca -0.00 0.43 0.06 0.00 0.70 0.00 0.00 55.95 57.13 1tl4 s SER 7 Cb -0.09 -2.03 -0.03 0.00 -1.71 0.00 0.00 66.02 62.15 1tl4 s SER 7 CO 0.01 0.25 0.23 -0.69 1.20 0.00 0.00 173.24 174.24 1tl4 s VAL 8 N -1.34 0.12 -0.08 4.45 1.01 -0.26 -0.18 120.40 124.12 1tl4 s VAL 8 Ca 0.28 -2.00 -0.05 0.00 0.00 0.00 0.00 61.98 60.22 1tl4 s VAL 8 Cb -0.13 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 1tl4 s VAL 8 CO 0.18 0.00 0.11 -0.62 0.00 0.00 0.00 175.10 174.77 1tl4 s ASP 9 N -3.39 6.07 -0.27 3.32 2.15 -1.24 -4.67 116.67 118.65 1tl4 s ASP 9 Ca 0.37 0.35 -0.01 0.00 0.43 0.00 0.00 52.55 53.69 1tl4 s ASP 9 Cb 0.03 -1.89 0.09 0.00 -0.30 0.00 0.00 42.92 40.85 1tl4 s ASP 9 CO 0.23 0.36 0.06 -0.04 -0.17 0.00 0.00 175.17 175.62 1tl4 s MET 10 N -1.23 0.82 0.43 4.34 -1.94 -1.26 -4.73 119.30 115.74 1tl4 s MET 10 Ca 0.17 -0.92 0.27 0.00 -1.71 0.00 0.00 55.69 53.50 1tl4 s MET 10 Cb -0.12 -2.11 0.76 0.00 2.01 0.00 0.00 34.83 35.37 1tl4 s MET 10 CO 0.07 -0.86 1.75 1.79 -0.01 0.00 0.00 175.02 177.76 1tl4 h THR 11 N 6.52 0.00 -3.36 2.05 1.35 -1.98 -3.46 112.91 114.04 1tl4 h THR 11 Ca -0.15 -0.73 -0.02 0.00 -0.55 0.00 0.00 66.41 64.96 1tl4 h THR 11 Cb 1.05 1.71 -0.09 0.00 -1.73 0.00 0.00 68.15 69.09 1tl4 h THR 11 CO 0.43 0.00 0.01 0.00 -0.25 0.00 0.00 175.52 175.72 1tl4 h GLY 13 N 2.20 1.67 -0.37 0.00 0.00 -2.01 -0.26 103.07 104.29 1tl4 h GLY 13 Ca -0.27 -0.11 0.31 0.00 0.00 0.00 0.00 47.33 47.27 1tl4 h GLY 13 CO 0.35 -0.44 0.74 -1.33 0.00 0.00 0.00 176.54 175.86 1tl4 h GLY 14 N 0.23 1.04 0.86 4.60 0.00 -1.98 0.20 103.07 108.03 1tl4 h GLY 14 Ca 0.64 -0.16 -0.06 0.00 0.00 0.00 0.00 47.33 47.76 1tl4 h GLY 14 CO -0.66 -0.17 -0.05 0.00 0.00 0.00 0.00 176.54 175.66 1tl4 h ALA 16 N 0.78 0.48 0.11 0.00 0.00 -0.79 0.80 119.26 120.64 1tl4 h ALA 16 Ca 0.07 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1tl4 h ALA 16 Cb 0.51 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1tl4 h ALA 16 CO 0.02 0.06 -0.38 0.93 0.00 0.00 0.00 179.25 179.88 1tl4 h GLU 17 N 0.46 -0.58 -0.37 0.00 5.08 -0.96 -0.15 114.58 118.07 1tl4 h GLU 17 Ca 0.13 0.04 0.08 0.00 -1.00 0.00 0.00 59.36 58.61 1tl4 h GLU 17 Cb 0.14 0.13 -0.09 0.00 0.50 0.00 0.00 28.75 29.44 1tl4 h GLU 17 CO -0.01 -0.39 -0.26 0.00 -1.00 0.00 0.00 179.01 177.35 1tl4 h ALA 18 N -0.05 -0.07 -0.46 3.43 0.00 -0.43 0.81 119.26 122.50 1tl4 h ALA 18 Ca 0.03 0.11 0.09 0.00 0.00 0.00 0.00 54.91 55.15 1tl4 h ALA 18 Cb 0.64 0.58 -0.09 0.00 0.00 0.00 0.00 17.79 18.92 1tl4 h ALA 18 CO -0.23 -0.65 -0.15 0.28 0.00 0.00 0.00 179.25 178.50 1tl4 h VAL 19 N -0.21 0.48 -0.67 0.00 2.07 -0.56 -0.45 116.25 116.90 1tl4 h VAL 19 Ca 0.18 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.75 1tl4 h VAL 19 Cb 0.49 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.68 1tl4 h VAL 19 CO -0.49 0.00 0.38 -1.28 0.02 0.00 0.00 177.57 176.20 1tl4 h SER 20 N -0.05 0.57 -0.27 0.57 0.87 0.10 0.19 113.55 115.53 1tl4 h SER 20 Ca 0.22 0.03 0.06 0.00 -1.23 0.00 0.00 61.79 60.86 1tl4 h SER 20 Cb 0.38 -0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 62.21 1tl4 h SER 20 CO -0.50 0.37 -0.08 0.03 -0.53 0.00 0.00 176.83 176.12 1tl4 h ARG 21 N 0.70 -0.01 0.04 2.24 3.08 -0.35 0.28 114.38 120.35 1tl4 h ARG 21 Ca 0.30 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.35 1tl4 h ARG 21 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1tl4 h ARG 21 CO -0.18 -0.01 -0.02 0.28 -1.07 0.00 0.00 179.97 178.97 1tl4 h VAL 22 N -0.01 0.99 -0.29 2.04 2.07 0.32 0.41 116.25 121.78 1tl4 h VAL 22 Ca 0.13 -0.09 -0.16 0.00 0.82 0.00 0.00 66.70 67.41 1tl4 h VAL 22 Cb 0.22 1.05 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1tl4 h VAL 22 CO -0.29 0.02 -0.44 -0.07 0.02 0.00 0.00 177.57 176.81 1tl4 h LEU 23 N -0.09 0.90 -0.93 2.57 3.38 -0.62 -2.67 115.31 117.85 1tl4 h LEU 23 Ca -0.00 -0.51 0.10 0.00 0.09 0.00 0.00 57.88 57.55 1tl4 h LEU 23 Cb 0.07 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 40.49 1tl4 h LEU 23 CO 0.01 1.23 0.57 -1.13 0.09 0.00 0.00 178.44 179.21 1tl4 h ASN 24 N 0.59 0.84 -0.96 -0.43 -0.00 -0.12 0.10 115.58 115.60 1tl4 h ASN 24 Ca 0.03 0.04 0.16 0.00 -0.00 0.00 0.00 56.30 56.53 1tl4 h ASN 24 Cb 1.04 -0.13 -0.08 0.00 -0.00 0.00 0.00 38.32 39.15 1tl4 h ASN 24 CO 0.10 0.48 0.61 0.50 -0.00 0.00 0.00 177.43 179.12 1tl4 h LYS 25 N 0.95 0.72 -0.04 6.67 1.63 -0.58 0.55 116.57 126.46 1tl4 h LYS 25 Ca 0.44 -0.04 0.04 0.00 -0.85 0.00 0.00 60.65 60.23 1tl4 h LYS 25 Cb 0.37 -0.16 -0.05 0.00 -0.60 0.00 0.00 32.23 31.79 1tl4 h LYS 25 CO -0.24 0.48 -0.24 1.25 -3.45 0.00 0.00 179.45 177.25 1tl4 h LEU 26 N 0.74 -0.71 0.00 5.20 7.12 -0.59 -3.49 115.31 123.58 1tl4 h LEU 26 Ca 0.51 0.10 0.00 0.00 0.13 0.00 0.00 57.88 58.62 1tl4 h LEU 26 Cb 0.80 0.30 0.00 0.00 -0.53 0.00 0.00 40.66 41.23 1tl4 h LEU 26 CO -0.27 -0.30 0.00 0.61 -0.13 0.00 0.00 178.44 178.35 1tl4 n GLY 27 N -1.36 1.21 0.12 3.75 0.00 0.18 -4.91 105.19 104.19 1tl4 n GLY 27 Ca -0.04 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.45 1tl4 n GLY 27 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1tl4 h GLY 28 N 0.00 0.34 -0.60 -0.02 0.00 -1.86 -3.44 103.07 97.50 1tl4 h GLY 28 Ca 0.00 -0.20 -0.08 0.00 0.00 0.00 0.00 47.33 47.06 1tl4 h GLY 28 CO 0.00 0.18 0.03 3.33 0.00 0.00 0.00 176.54 180.09 1tl4 n VAL 29 N -4.80 0.00 -4.37 4.60 0.24 -1.26 -5.00 118.33 107.74 1tl4 n VAL 29 Ca -0.04 0.00 -0.28 0.00 -2.04 0.00 0.00 64.34 61.99 1tl4 n VAL 29 Cb 0.14 -0.02 -0.13 0.00 -1.47 0.00 0.00 33.84 32.36 1tl4 n VAL 29 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1tl4 s LYS 30 N 0.14 1.34 -0.01 7.34 -0.14 -1.09 -4.85 119.74 122.47 1tl4 s LYS 30 Ca 0.09 -1.31 -0.24 0.00 -1.36 0.00 0.00 55.97 53.14 1tl4 s LYS 30 Cb -0.13 -1.77 0.05 0.00 -1.68 0.00 0.00 37.83 34.31 1tl4 s LYS 30 CO 0.06 0.42 0.54 1.52 -0.76 0.00 0.00 175.35 177.13 1tl4 s TYR 31 N -1.12 -0.47 0.10 3.18 1.13 -1.26 -0.36 117.35 118.55 1tl4 s TYR 31 Ca 0.12 0.72 -0.12 0.00 -1.41 0.00 0.00 57.07 56.38 1tl4 s TYR 31 Cb -0.10 0.31 -0.06 0.00 -1.10 0.00 0.00 41.96 41.01 1tl4 s TYR 31 CO 0.06 -0.57 0.47 0.34 -2.51 0.00 0.00 175.55 173.34 1tl4 s ASP 32 N -1.47 6.75 -0.39 -0.18 2.15 0.65 -4.91 116.67 119.28 1tl4 s ASP 32 Ca -0.10 0.94 0.01 0.00 0.43 0.00 0.00 52.55 53.83 1tl4 s ASP 32 Cb -0.01 -2.24 0.13 0.00 -0.30 0.00 0.00 42.92 40.50 1tl4 s ASP 32 CO 0.05 0.16 0.20 -0.63 -0.17 0.00 0.00 175.17 174.78 1tl4 s ILE 33 N -1.38 1.02 -0.32 4.11 1.01 -1.26 -1.05 121.20 123.32 1tl4 s ILE 33 Ca 0.34 -2.09 -0.16 0.00 0.00 0.00 0.00 60.65 58.74 1tl4 s ILE 33 Cb -0.15 -1.73 -0.02 0.00 0.01 0.00 0.00 42.46 40.58 1tl4 s ILE 33 CO 0.18 -0.86 0.40 -0.62 0.00 0.00 0.00 174.94 174.04 1tl4 s ASP 34 N 0.82 6.23 -0.06 3.58 -1.08 0.20 -4.98 116.67 121.38 1tl4 s ASP 34 Ca 0.16 -0.02 -0.05 0.00 -0.52 0.00 0.00 52.55 52.12 1tl4 s ASP 34 Cb -0.22 -2.22 -0.03 0.00 -1.46 0.00 0.00 42.92 38.99 1tl4 s ASP 34 CO -0.06 -0.32 0.23 -0.07 0.52 0.00 0.00 175.17 175.47 1tl4 h LEU 35 N 8.78 -0.14 -1.39 -1.34 3.38 -1.95 0.11 115.31 122.74 1tl4 h LEU 35 Ca -0.30 0.00 0.17 0.00 0.09 0.00 0.00 57.88 57.85 1tl4 h LEU 35 Cb 1.15 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.86 1tl4 h LEU 35 CO 0.70 0.23 0.57 1.55 0.09 0.00 0.00 178.44 181.57 1tl4 h PRO 36 N -0.83 0.53 -0.01 1.13 0.13 -1.96 0.65 132.00 131.65 1tl4 h PRO 36 Ca -0.02 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1tl4 h PRO 36 Cb 0.13 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.14 1tl4 h PRO 36 CO 0.03 0.35 -0.50 0.09 -0.23 0.00 0.00 178.00 177.74 1tl4 n ASN 37 N -4.54 1.23 -3.26 1.44 3.02 -1.26 -5.03 115.26 106.85 1tl4 n ASN 37 Ca 0.18 -0.98 -0.09 0.00 -0.03 0.00 0.00 54.58 53.65 1tl4 n ASN 37 Cb 0.57 0.41 0.00 0.00 -0.61 0.00 0.00 39.78 40.15 1tl4 n ASN 37 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1tl4 n LYS 38 N -0.76 -1.51 -3.86 3.52 4.01 0.22 -4.85 118.16 114.92 1tl4 n LYS 38 Ca 0.09 1.35 -0.11 0.00 -0.51 0.00 0.00 58.31 59.13 1tl4 n LYS 38 Cb 0.38 -4.63 -0.10 0.00 -0.51 0.00 0.00 35.03 30.17 1tl4 n LYS 38 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1tl4 s LYS 39 N -3.48 0.51 -0.28 1.97 1.02 0.31 -1.10 119.74 118.70 1tl4 s LYS 39 Ca 0.04 -0.40 -0.02 0.00 0.02 0.00 0.00 55.97 55.61 1tl4 s LYS 39 Cb -0.01 0.21 0.09 0.00 -0.52 0.00 0.00 37.83 37.61 1tl4 s LYS 39 CO 0.80 -0.12 0.09 0.08 -0.92 0.00 0.00 175.35 175.28 1tl4 s VAL 40 N -1.45 0.50 -0.25 3.17 1.01 0.56 -0.63 120.40 123.30 1tl4 s VAL 40 Ca -0.14 -1.01 -0.07 0.00 0.00 0.00 0.00 61.98 60.76 1tl4 s VAL 40 Cb -0.07 -1.31 -0.02 0.00 0.00 0.00 0.00 36.38 34.99 1tl4 s VAL 40 CO 0.02 -0.59 0.05 0.00 0.00 0.00 0.00 175.10 174.57 1tl4 s ILE 42 N 1.56 3.70 -0.44 0.00 1.01 0.25 -0.25 121.20 127.04 1tl4 s ILE 42 Ca 0.05 -0.42 -0.12 0.00 0.00 0.00 0.00 60.65 60.16 1tl4 s ILE 42 Cb -0.15 -2.62 0.07 0.00 0.01 0.00 0.00 42.46 39.77 1tl4 s ILE 42 CO 0.02 0.49 0.32 -1.61 0.00 0.00 0.00 174.94 174.16 1tl4 s GLU 43 N 0.44 2.78 -0.27 2.79 8.01 0.51 -0.52 118.70 132.44 1tl4 s GLU 43 Ca -0.05 -1.40 -0.19 0.00 0.01 0.00 0.00 54.97 53.35 1tl4 s GLU 43 Cb -0.15 -3.93 0.08 0.00 -4.31 0.00 0.00 34.13 25.82 1tl4 s GLU 43 CO 0.03 -0.97 0.69 0.45 0.01 0.00 0.00 175.26 175.47 1tl4 s SER 44 N 2.30 -0.87 -1.02 -0.19 0.15 0.24 -2.65 113.70 111.67 1tl4 s SER 44 Ca 0.03 1.47 -0.12 0.00 0.70 0.00 0.00 55.95 58.04 1tl4 s SER 44 Cb -0.23 1.39 -0.08 0.00 -1.71 0.00 0.00 66.02 65.39 1tl4 s SER 44 CO 0.04 -0.24 2.17 -0.62 1.20 0.00 0.00 173.24 175.79 1tl4 n GLU 45 N 3.77 2.19 -4.38 5.44 1.02 -1.26 -3.85 120.64 123.57 1tl4 n GLU 45 Ca -0.18 -1.78 -0.19 0.00 -0.02 0.00 0.00 57.16 54.99 1tl4 n GLU 45 Cb 0.58 -2.72 -0.10 0.00 -0.02 0.00 0.00 31.44 29.17 1tl4 n GLU 45 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1tl4 s HIS 46 N 3.71 1.77 0.09 -0.32 2.46 -1.26 -4.97 115.29 116.77 1tl4 s HIS 46 Ca 0.49 -0.71 -0.31 0.00 0.47 0.00 0.00 55.06 55.00 1tl4 s HIS 46 Cb 0.13 -0.96 -0.09 0.00 -0.13 0.00 0.00 32.58 31.52 1tl4 s HIS 46 CO 0.00 0.23 1.81 -1.54 -2.47 0.00 0.00 174.74 172.77 1tl4 s SER 47 N -3.37 6.47 0.25 9.88 1.04 -1.26 -4.72 113.70 122.00 1tl4 s SER 47 Ca 0.27 2.67 -0.05 0.00 0.48 0.00 0.00 55.95 59.32 1tl4 s SER 47 Cb 0.03 -2.56 0.29 0.00 0.10 0.00 0.00 66.02 63.88 1tl4 s SER 47 CO 0.09 -0.99 1.86 0.00 0.98 0.00 0.00 173.24 175.19 1tl4 h MET 48 N 8.91 1.13 -0.35 4.02 -0.00 -1.96 -0.95 114.93 125.73 1tl4 h MET 48 Ca -0.46 -0.15 0.04 0.00 -0.00 0.00 0.00 59.70 59.14 1tl4 h MET 48 Cb 1.22 -0.21 -0.06 0.00 -0.00 0.00 0.00 31.60 32.54 1tl4 h MET 48 CO 0.94 0.85 -0.43 0.22 -0.00 0.00 0.00 176.91 178.50 1tl4 h ASP 49 N 1.12 -1.44 -0.34 -0.10 3.58 -1.99 0.67 116.42 117.92 1tl4 h ASP 49 Ca 0.28 0.19 -0.14 0.00 0.42 0.00 0.00 57.03 57.78 1tl4 h ASP 49 Cb 0.08 0.60 -0.01 0.00 1.72 0.00 0.00 39.33 41.72 1tl4 h ASP 49 CO -0.04 -0.29 -0.30 0.74 -2.88 0.00 0.00 179.24 176.47 1tl4 h THR 50 N -0.27 1.27 0.08 2.25 2.02 -1.82 0.15 112.91 116.59 1tl4 h THR 50 Ca 0.06 -1.46 0.00 0.00 0.77 0.00 0.00 66.41 65.78 1tl4 h THR 50 Cb 0.44 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 68.12 1tl4 h THR 50 CO -0.48 0.49 -0.20 -0.07 0.37 0.00 0.00 175.52 175.63 1tl4 h LEU 51 N 0.73 -0.60 -0.60 2.58 3.38 -1.07 -0.20 115.31 119.53 1tl4 h LEU 51 Ca 0.08 0.06 0.11 0.00 0.09 0.00 0.00 57.88 58.22 1tl4 h LEU 51 Cb 0.86 0.22 -0.12 0.00 0.09 0.00 0.00 40.66 41.71 1tl4 h LEU 51 CO 0.08 -0.23 -0.26 0.25 0.09 0.00 0.00 178.44 178.37 1tl4 h LEU 52 N -0.32 -0.91 -1.27 1.67 5.85 -0.43 0.29 115.31 120.20 1tl4 h LEU 52 Ca -0.01 0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.88 1tl4 h LEU 52 Cb 0.30 0.49 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 1tl4 h LEU 52 CO -0.09 -0.27 0.08 0.00 -0.34 0.00 0.00 178.44 177.82 1tl4 h ALA 53 N 1.26 1.41 -0.15 1.25 0.00 -0.63 0.28 119.26 122.68 1tl4 h ALA 53 Ca 0.26 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 1tl4 h ALA 53 Cb 0.52 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1tl4 h ALA 53 CO -0.66 0.42 -0.19 1.15 0.00 0.00 0.00 179.25 179.97 1tl4 h THR 54 N 0.57 1.35 -0.84 0.00 2.02 0.27 -3.27 112.91 113.02 1tl4 h THR 54 Ca 0.13 -1.39 0.00 0.00 0.77 0.00 0.00 66.41 65.92 1tl4 h THR 54 Cb 0.24 1.91 -0.04 0.00 -1.74 0.00 0.00 68.15 68.52 1tl4 h THR 54 CO -0.00 0.41 0.54 -0.07 0.37 0.00 0.00 175.52 176.77 1tl4 h LEU 55 N 0.03 0.97 -1.78 2.58 3.38 0.34 -0.78 115.31 120.04 1tl4 h LEU 55 Ca 0.02 -0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.05 1tl4 h LEU 55 Cb 0.75 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1tl4 h LEU 55 CO 0.05 0.72 0.52 0.11 0.09 0.00 0.00 178.44 179.93 1tl4 h LYS 56 N 1.14 0.00 -0.26 1.13 1.57 -0.53 -2.15 116.57 117.47 1tl4 h LYS 56 Ca 0.30 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 59.16 1tl4 h LYS 56 Cb -0.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1tl4 h LYS 56 CO -0.06 0.00 0.21 0.87 -0.57 0.00 0.00 179.45 179.90 1tl4 h LYS 57 N 0.00 0.00 0.00 3.15 1.79 -1.18 0.34 116.57 120.67 1tl4 h LYS 57 Ca 0.16 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.57 1tl4 h LYS 57 Cb 1.20 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.84 1tl4 h LYS 57 CO -0.00 0.00 -0.27 1.79 -1.08 0.00 0.00 179.45 179.89 1tl4 h THR 58 N 0.00 1.12 -3.90 -0.16 1.35 -1.59 -3.47 112.91 106.27 1tl4 h THR 58 Ca 0.12 -0.94 -0.39 0.00 -0.55 0.00 0.00 66.41 64.65 1tl4 h THR 58 Cb 0.54 1.52 0.01 0.00 -1.73 0.00 0.00 68.15 68.49 1tl4 h THR 58 CO -0.00 0.26 -0.54 0.61 -0.25 0.00 0.00 175.52 175.60 1tl4 n GLY 59 N -0.69 -0.51 2.79 5.82 0.00 0.12 -5.00 105.19 107.73 1tl4 n GLY 59 Ca -0.02 0.06 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 1tl4 n GLY 59 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tl4 n LYS 60 N -3.47 -1.06 -0.99 1.61 4.76 -1.26 -4.91 118.16 112.84 1tl4 n LYS 60 Ca -0.16 -1.48 -0.30 0.00 -2.87 0.00 0.00 58.31 53.49 1tl4 n LYS 60 Cb 0.64 -1.01 -0.03 0.00 -1.84 0.00 0.00 35.03 32.79 1tl4 n LYS 60 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1tl4 n THR 61 N -3.40 2.72 -2.58 -0.18 -1.04 -1.26 -4.85 114.28 103.69 1tl4 n THR 61 Ca 0.12 -1.79 -0.42 0.00 -2.04 0.00 0.00 64.05 59.92 1tl4 n THR 61 Cb 0.42 -2.29 -0.04 0.00 -1.82 0.00 0.00 70.33 66.61 1tl4 n THR 61 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1tl4 s VAL 62 N 3.48 4.27 -0.01 12.58 0.11 -1.26 -3.62 120.40 135.94 1tl4 s VAL 62 Ca 0.49 1.76 0.01 0.00 -2.93 0.00 0.00 61.98 61.31 1tl4 s VAL 62 Cb 0.13 -4.13 0.00 0.00 -1.53 0.00 0.00 36.38 30.85 1tl4 s VAL 62 CO -0.01 0.21 -0.03 -0.55 -3.33 0.00 0.00 175.10 171.39 1tl4 s SER 63 N 0.50 0.39 -0.11 3.54 0.15 0.74 -4.98 113.70 113.94 1tl4 s SER 63 Ca 0.52 -0.05 -0.23 0.00 0.70 0.00 0.00 55.95 56.88 1tl4 s SER 63 Cb -0.26 -0.08 -0.03 0.00 -1.71 0.00 0.00 66.02 63.94 1tl4 s SER 63 CO 0.31 0.02 0.71 -0.47 1.20 0.00 0.00 173.24 175.00 1tl4 s TYR 64 N 0.11 3.51 0.53 3.44 5.04 -1.26 -0.81 117.35 127.91 1tl4 s TYR 64 Ca -0.01 1.19 0.01 0.00 -2.44 0.00 0.00 57.07 55.82 1tl4 s TYR 64 Cb -0.03 -2.84 0.00 0.00 0.35 0.00 0.00 41.96 39.44 1tl4 s TYR 64 CO -0.00 -0.02 0.06 -0.51 -1.34 0.00 0.00 175.55 173.74 1tl4 s LEU 65 N 1.23 2.27 0.00 6.97 1.02 0.45 -4.92 118.68 125.70 1tl4 s LEU 65 Ca 0.36 -1.64 0.00 0.00 0.02 0.00 0.00 54.13 52.87 1tl4 s LEU 65 Cb -0.17 -0.77 0.00 0.00 0.02 0.00 0.00 46.19 45.27 1tl4 s LEU 65 CO 0.16 -0.94 0.00 0.61 0.02 0.00 0.00 176.35 176.20 1tl4 n GLY 66 N -1.37 0.00 3.73 -3.19 0.00 -1.26 -3.71 105.19 99.39 1tl4 n GLY 66 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1tl4 n GLY 66 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1tl4 s LEU 67 N 0.00 4.41 0.00 0.99 1.98 -1.26 -1.16 118.68 123.64 1tl4 s LEU 67 Ca 0.00 1.52 0.00 0.00 -2.89 0.00 0.00 54.13 52.76 1tl4 s LEU 67 Cb 0.00 -3.35 0.00 0.00 0.66 0.00 0.00 46.19 43.50 1tl4 s LEU 67 CO 0.00 -0.09 0.00 1.21 -1.89 0.00 0.00 176.35 175.58