#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tl4 s PRO 2 N 0.00 -0.00 0.26 2.12 0.04 -1.26 -5.07 135.00 131.08 1tl4 s PRO 2 Ca 0.00 0.84 -0.17 0.00 0.04 0.00 0.00 61.00 61.71 1tl4 s PRO 2 Cb 0.00 -1.66 0.01 0.00 0.04 0.00 0.00 34.50 32.89 1tl4 s PRO 2 CO 0.00 -3.11 0.60 -1.59 0.04 0.00 0.00 177.00 172.94 1tl4 s LYS 3 N -4.69 1.65 -0.07 4.56 -2.85 0.12 -4.48 119.74 113.98 1tl4 s LYS 3 Ca 0.67 -1.09 -0.02 0.00 -1.00 0.00 0.00 55.97 54.53 1tl4 s LYS 3 Cb -0.22 0.54 0.03 0.00 -2.06 0.00 0.00 37.83 36.12 1tl4 s LYS 3 CO 0.61 -0.72 0.02 -1.01 0.10 0.00 0.00 175.35 174.35 1tl4 s HIS 4 N -3.96 0.49 0.20 1.78 3.76 0.57 -1.27 115.29 116.87 1tl4 s HIS 4 Ca 0.16 -0.08 -0.30 0.00 -0.15 0.00 0.00 55.06 54.69 1tl4 s HIS 4 Cb -0.03 -0.71 -0.08 0.00 1.11 0.00 0.00 32.58 32.86 1tl4 s HIS 4 CO 0.07 -0.31 1.07 -2.00 -0.85 0.00 0.00 174.74 172.72 1tl4 s GLU 5 N 2.03 4.64 -0.13 1.40 2.12 -1.26 -0.87 118.70 126.64 1tl4 s GLU 5 Ca 0.05 1.69 -0.00 0.00 0.36 0.00 0.00 54.97 57.06 1tl4 s GLU 5 Cb -0.12 -3.27 -0.02 0.00 0.26 0.00 0.00 34.13 30.98 1tl4 s GLU 5 CO -0.05 0.17 -0.12 -0.06 -0.54 0.00 0.00 175.26 174.66 1tl4 s PHE 6 N -0.53 2.82 0.00 5.30 0.40 0.31 -0.56 117.98 125.73 1tl4 s PHE 6 Ca 0.47 -0.59 -0.16 0.00 -0.60 0.00 0.00 56.93 56.05 1tl4 s PHE 6 Cb -0.29 -1.84 -0.06 0.00 0.51 0.00 0.00 43.02 41.34 1tl4 s PHE 6 CO 0.35 -0.17 0.45 0.45 0.70 0.00 0.00 175.22 177.00 1tl4 s SER 7 N 0.28 6.86 0.31 1.36 0.15 0.25 -0.51 113.70 122.39 1tl4 s SER 7 Ca -0.09 1.02 0.04 0.00 0.70 0.00 0.00 55.95 57.62 1tl4 s SER 7 Cb -0.15 -2.28 -0.03 0.00 -1.71 0.00 0.00 66.02 61.84 1tl4 s SER 7 CO 0.05 0.28 0.20 -0.69 1.20 0.00 0.00 173.24 174.29 1tl4 s VAL 8 N -0.91 0.14 -0.41 4.45 1.01 0.12 -0.44 120.40 124.37 1tl4 s VAL 8 Ca 0.25 -2.00 -0.13 0.00 0.00 0.00 0.00 61.98 60.10 1tl4 s VAL 8 Cb -0.17 -2.49 0.03 0.00 0.00 0.00 0.00 36.38 33.75 1tl4 s VAL 8 CO 0.14 0.00 0.28 -0.62 0.00 0.00 0.00 175.10 174.90 1tl4 s ASP 9 N -3.35 5.95 -0.45 3.32 2.15 -1.25 -4.69 116.67 118.35 1tl4 s ASP 9 Ca 0.38 -1.03 0.08 0.00 0.43 0.00 0.00 52.55 52.41 1tl4 s ASP 9 Cb 0.04 -2.10 0.40 0.00 -0.30 0.00 0.00 42.92 40.95 1tl4 s ASP 9 CO 0.21 -0.46 0.99 0.23 -0.17 0.00 0.00 175.17 175.96 1tl4 n MET 10 N 5.09 2.61 0.00 4.34 2.81 -1.26 -4.91 117.12 125.81 1tl4 n MET 10 Ca -0.11 -4.22 0.12 0.00 -1.81 0.00 0.00 57.70 51.68 1tl4 n MET 10 Cb 0.46 -1.98 0.61 0.00 -0.71 0.00 0.00 33.22 31.60 1tl4 n MET 10 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1tl4 n THR 11 N -0.24 0.21 -3.89 2.03 -1.04 -1.26 -4.63 114.28 105.47 1tl4 n THR 11 Ca 0.29 0.05 -0.11 0.00 -2.04 0.00 0.00 64.05 62.25 1tl4 n THR 11 Cb 0.62 -0.67 -0.10 0.00 -1.82 0.00 0.00 70.33 68.35 1tl4 n THR 11 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1tl4 n GLY 13 N 1.61 -1.66 0.36 0.00 0.00 -1.26 -1.22 105.19 103.03 1tl4 n GLY 13 Ca -0.22 0.88 0.18 0.00 0.00 0.00 0.00 46.02 46.85 1tl4 n GLY 13 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1tl4 h GLY 14 N 0.00 0.00 1.09 -0.02 0.00 -1.98 0.19 103.07 102.35 1tl4 h GLY 14 Ca 0.25 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.51 1tl4 h GLY 14 CO -0.77 0.00 0.17 0.00 0.00 0.00 0.00 176.54 175.94 1tl4 h ALA 16 N 1.11 0.79 -0.23 0.00 0.00 -0.76 0.93 119.26 121.09 1tl4 h ALA 16 Ca 0.22 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.06 1tl4 h ALA 16 Cb 0.37 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1tl4 h ALA 16 CO 0.00 0.30 0.06 0.93 0.00 0.00 0.00 179.25 180.55 1tl4 h GLU 17 N 0.83 0.16 -0.05 0.00 4.39 -1.03 0.19 114.58 119.08 1tl4 h GLU 17 Ca 0.22 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.93 1tl4 h GLU 17 Cb 0.04 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 1tl4 h GLU 17 CO -0.04 0.11 -0.09 0.00 -1.16 0.00 0.00 179.01 177.83 1tl4 h ALA 18 N 1.16 -0.06 -0.33 3.43 0.00 -0.54 0.35 119.26 123.26 1tl4 h ALA 18 Ca 0.10 0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.09 1tl4 h ALA 18 Cb 0.09 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1tl4 h ALA 18 CO -0.12 -0.57 0.00 0.28 0.00 0.00 0.00 179.25 178.84 1tl4 h VAL 19 N -0.14 0.76 -0.18 0.00 2.07 -0.54 -0.63 116.25 117.60 1tl4 h VAL 19 Ca 0.05 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 67.59 1tl4 h VAL 19 Cb 0.21 0.65 -0.06 0.00 -1.52 0.00 0.00 31.29 30.58 1tl4 h VAL 19 CO -0.13 0.02 -0.21 -1.28 0.02 0.00 0.00 177.57 175.99 1tl4 h SER 20 N 0.10 -0.65 -0.47 0.57 0.87 -0.22 0.11 113.55 113.86 1tl4 h SER 20 Ca 0.16 0.12 0.09 0.00 -1.23 0.00 0.00 61.79 60.93 1tl4 h SER 20 Cb 0.22 0.30 -0.08 0.00 -0.44 0.00 0.00 62.40 62.40 1tl4 h SER 20 CO -0.27 -0.25 -0.03 0.08 -0.53 0.00 0.00 176.83 175.83 1tl4 h ARG 21 N -0.24 0.08 0.01 2.24 0.11 -0.39 0.33 114.38 116.52 1tl4 h ARG 21 Ca 0.11 -0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.19 1tl4 h ARG 21 Cb 0.41 -0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.47 1tl4 h ARG 21 CO -0.32 0.05 -0.01 0.28 0.10 0.00 0.00 179.97 180.08 1tl4 h VAL 22 N 0.08 1.14 -0.68 0.08 2.07 -0.22 -0.70 116.25 118.02 1tl4 h VAL 22 Ca 0.23 -0.45 -0.08 0.00 0.82 0.00 0.00 66.70 67.22 1tl4 h VAL 22 Cb 0.35 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 1tl4 h VAL 22 CO -0.41 0.12 0.10 -0.07 0.02 0.00 0.00 177.57 177.33 1tl4 h LEU 23 N -0.21 1.08 -1.58 2.57 3.38 -0.57 -2.33 115.31 117.65 1tl4 h LEU 23 Ca -0.00 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.71 1tl4 h LEU 23 Cb 0.20 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1tl4 h LEU 23 CO 0.00 1.07 0.29 -1.13 0.09 0.00 0.00 178.44 178.76 1tl4 h ASN 24 N 1.05 0.49 -0.94 -0.43 -0.00 -0.10 0.13 115.58 115.78 1tl4 h ASN 24 Ca 0.20 -0.01 0.17 0.00 -0.00 0.00 0.00 56.30 56.67 1tl4 h ASN 24 Cb 0.45 -0.12 -0.10 0.00 -0.00 0.00 0.00 38.32 38.55 1tl4 h ASN 24 CO 0.01 0.35 0.53 0.50 -0.00 0.00 0.00 177.43 178.83 1tl4 h LYS 25 N 0.58 0.68 0.07 6.67 3.11 -0.55 -0.21 116.57 126.92 1tl4 h LYS 25 Ca 0.16 -0.04 -0.00 0.00 -2.81 0.00 0.00 60.65 57.96 1tl4 h LYS 25 Cb -0.04 -0.15 0.00 0.00 -1.00 0.00 0.00 32.23 31.04 1tl4 h LYS 25 CO -0.04 0.45 -0.03 1.25 -2.81 0.00 0.00 179.45 178.27 1tl4 h LEU 26 N 0.70 -0.08 0.00 5.20 7.12 -0.92 -3.47 115.31 123.86 1tl4 h LEU 26 Ca 0.53 -0.33 0.00 0.00 0.13 0.00 0.00 57.88 58.22 1tl4 h LEU 26 Cb 0.80 0.02 0.00 0.00 -0.53 0.00 0.00 40.66 40.95 1tl4 h LEU 26 CO -0.38 0.29 0.00 0.61 -0.13 0.00 0.00 178.44 178.83 1tl4 n GLY 27 N -0.14 2.35 2.00 3.75 0.00 0.22 -4.81 105.19 108.56 1tl4 n GLY 27 Ca -0.08 -0.45 -0.07 0.00 0.00 0.00 0.00 46.02 45.41 1tl4 n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tl4 n GLY 28 N 0.00 2.38 3.06 -0.02 0.00 -1.26 -4.80 105.19 104.56 1tl4 n GLY 28 Ca 0.00 -0.69 -0.19 0.00 0.00 0.00 0.00 46.02 45.15 1tl4 n GLY 28 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1tl4 s VAL 29 N 1.25 0.83 -0.10 1.61 -7.23 -1.26 -4.27 120.40 111.23 1tl4 s VAL 29 Ca 0.38 -0.63 -0.00 0.00 -1.81 0.00 0.00 61.98 59.92 1tl4 s VAL 29 Cb 0.18 -0.73 -0.02 0.00 0.56 0.00 0.00 36.38 36.36 1tl4 s VAL 29 CO 0.00 0.11 -0.09 -0.75 -0.31 0.00 0.00 175.10 174.05 1tl4 s LYS 30 N -0.59 3.12 -0.21 4.82 2.36 0.02 -5.02 119.74 124.25 1tl4 s LYS 30 Ca 0.02 -0.61 -0.04 0.00 -2.55 0.00 0.00 55.97 52.79 1tl4 s LYS 30 Cb -0.05 -2.64 0.08 0.00 -1.05 0.00 0.00 37.83 34.16 1tl4 s LYS 30 CO 0.00 0.42 0.14 1.52 1.55 0.00 0.00 175.35 178.98 1tl4 s TYR 31 N -0.18 0.10 -0.51 4.03 1.13 -1.26 -0.34 117.35 120.32 1tl4 s TYR 31 Ca 0.01 -0.34 -0.28 0.00 -1.41 0.00 0.00 57.07 55.06 1tl4 s TYR 31 Cb -0.13 -0.67 0.03 0.00 -1.10 0.00 0.00 41.96 40.09 1tl4 s TYR 31 CO 0.03 -0.63 1.10 -0.51 -2.51 0.00 0.00 175.55 173.04 1tl4 s ASP 32 N 2.18 6.54 -0.05 -0.18 1.01 0.29 -4.88 116.67 121.57 1tl4 s ASP 32 Ca 0.05 0.25 -0.20 0.00 0.71 0.00 0.00 52.55 53.36 1tl4 s ASP 32 Cb -0.16 -2.53 -0.05 0.00 1.01 0.00 0.00 42.92 41.20 1tl4 s ASP 32 CO -0.17 -1.28 0.58 -0.63 0.21 0.00 0.00 175.17 173.88 1tl4 s ILE 33 N 4.44 5.03 -0.20 0.77 1.01 -1.26 -0.83 121.20 130.16 1tl4 s ILE 33 Ca 0.44 1.20 0.01 0.00 0.00 0.00 0.00 60.65 62.30 1tl4 s ILE 33 Cb -0.08 -3.92 0.03 0.00 0.01 0.00 0.00 42.46 38.50 1tl4 s ILE 33 CO 0.28 0.35 -0.17 -0.62 0.00 0.00 0.00 174.94 174.78 1tl4 s ASP 34 N 0.29 3.43 -0.04 3.58 -1.08 0.23 -5.01 116.67 118.07 1tl4 s ASP 34 Ca 0.31 -0.83 -0.06 0.00 -0.52 0.00 0.00 52.55 51.45 1tl4 s ASP 34 Cb -0.17 -1.46 -0.03 0.00 -1.46 0.00 0.00 42.92 39.79 1tl4 s ASP 34 CO 0.15 -0.06 0.32 -0.07 0.52 0.00 0.00 175.17 176.03 1tl4 h LEU 35 N 7.91 -0.17 -1.88 -1.34 -0.00 -1.85 -0.18 115.31 117.79 1tl4 h LEU 35 Ca -0.38 0.01 0.09 0.00 -0.00 0.00 0.00 57.88 57.59 1tl4 h LEU 35 Cb 1.11 0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 41.80 1tl4 h LEU 35 CO 0.58 0.12 0.27 1.55 -0.00 0.00 0.00 178.44 180.96 1tl4 h PRO 36 N -0.69 0.13 -0.02 1.13 0.13 -1.96 0.13 132.00 130.86 1tl4 h PRO 36 Ca -0.02 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1tl4 h PRO 36 Cb 0.16 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.26 1tl4 h PRO 36 CO 0.03 0.09 -0.34 0.09 -0.23 0.00 0.00 178.00 177.65 1tl4 n ASN 37 N -4.45 1.87 -3.54 1.44 3.02 -1.26 -5.01 115.26 107.32 1tl4 n ASN 37 Ca 0.06 -1.42 -0.25 0.00 -0.03 0.00 0.00 54.58 52.93 1tl4 n ASN 37 Cb 0.37 0.31 0.04 0.00 -0.61 0.00 0.00 39.78 39.88 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 0.01 -1.44 -4.07 3.52 4.01 0.44 -4.84 118.16 115.79 1tl4 n LYS 38 Ca 0.11 0.65 -0.09 0.00 -0.51 0.00 0.00 58.31 58.48 1tl4 n LYS 38 Cb 0.45 -4.50 -0.10 0.00 -0.51 0.00 0.00 35.03 30.37 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 -5.32 0.54 -0.20 1.97 1.02 -0.14 -0.71 119.74 116.90 1tl4 s LYS 39 Ca 0.40 -0.99 -0.02 0.00 0.02 0.00 0.00 55.97 55.38 1tl4 s LYS 39 Cb -0.12 0.04 0.06 0.00 -0.52 0.00 0.00 37.83 37.29 1tl4 s LYS 39 CO 0.83 -0.05 0.01 0.08 -0.92 0.00 0.00 175.35 175.29 1tl4 s VAL 40 N -2.77 0.84 -0.68 3.17 1.01 0.33 -0.60 120.40 121.70 1tl4 s VAL 40 Ca -0.02 -0.75 -0.25 0.00 0.00 0.00 0.00 61.98 60.96 1tl4 s VAL 40 Cb -0.00 -1.26 0.05 0.00 0.00 0.00 0.00 36.38 35.16 1tl4 s VAL 40 CO -0.05 -0.16 1.10 0.00 0.00 0.00 0.00 175.10 175.99 1tl4 s ILE 42 N 4.78 5.17 -0.29 0.00 1.01 -0.05 -0.55 121.20 131.27 1tl4 s ILE 42 Ca 0.29 0.79 -0.04 0.00 0.00 0.00 0.00 60.65 61.70 1tl4 s ILE 42 Cb -0.12 -3.77 0.03 0.00 0.01 0.00 0.00 42.46 38.61 1tl4 s ILE 42 CO 0.14 0.23 0.02 -0.70 0.00 0.00 0.00 174.94 174.64 1tl4 s GLU 43 N 1.38 2.71 -0.23 2.79 2.12 0.54 -0.31 118.70 127.69 1tl4 s GLU 43 Ca 0.21 -1.09 -0.15 0.00 0.36 0.00 0.00 54.97 54.29 1tl4 s GLU 43 Cb -0.15 -3.23 0.07 0.00 0.26 0.00 0.00 34.13 31.07 1tl4 s GLU 43 CO 0.09 -0.54 0.59 0.45 -0.54 0.00 0.00 175.26 175.30 1tl4 s SER 44 N 1.35 -0.74 -1.11 -1.70 0.15 -1.26 -0.80 113.70 109.60 1tl4 s SER 44 Ca -0.02 1.26 -0.08 0.00 0.70 0.00 0.00 55.95 57.81 1tl4 s SER 44 Cb -0.18 1.17 -0.11 0.00 -1.71 0.00 0.00 66.02 65.18 1tl4 s SER 44 CO -0.00 -0.22 3.09 -0.62 1.20 0.00 0.00 173.24 176.69 1tl4 n GLU 45 N 3.88 3.27 -4.16 5.44 1.02 -1.26 -4.79 120.64 124.05 1tl4 n GLU 45 Ca -0.19 -1.99 -0.10 0.00 -0.02 0.00 0.00 57.16 54.85 1tl4 n GLU 45 Cb 0.57 -2.54 -0.10 0.00 -0.02 0.00 0.00 31.44 29.35 1tl4 n GLU 45 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1tl4 s HIS 46 N 1.39 0.90 0.64 -0.32 3.76 -1.26 -5.11 115.29 115.30 1tl4 s HIS 46 Ca 0.67 -1.22 -0.14 0.00 -0.15 0.00 0.00 55.06 54.23 1tl4 s HIS 46 Cb 0.23 -0.50 -0.01 0.00 1.11 0.00 0.00 32.58 33.40 1tl4 s HIS 46 CO -0.05 -0.49 1.07 0.45 -0.85 0.00 0.00 174.74 174.86 1tl4 s SER 47 N -3.06 5.49 0.48 1.40 0.15 -1.26 -4.91 113.70 111.99 1tl4 s SER 47 Ca 0.24 1.78 0.22 0.00 0.70 0.00 0.00 55.95 58.89 1tl4 s SER 47 Cb 0.07 -2.52 1.25 0.00 -1.71 0.00 0.00 66.02 63.11 1tl4 s SER 47 CO 0.02 -1.37 1.95 0.00 1.20 0.00 0.00 173.24 175.04 1tl4 h MET 48 N -0.07 0.18 0.14 5.44 -0.00 -1.98 -1.08 114.93 117.56 1tl4 h MET 48 Ca -0.46 -0.01 0.01 0.00 -0.00 0.00 0.00 59.70 59.25 1tl4 h MET 48 Cb 1.22 -0.04 -0.03 0.00 -0.00 0.00 0.00 31.60 32.75 1tl4 h MET 48 CO 0.56 0.12 -0.23 0.38 -0.00 0.00 0.00 176.91 177.75 1tl4 h ASP 49 N 0.19 -0.64 -0.29 -0.10 2.03 -1.99 0.24 116.42 115.87 1tl4 h ASP 49 Ca 0.33 0.07 -0.04 0.00 -0.73 0.00 0.00 57.03 56.66 1tl4 h ASP 49 Cb 1.02 0.24 -0.01 0.00 -0.83 0.00 0.00 39.33 39.75 1tl4 h ASP 49 CO -0.06 -0.32 0.02 0.74 -1.03 0.00 0.00 179.24 178.59 1tl4 h THR 50 N -0.44 1.25 0.13 1.15 2.02 -1.72 0.82 112.91 116.12 1tl4 h THR 50 Ca 0.02 -0.89 0.02 0.00 0.77 0.00 0.00 66.41 66.33 1tl4 h THR 50 Cb 0.45 1.26 -0.04 0.00 -1.74 0.00 0.00 68.15 68.09 1tl4 h THR 50 CO -0.11 0.29 -0.29 -0.07 0.37 0.00 0.00 175.52 175.71 1tl4 h LEU 51 N 0.30 -0.82 -0.04 2.58 3.38 -1.16 -1.20 115.31 118.35 1tl4 h LEU 51 Ca 0.08 0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.17 1tl4 h LEU 51 Cb 0.40 0.31 -0.06 0.00 0.09 0.00 0.00 40.66 41.40 1tl4 h LEU 51 CO 0.01 -0.38 -0.52 -0.07 0.09 0.00 0.00 178.44 177.57 1tl4 h LEU 52 N -0.51 -1.62 -1.44 1.67 3.38 0.04 0.29 115.31 117.12 1tl4 h LEU 52 Ca 0.03 0.19 0.12 0.00 0.09 0.00 0.00 57.88 58.31 1tl4 h LEU 52 Cb 0.53 0.62 -0.05 0.00 0.09 0.00 0.00 40.66 41.85 1tl4 h LEU 52 CO -0.16 -0.51 0.51 0.00 0.09 0.00 0.00 178.44 178.37 1tl4 h ALA 53 N -0.32 1.92 0.36 1.53 0.00 -0.75 0.15 119.26 122.16 1tl4 h ALA 53 Ca 0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1tl4 h ALA 53 Cb 0.71 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1tl4 h ALA 53 CO -0.38 -0.11 -0.17 1.15 0.00 0.00 0.00 179.25 179.74 1tl4 h THR 54 N 0.58 0.48 -0.32 0.00 2.02 -0.56 -3.38 112.91 111.73 1tl4 h THR 54 Ca 0.38 -0.67 -0.11 0.00 0.77 0.00 0.00 66.41 66.77 1tl4 h THR 54 Cb 0.65 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1tl4 h THR 54 CO -0.14 0.10 -0.24 -0.07 0.37 0.00 0.00 175.52 175.54 1tl4 h LEU 55 N -0.94 0.64 -1.40 2.58 3.38 0.87 -0.33 115.31 120.11 1tl4 h LEU 55 Ca -0.05 -0.23 0.47 0.00 0.09 0.00 0.00 57.88 58.16 1tl4 h LEU 55 Cb 0.53 -0.18 -0.12 0.00 0.09 0.00 0.00 40.66 40.98 1tl4 h LEU 55 CO 0.08 0.87 0.92 0.29 0.09 0.00 0.00 178.44 180.69 1tl4 n LYS 56 N -4.11 -0.03 0.00 1.13 4.01 0.40 -1.14 118.16 118.42 1tl4 n LYS 56 Ca -0.00 1.17 0.06 0.00 -0.51 0.00 0.00 58.31 59.03 1tl4 n LYS 56 Cb 0.42 -2.36 0.28 0.00 -0.51 0.00 0.00 35.03 32.86 1tl4 n LYS 56 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1tl4 n LYS 57 N -4.51 0.03 -0.32 1.97 5.02 -0.13 -0.07 118.16 120.14 1tl4 n LYS 57 Ca 0.39 0.26 0.04 0.00 -2.02 0.00 0.00 58.31 56.99 1tl4 n LYS 57 Cb 1.56 -1.50 0.23 0.00 -0.02 0.00 0.00 35.03 35.30 1tl4 n LYS 57 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1tl4 h THR 58 N 0.00 1.05 -4.41 -0.18 1.35 -1.33 -3.47 112.91 105.91 1tl4 h THR 58 Ca 0.00 -0.36 -0.27 0.00 -0.55 0.00 0.00 66.41 65.23 1tl4 h THR 58 Cb 0.21 -0.09 0.10 0.00 -1.73 0.00 0.00 68.15 66.64 1tl4 h THR 58 CO 0.00 0.19 -0.49 0.61 -0.25 0.00 0.00 175.52 175.59 1tl4 n GLY 59 N -1.39 -0.10 0.54 5.82 0.00 0.90 -5.04 105.19 105.93 1tl4 n GLY 59 Ca 0.15 -0.03 -0.04 0.00 0.00 0.00 0.00 46.02 46.09 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 -3.57 1.15 -0.99 1.61 5.02 -1.26 -5.03 118.16 115.08 1tl4 n LYS 60 Ca -0.03 -0.56 -0.26 0.00 -2.02 0.00 0.00 58.31 55.44 1tl4 n LYS 60 Cb 0.56 0.26 -0.05 0.00 -0.02 0.00 0.00 35.03 35.77 1tl4 n LYS 60 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1tl4 n THR 61 N -0.16 3.23 -3.05 -0.18 -1.04 -1.26 -4.83 114.28 106.99 1tl4 n THR 61 Ca -0.02 -1.87 -0.45 0.00 -2.04 0.00 0.00 64.05 59.68 1tl4 n THR 61 Cb 0.10 -2.28 -0.02 0.00 -1.82 0.00 0.00 70.33 66.30 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 2.43 5.02 -0.18 12.58 0.11 -1.26 -3.94 120.40 135.15 1tl4 s VAL 62 Ca 0.56 -1.91 -0.10 0.00 -2.93 0.00 0.00 61.98 57.60 1tl4 s VAL 62 Cb 0.17 -4.69 -0.05 0.00 -1.53 0.00 0.00 36.38 30.28 1tl4 s VAL 62 CO -0.04 -1.37 0.14 -0.44 -3.33 0.00 0.00 175.10 170.06 1tl4 s SER 63 N 3.14 6.25 0.04 3.54 0.01 0.42 -4.81 113.70 122.29 1tl4 s SER 63 Ca 0.29 0.29 -0.30 0.00 1.31 0.00 0.00 55.95 57.53 1tl4 s SER 63 Cb -0.06 -2.09 -0.04 0.00 0.21 0.00 0.00 66.02 64.03 1tl4 s SER 63 CO -0.09 0.22 1.06 -0.47 0.41 0.00 0.00 173.24 174.37 1tl4 s TYR 64 N 0.10 3.59 0.60 2.43 5.04 -1.26 -0.58 117.35 127.26 1tl4 s TYR 64 Ca 0.10 1.56 0.05 0.00 -2.44 0.00 0.00 57.07 56.33 1tl4 s TYR 64 Cb -0.11 -3.23 0.08 0.00 0.35 0.00 0.00 41.96 39.05 1tl4 s TYR 64 CO -0.01 -0.48 0.83 -0.51 -1.34 0.00 0.00 175.55 174.04 1tl4 s LEU 65 N 0.91 3.16 1.21 6.97 1.02 0.27 -4.92 118.68 127.29 1tl4 s LEU 65 Ca 0.54 -0.53 -0.14 0.00 0.02 0.00 0.00 54.13 54.02 1tl4 s LEU 65 Cb -0.25 -2.03 0.30 0.00 0.02 0.00 0.00 46.19 44.23 1tl4 s LEU 65 CO 0.29 -1.41 0.95 0.61 0.02 0.00 0.00 176.35 176.80 1tl4 n GLY 66 N -2.40 -2.24 3.71 -3.19 0.00 -1.26 -4.59 105.19 95.22 1tl4 n GLY 66 Ca 0.13 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.52 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 -7.03 4.39 0.00 0.99 1.98 -1.26 -4.32 118.68 113.42 1tl4 s LEU 67 Ca 0.68 1.89 0.00 0.00 -2.89 0.00 0.00 54.13 53.81 1tl4 s LEU 67 Cb -0.25 -3.58 0.00 0.00 0.66 0.00 0.00 46.19 43.02 1tl4 s LEU 67 CO 0.66 -0.36 0.49 -0.62 -1.89 0.00 0.00 176.35 174.63