#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 1.54 -0.09 3.17 0.04 -1.26 -4.80 135.00 133.59 1tl5 s PRO 2 Ca 0.00 1.41 -0.04 0.00 0.04 0.00 0.00 61.00 62.41 1tl5 s PRO 2 Cb 0.00 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.71 1tl5 s PRO 2 CO 0.00 -2.22 0.08 0.21 0.04 0.00 0.00 177.00 175.11 1tl5 s LYS 3 N -4.71 3.23 -0.11 4.56 2.20 0.15 -4.03 119.74 121.02 1tl5 s LYS 3 Ca 0.65 -0.27 0.02 0.00 -0.36 0.00 0.00 55.97 56.01 1tl5 s LYS 3 Cb -0.21 -3.01 0.01 0.00 -1.51 0.00 0.00 37.83 33.11 1tl5 s LYS 3 CO 0.57 0.74 -0.19 -1.01 -0.36 0.00 0.00 175.35 175.10 1tl5 s HIS 4 N -0.99 2.25 -0.03 4.03 3.76 0.56 -0.63 115.29 124.24 1tl5 s HIS 4 Ca 0.15 -1.05 -0.02 0.00 -0.15 0.00 0.00 55.06 53.99 1tl5 s HIS 4 Cb -0.12 -1.57 -0.04 0.00 1.11 0.00 0.00 32.58 31.97 1tl5 s HIS 4 CO 0.04 -0.50 0.10 -1.21 -0.85 0.00 0.00 174.74 172.32 1tl5 s GLU 5 N 0.80 3.17 -0.05 1.40 0.41 -0.15 -0.65 118.70 123.64 1tl5 s GLU 5 Ca -0.09 -0.40 -0.03 0.00 -0.41 0.00 0.00 54.97 54.04 1tl5 s GLU 5 Cb -0.16 -2.94 0.02 0.00 -1.78 0.00 0.00 34.13 29.28 1tl5 s GLU 5 CO 0.00 0.68 0.12 -0.06 -0.49 0.00 0.00 175.26 175.51 1tl5 s PHE 6 N -1.15 -0.13 0.13 1.61 0.40 0.46 -0.25 117.98 119.05 1tl5 s PHE 6 Ca 0.21 0.36 -0.16 0.00 -0.60 0.00 0.00 56.93 56.75 1tl5 s PHE 6 Cb -0.12 -0.02 -0.07 0.00 0.51 0.00 0.00 43.02 43.32 1tl5 s PHE 6 CO 0.12 -0.10 0.56 0.45 0.70 0.00 0.00 175.22 176.95 1tl5 s SER 7 N 0.55 6.89 0.09 1.36 0.15 -0.22 -0.82 113.70 121.69 1tl5 s SER 7 Ca -0.04 1.14 0.06 0.00 0.70 0.00 0.00 55.95 57.81 1tl5 s SER 7 Cb -0.06 -2.31 -0.03 0.00 -1.71 0.00 0.00 66.02 61.91 1tl5 s SER 7 CO -0.02 0.14 -0.17 -0.69 1.20 0.00 0.00 173.24 173.69 1tl5 s VAL 8 N -1.39 1.38 -0.02 4.45 1.01 -0.11 -0.82 120.40 124.90 1tl5 s VAL 8 Ca 0.36 -1.45 -0.09 0.00 0.00 0.00 0.00 61.98 60.80 1tl5 s VAL 8 Cb -0.16 -1.32 -0.05 0.00 0.00 0.00 0.00 36.38 34.85 1tl5 s VAL 8 CO 0.19 -0.18 0.28 -0.62 0.00 0.00 0.00 175.10 174.77 1tl5 s ASP 9 N -1.89 6.55 -0.44 3.32 2.15 -1.21 -4.75 116.67 120.39 1tl5 s ASP 9 Ca 0.03 0.65 0.03 0.00 0.43 0.00 0.00 52.55 53.69 1tl5 s ASP 9 Cb -0.09 -2.13 0.16 0.00 -0.30 0.00 0.00 42.92 40.56 1tl5 s ASP 9 CO 0.03 0.30 0.34 -0.04 -0.17 0.00 0.00 175.17 175.63 1tl5 s MET 10 N -1.43 1.07 0.44 4.34 -1.94 -1.26 -4.77 119.30 115.75 1tl5 s MET 10 Ca 0.24 -2.16 0.25 0.00 -1.71 0.00 0.00 55.69 52.31 1tl5 s MET 10 Cb -0.14 -1.70 0.60 0.00 2.01 0.00 0.00 34.83 35.60 1tl5 s MET 10 CO 0.12 -1.34 1.70 1.79 -0.01 0.00 0.00 175.02 177.29 1tl5 h THR 11 N 4.68 0.00 -2.74 2.05 1.35 -1.99 -3.45 112.91 112.81 1tl5 h THR 11 Ca 0.21 -0.84 -0.07 0.00 -0.55 0.00 0.00 66.41 65.16 1tl5 h THR 11 Cb 0.90 1.83 -0.17 0.00 -1.73 0.00 0.00 68.15 68.97 1tl5 h THR 11 CO 0.41 0.00 -0.02 0.00 -0.25 0.00 0.00 175.52 175.66 1tl5 h GLY 13 N 3.03 1.85 1.81 0.00 0.00 -2.02 0.11 103.07 107.84 1tl5 h GLY 13 Ca -0.30 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1tl5 h GLY 13 CO 0.41 -0.40 0.05 0.61 0.00 0.00 0.00 176.54 177.22 1tl5 n GLY 14 N -1.32 -0.54 0.36 4.60 0.00 -1.26 -0.69 105.19 106.34 1tl5 n GLY 14 Ca 0.28 0.05 0.18 0.00 0.00 0.00 0.00 46.02 46.53 1tl5 n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tl5 h ALA 16 N 1.68 0.32 -0.57 0.00 0.00 -1.13 0.72 119.26 120.29 1tl5 h ALA 16 Ca 0.62 -0.21 0.08 0.00 0.00 0.00 0.00 54.91 55.39 1tl5 h ALA 16 Cb 1.24 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.88 1tl5 h ALA 16 CO -0.41 0.05 0.21 0.93 0.00 0.00 0.00 179.25 180.04 1tl5 h GLU 17 N 0.20 0.39 0.26 0.00 4.39 -1.47 0.13 114.58 118.47 1tl5 h GLU 17 Ca 0.07 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 1tl5 h GLU 17 Cb 0.40 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1tl5 h GLU 17 CO 0.01 0.26 -0.12 0.00 -1.16 0.00 0.00 179.01 178.00 1tl5 h ALA 18 N 1.38 -0.34 -0.27 3.43 0.00 -0.55 -1.17 119.26 121.74 1tl5 h ALA 18 Ca 0.28 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1tl5 h ALA 18 Cb 0.31 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1tl5 h ALA 18 CO -0.27 -0.56 0.10 0.28 0.00 0.00 0.00 179.25 178.80 1tl5 h VAL 19 N -0.62 0.94 -0.20 0.00 2.07 -0.77 0.42 116.25 118.09 1tl5 h VAL 19 Ca -0.04 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.46 1tl5 h VAL 19 Cb 0.44 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 30.84 1tl5 h VAL 19 CO 0.06 0.04 -0.23 -1.28 0.02 0.00 0.00 177.57 176.18 1tl5 h SER 20 N 0.23 -0.71 -0.19 0.57 0.87 -0.71 0.13 113.55 113.74 1tl5 h SER 20 Ca 0.12 0.13 0.03 0.00 -1.23 0.00 0.00 61.79 60.83 1tl5 h SER 20 Cb 0.08 0.33 -0.03 0.00 -0.44 0.00 0.00 62.40 62.34 1tl5 h SER 20 CO -0.11 -0.27 0.01 0.03 -0.53 0.00 0.00 176.83 175.96 1tl5 h ARG 21 N -0.25 0.07 -0.61 2.24 3.08 -0.69 0.10 114.38 118.32 1tl5 h ARG 21 Ca 0.12 -0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.19 1tl5 h ARG 21 Cb 0.44 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.43 1tl5 h ARG 21 CO -0.35 0.05 0.38 -0.24 -1.07 0.00 0.00 179.97 178.74 1tl5 h VAL 22 N 0.07 1.10 0.24 2.04 3.04 -0.44 0.18 116.25 122.49 1tl5 h VAL 22 Ca 0.09 -0.26 -0.01 0.00 -1.01 0.00 0.00 66.70 65.50 1tl5 h VAL 22 Cb 0.10 0.27 0.00 0.00 -2.01 0.00 0.00 31.29 29.65 1tl5 h VAL 22 CO -0.14 0.14 -0.12 -0.07 -1.01 0.00 0.00 177.57 176.38 1tl5 h LEU 23 N 0.77 -0.27 -0.69 3.16 -0.00 -0.70 -2.65 115.31 114.92 1tl5 h LEU 23 Ca 0.24 -0.13 0.15 0.00 -0.00 0.00 0.00 57.88 58.14 1tl5 h LEU 23 Cb -0.02 0.07 -0.12 0.00 -0.00 0.00 0.00 40.66 40.60 1tl5 h LEU 23 CO -0.08 -0.02 0.02 -1.13 -0.00 0.00 0.00 178.44 177.22 1tl5 h ASN 24 N -0.53 -0.29 -0.89 -0.43 -1.24 -0.56 0.36 115.58 112.02 1tl5 h ASN 24 Ca -0.03 0.17 0.13 0.00 0.71 0.00 0.00 56.30 57.28 1tl5 h ASN 24 Cb 0.39 0.30 -0.07 0.00 0.73 0.00 0.00 38.32 39.67 1tl5 h ASN 24 CO 0.05 -0.14 0.57 0.11 -1.29 0.00 0.00 177.43 176.74 1tl5 h LYS 25 N 0.12 0.70 -0.55 6.67 1.79 -0.50 -1.42 116.57 123.39 1tl5 h LYS 25 Ca 0.37 -0.04 0.04 0.00 -2.18 0.00 0.00 60.65 58.85 1tl5 h LYS 25 Cb 0.63 -0.16 -0.05 0.00 -1.58 0.00 0.00 32.23 31.08 1tl5 h LYS 25 CO -0.59 0.46 0.29 1.25 -1.08 0.00 0.00 179.45 179.78 1tl5 h LEU 26 N 0.72 0.43 0.00 2.94 7.12 -0.56 -3.49 115.31 122.48 1tl5 h LEU 26 Ca 0.44 0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.47 1tl5 h LEU 26 Cb 0.66 -0.06 0.00 0.00 -0.53 0.00 0.00 40.66 40.73 1tl5 h LEU 26 CO -0.20 0.30 0.00 0.61 -0.13 0.00 0.00 178.44 179.02 1tl5 n GLY 27 N -1.26 -1.20 2.52 3.75 0.00 -0.53 -5.01 105.19 103.46 1tl5 n GLY 27 Ca 0.05 0.43 -0.20 0.00 0.00 0.00 0.00 46.02 46.31 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 4.00 3.40 -0.02 0.00 -1.26 -4.85 105.19 106.45 1tl5 n GLY 28 Ca 0.00 -2.03 -0.36 0.00 0.00 0.00 0.00 46.02 43.63 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 4.02 -0.68 1.61 0.11 -1.26 -4.79 120.40 115.90 1tl5 s VAL 29 Ca 0.41 -0.31 -0.25 0.00 -2.93 0.00 0.00 61.98 58.89 1tl5 s VAL 29 Cb 0.36 -2.89 0.04 0.00 -1.53 0.00 0.00 36.38 32.37 1tl5 s VAL 29 CO -0.08 0.33 1.14 -0.75 -3.33 0.00 0.00 175.10 172.41 1tl5 s LYS 30 N 1.57 3.21 0.16 1.54 2.36 -1.26 -4.83 119.74 122.49 1tl5 s LYS 30 Ca 0.06 -0.37 0.04 0.00 -2.55 0.00 0.00 55.97 53.15 1tl5 s LYS 30 Cb -0.15 -4.16 -0.04 0.00 -1.05 0.00 0.00 37.83 32.43 1tl5 s LYS 30 CO 0.02 -1.93 0.20 1.52 1.55 0.00 0.00 175.35 176.71 1tl5 s TYR 31 N 4.96 3.29 0.01 4.03 1.13 -1.26 -1.08 117.35 128.42 1tl5 s TYR 31 Ca 0.31 0.03 0.00 0.00 -1.41 0.00 0.00 57.07 56.01 1tl5 s TYR 31 Cb -0.11 -1.57 -0.01 0.00 -1.10 0.00 0.00 41.96 39.16 1tl5 s TYR 31 CO 0.15 0.52 -0.02 -0.51 -2.51 0.00 0.00 175.55 173.17 1tl5 s ASP 32 N -3.20 0.18 -0.13 -0.18 1.01 0.50 -4.98 116.67 109.87 1tl5 s ASP 32 Ca 0.32 -0.35 0.01 0.00 0.71 0.00 0.00 52.55 53.25 1tl5 s ASP 32 Cb -0.10 0.07 0.02 0.00 1.01 0.00 0.00 42.92 43.91 1tl5 s ASP 32 CO 0.26 -0.21 -0.16 -0.63 0.21 0.00 0.00 175.17 174.63 1tl5 s ILE 33 N -1.02 1.64 -0.30 0.77 1.09 -1.26 -1.00 121.20 121.12 1tl5 s ILE 33 Ca -0.11 -0.72 -0.11 0.00 -1.10 0.00 0.00 60.65 58.61 1tl5 s ILE 33 Cb -0.07 -1.50 -0.03 0.00 -1.06 0.00 0.00 42.46 39.80 1tl5 s ILE 33 CO -0.01 0.47 0.19 -0.62 -0.10 0.00 0.00 174.94 174.87 1tl5 s ASP 34 N 1.09 5.86 -0.08 3.58 -1.08 0.44 -5.01 116.67 121.47 1tl5 s ASP 34 Ca -0.03 -0.24 -0.12 0.00 -0.52 0.00 0.00 52.55 51.64 1tl5 s ASP 34 Cb -0.14 -2.09 -0.09 0.00 -1.46 0.00 0.00 42.92 39.14 1tl5 s ASP 34 CO -0.04 -0.13 0.43 0.25 0.52 0.00 0.00 175.17 176.19 1tl5 h LEU 35 N 8.39 -0.15 -1.63 -1.34 7.12 -1.97 -0.51 115.31 125.22 1tl5 h LEU 35 Ca -0.34 -0.20 0.04 0.00 0.13 0.00 0.00 57.88 57.51 1tl5 h LEU 35 Cb 1.17 0.04 -0.03 0.00 -0.53 0.00 0.00 40.66 41.31 1tl5 h LEU 35 CO 0.59 0.41 0.31 1.55 -0.13 0.00 0.00 178.44 181.17 1tl5 h PRO 36 N -1.01 0.46 -0.00 5.25 0.13 -1.96 -0.33 132.00 134.54 1tl5 h PRO 36 Ca -0.02 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1tl5 h PRO 36 Cb 0.34 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.36 1tl5 h PRO 36 CO 0.03 0.31 -0.28 0.09 -0.23 0.00 0.00 178.00 177.91 1tl5 n ASN 37 N -4.48 0.46 -3.62 1.44 3.02 -1.26 -4.96 115.26 105.86 1tl5 n ASN 37 Ca 0.05 -0.24 -0.22 0.00 -0.03 0.00 0.00 54.58 54.14 1tl5 n ASN 37 Cb 0.17 0.01 0.04 0.00 -0.61 0.00 0.00 39.78 39.39 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 -1.27 -4.05 -4.36 3.52 4.01 -0.14 -4.90 118.16 110.97 1tl5 n LYS 38 Ca 0.09 0.64 -0.22 0.00 -0.51 0.00 0.00 58.31 58.30 1tl5 n LYS 38 Cb 0.33 -5.13 -0.13 0.00 -0.51 0.00 0.00 35.03 29.59 1tl5 n LYS 38 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 1tl5 s LYS 39 N -5.74 1.09 0.01 1.97 2.47 -0.23 -0.93 119.74 118.37 1tl5 s LYS 39 Ca 0.14 -0.98 0.08 0.00 -1.56 0.00 0.00 55.97 53.65 1tl5 s LYS 39 Cb -0.04 -1.21 -0.02 0.00 -1.46 0.00 0.00 37.83 35.10 1tl5 s LYS 39 CO 0.81 0.29 -0.25 0.08 0.16 0.00 0.00 175.35 176.44 1tl5 s VAL 40 N -1.03 2.01 0.02 4.02 1.01 -0.00 -0.42 120.40 126.01 1tl5 s VAL 40 Ca 0.04 -1.19 0.07 0.00 0.00 0.00 0.00 61.98 60.90 1tl5 s VAL 40 Cb -0.09 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 1tl5 s VAL 40 CO 0.03 0.47 -0.20 0.00 0.00 0.00 0.00 175.10 175.39 1tl5 s ILE 42 N -0.70 0.14 -0.46 0.00 1.01 0.18 -0.37 121.20 121.00 1tl5 s ILE 42 Ca 0.07 0.15 0.03 0.00 0.00 0.00 0.00 60.65 60.90 1tl5 s ILE 42 Cb -0.08 -0.27 0.14 0.00 0.01 0.00 0.00 42.46 42.25 1tl5 s ILE 42 CO 0.01 0.16 0.26 -0.70 0.00 0.00 0.00 174.94 174.67 1tl5 s GLU 43 N 1.31 1.40 0.16 2.79 2.12 -0.25 -0.32 118.70 125.90 1tl5 s GLU 43 Ca -0.06 -2.14 -0.18 0.00 0.36 0.00 0.00 54.97 52.94 1tl5 s GLU 43 Cb -0.13 -2.44 0.04 0.00 0.26 0.00 0.00 34.13 31.87 1tl5 s GLU 43 CO -0.02 -1.18 0.49 0.45 -0.54 0.00 0.00 175.26 174.46 1tl5 s SER 44 N 0.17 -0.34 0.00 -1.70 0.15 -1.26 -4.31 113.70 106.42 1tl5 s SER 44 Ca 0.19 -0.28 0.28 0.00 0.70 0.00 0.00 55.95 56.84 1tl5 s SER 44 Cb -0.22 0.54 1.35 0.00 -1.71 0.00 0.00 66.02 65.98 1tl5 s SER 44 CO -0.02 -0.95 1.93 -1.84 1.20 0.00 0.00 173.24 173.57 1tl5 n GLU 45 N -0.30 0.31 -1.95 5.44 0.28 -1.26 -4.80 120.64 118.36 1tl5 n GLU 45 Ca -0.14 0.03 -0.41 0.00 -0.16 0.00 0.00 57.16 56.47 1tl5 n GLU 45 Cb 0.64 -1.50 -0.02 0.00 1.43 0.00 0.00 31.44 31.99 1tl5 n GLU 45 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 1tl5 s HIS 46 N -2.66 2.95 0.49 -1.84 3.76 -1.26 -4.93 115.29 111.79 1tl5 s HIS 46 Ca 0.23 0.95 -0.24 0.00 -0.15 0.00 0.00 55.06 55.85 1tl5 s HIS 46 Cb 0.18 -3.89 -0.07 0.00 1.11 0.00 0.00 32.58 29.91 1tl5 s HIS 46 CO 0.44 -2.94 1.41 0.45 -0.85 0.00 0.00 174.74 173.25 1tl5 s SER 47 N 0.42 5.63 0.17 1.40 0.15 -1.26 -4.80 113.70 115.41 1tl5 s SER 47 Ca 0.61 2.89 -0.19 0.00 0.70 0.00 0.00 55.95 59.96 1tl5 s SER 47 Cb -0.43 -2.65 0.11 0.00 -1.71 0.00 0.00 66.02 61.34 1tl5 s SER 47 CO 0.44 -1.34 1.63 0.24 1.20 0.00 0.00 173.24 175.41 1tl5 h MET 48 N 2.00 -0.11 -0.39 5.44 2.86 -1.94 -0.58 114.93 122.21 1tl5 h MET 48 Ca -0.51 0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.17 1tl5 h MET 48 Cb 1.28 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.91 1tl5 h MET 48 CO 0.60 -0.07 -0.28 0.22 1.06 0.00 0.00 176.91 178.44 1tl5 h ASP 49 N -0.11 -0.99 -0.68 1.22 3.58 -1.99 0.53 116.42 117.97 1tl5 h ASP 49 Ca 0.21 0.14 -0.01 0.00 0.42 0.00 0.00 57.03 57.80 1tl5 h ASP 49 Cb 0.43 0.43 -0.03 0.00 1.72 0.00 0.00 39.33 41.88 1tl5 h ASP 49 CO -0.50 -0.14 0.40 0.74 -2.88 0.00 0.00 179.24 176.86 1tl5 h THR 50 N -0.06 1.20 0.44 2.25 2.02 -1.64 0.13 112.91 117.25 1tl5 h THR 50 Ca 0.06 -0.46 -0.02 0.00 0.77 0.00 0.00 66.41 66.76 1tl5 h THR 50 Cb 0.23 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 66.91 1tl5 h THR 50 CO -0.40 0.21 -0.23 -0.07 0.37 0.00 0.00 175.52 175.41 1tl5 h LEU 51 N 0.93 -0.55 -0.78 2.58 3.38 -0.99 -2.56 115.31 117.32 1tl5 h LEU 51 Ca 0.24 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.31 1tl5 h LEU 51 Cb -0.01 0.15 -0.11 0.00 0.09 0.00 0.00 40.66 40.78 1tl5 h LEU 51 CO -0.04 -0.37 -0.57 -0.07 0.09 0.00 0.00 178.44 177.47 1tl5 h LEU 52 N -0.61 -2.04 -1.08 1.67 3.38 -0.14 0.13 115.31 116.62 1tl5 h LEU 52 Ca -0.06 0.30 0.12 0.00 0.09 0.00 0.00 57.88 58.33 1tl5 h LEU 52 Cb 0.48 0.88 -0.08 0.00 0.09 0.00 0.00 40.66 42.03 1tl5 h LEU 52 CO 0.09 -0.30 0.62 0.00 0.09 0.00 0.00 178.44 178.94 1tl5 h ALA 53 N 0.32 1.59 0.64 1.53 0.00 -0.87 0.67 119.26 123.15 1tl5 h ALA 53 Ca 0.13 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1tl5 h ALA 53 Cb 0.48 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.09 1tl5 h ALA 53 CO -0.81 0.16 -0.31 1.15 0.00 0.00 0.00 179.25 179.44 1tl5 h THR 54 N 0.93 0.00 0.00 0.00 2.02 -0.44 -3.32 112.91 112.10 1tl5 h THR 54 Ca 0.48 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 67.38 1tl5 h THR 54 Cb 0.54 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.95 1tl5 h THR 54 CO -0.25 0.00 -0.04 0.17 0.37 0.00 0.00 175.52 175.77 1tl5 h LEU 55 N -1.13 0.00 -0.99 2.58 8.10 -0.30 -0.61 115.31 122.96 1tl5 h LEU 55 Ca -0.09 0.00 0.36 0.00 0.11 0.00 0.00 57.88 58.26 1tl5 h LEU 55 Cb 0.66 0.00 -0.17 0.00 -0.44 0.00 0.00 40.66 40.71 1tl5 h LEU 55 CO 0.14 0.04 0.45 0.50 -4.11 0.00 0.00 178.44 175.46 1tl5 h LYS 56 N 0.00 0.10 0.00 0.17 3.64 -0.98 -0.85 116.57 118.65 1tl5 h LYS 56 Ca -0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1tl5 h LYS 56 Cb 0.08 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1tl5 h LYS 56 CO 0.01 0.07 0.00 1.63 -2.27 0.00 0.00 179.45 178.88 1tl5 n LYS 57 N -5.24 0.16 0.25 1.90 5.02 -0.24 -0.68 118.16 119.33 1tl5 n LYS 57 Ca 0.33 0.57 0.10 0.00 -2.02 0.00 0.00 58.31 57.29 1tl5 n LYS 57 Cb 1.08 -1.93 0.65 0.00 -0.02 0.00 0.00 35.03 34.81 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 0.74 -1.06 -0.18 1.35 -1.36 -3.46 112.91 108.94 1tl5 h THR 58 Ca 0.00 -0.61 -0.24 0.00 -0.55 0.00 0.00 66.41 65.02 1tl5 h THR 58 Cb 0.11 1.37 -0.06 0.00 -1.73 0.00 0.00 68.15 67.84 1tl5 h THR 58 CO 0.00 0.15 -0.25 0.61 -0.25 0.00 0.00 175.52 175.77 1tl5 n GLY 59 N -0.75 0.64 3.93 5.82 0.00 0.14 -5.04 105.19 109.94 1tl5 n GLY 59 Ca -0.02 -0.45 -0.25 0.00 0.00 0.00 0.00 46.02 45.30 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 -3.72 3.51 -0.24 1.61 -0.14 -1.26 -4.98 119.74 114.52 1tl5 s LYS 60 Ca 0.00 -0.13 -0.05 0.00 -1.36 0.00 0.00 55.97 54.44 1tl5 s LYS 60 Cb 0.00 -2.55 -0.15 0.00 -1.68 0.00 0.00 37.83 33.44 1tl5 s LYS 60 CO 0.00 0.02 2.52 2.41 -0.76 0.00 0.00 175.35 179.53 1tl5 n THR 61 N -1.95 2.19 -2.76 2.17 -1.04 -1.26 -4.79 114.28 106.84 1tl5 n THR 61 Ca -0.03 -1.16 -0.43 0.00 -2.04 0.00 0.00 64.05 60.40 1tl5 n THR 61 Cb 0.56 -1.92 -0.02 0.00 -1.82 0.00 0.00 70.33 67.12 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 2.00 4.38 0.11 12.58 0.11 -1.26 -3.36 120.40 134.97 1tl5 s VAL 62 Ca 0.45 -1.34 0.02 0.00 -2.93 0.00 0.00 61.98 58.17 1tl5 s VAL 62 Cb 0.19 -4.93 -0.04 0.00 -1.53 0.00 0.00 36.38 30.07 1tl5 s VAL 62 CO -0.01 -1.73 0.21 -0.44 -3.33 0.00 0.00 175.10 169.80 1tl5 s SER 63 N 4.16 6.14 -0.12 3.54 0.01 0.00 -4.87 113.70 122.56 1tl5 s SER 63 Ca 0.40 0.15 -0.18 0.00 1.31 0.00 0.00 55.95 57.63 1tl5 s SER 63 Cb -0.02 -1.81 -0.04 0.00 0.21 0.00 0.00 66.02 64.35 1tl5 s SER 63 CO -0.08 0.11 0.48 -0.47 0.41 0.00 0.00 173.24 173.69 1tl5 s TYR 64 N -1.61 3.51 -0.44 2.43 6.14 -1.26 -1.06 117.35 125.07 1tl5 s TYR 64 Ca 0.34 0.89 0.06 0.00 0.64 0.00 0.00 57.07 58.99 1tl5 s TYR 64 Cb -0.12 -2.55 0.18 0.00 0.42 0.00 0.00 41.96 39.89 1tl5 s TYR 64 CO 0.27 0.17 0.56 -0.48 0.64 0.00 0.00 175.55 176.71 1tl5 s LEU 65 N 0.62 -0.73 0.00 6.97 -0.00 0.65 -4.90 118.68 121.29 1tl5 s LEU 65 Ca 0.26 -1.62 0.00 0.00 -0.00 0.00 0.00 54.13 52.77 1tl5 s LEU 65 Cb -0.15 1.26 0.00 0.00 -0.00 0.00 0.00 46.19 47.30 1tl5 s LEU 65 CO 0.10 -0.15 0.00 0.61 -0.00 0.00 0.00 176.35 176.91 1tl5 n GLY 66 N 3.66 4.77 2.88 -3.48 0.00 -1.22 -4.49 105.19 107.32 1tl5 n GLY 66 Ca 0.16 -1.13 -0.18 0.00 0.00 0.00 0.00 46.02 44.88 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 1.44 0.00 0.99 2.96 -1.26 -0.98 118.68 121.83 1tl5 s LEU 67 Ca 0.00 -0.08 0.00 0.00 -0.22 0.00 0.00 54.13 53.83 1tl5 s LEU 67 Cb 0.00 -0.32 0.00 0.00 0.50 0.00 0.00 46.19 46.37 1tl5 s LEU 67 CO 0.00 -0.04 0.22 1.21 -1.32 0.00 0.00 176.35 176.42