#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jt4 s ALA 2 N 0.00 -1.83 -0.88 -5.12 0.00 -1.26 -5.09 121.76 107.58 2jt4 s ALA 2 Ca 0.00 2.01 -0.20 0.00 0.00 0.00 0.00 51.96 53.77 2jt4 s ALA 2 Cb 0.00 -1.24 0.10 0.00 0.00 0.00 0.00 23.12 21.98 2jt4 s ALA 2 CO 0.00 -0.32 1.14 -1.54 0.00 0.00 0.00 175.76 175.04 2jt4 s SER 3 N 0.39 6.50 0.05 0.00 1.04 -1.26 -4.83 113.70 115.59 2jt4 s SER 3 Ca 0.00 -1.69 0.05 0.00 0.48 0.00 0.00 55.95 54.80 2jt4 s SER 3 Cb -0.05 -2.43 -0.24 0.00 0.10 0.00 0.00 66.02 63.40 2jt4 s SER 3 CO -0.01 -1.23 1.00 0.11 0.98 0.00 0.00 173.24 174.09 2jt4 h LYS 4 N 9.17 0.08 -6.24 4.02 1.57 -2.04 -3.45 116.57 119.67 2jt4 h LYS 4 Ca 0.06 -0.13 -0.55 0.00 -1.87 0.00 0.00 60.65 58.15 2jt4 h LYS 4 Cb 1.03 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.37 2jt4 h LYS 4 CO 1.18 0.90 0.97 -1.12 -0.57 0.00 0.00 179.45 180.81 2jt4 s SER 5 N -6.63 6.80 0.38 0.86 0.01 -1.26 -5.00 113.70 108.86 2jt4 s SER 5 Ca -0.03 2.02 -0.21 0.00 1.31 0.00 0.00 55.95 59.04 2jt4 s SER 5 Cb 0.09 -2.54 -0.10 0.00 0.21 0.00 0.00 66.02 63.67 2jt4 s SER 5 CO 0.83 -0.83 0.90 -0.54 0.41 0.00 0.00 173.24 174.01 2jt4 s LYS 6 N 3.52 4.25 0.76 12.44 3.01 -1.26 -5.06 119.74 137.40 2jt4 s LYS 6 Ca 0.65 1.06 -0.12 0.00 -1.01 0.00 0.00 55.97 56.55 2jt4 s LYS 6 Cb -0.29 -2.37 0.05 0.00 -1.01 0.00 0.00 37.83 34.21 2jt4 s LYS 6 CO 0.24 0.08 1.11 0.15 0.51 0.00 0.00 175.35 177.44 2jt4 s LYS 7 N -2.88 2.39 0.20 1.68 1.02 -0.96 -4.86 119.74 116.32 2jt4 s LYS 7 Ca 0.58 0.45 0.07 0.00 0.02 0.00 0.00 55.97 57.09 2jt4 s LYS 7 Cb -0.11 -1.97 -0.05 0.00 -0.52 0.00 0.00 37.83 35.18 2jt4 s LYS 7 CO 0.16 -1.37 -0.14 1.03 -0.92 0.00 0.00 175.35 174.11 2jt4 s ARG 8 N -5.33 1.30 0.19 1.68 0.52 -1.26 0.36 118.95 116.41 2jt4 s ARG 8 Ca 0.60 -1.56 -0.23 0.00 -0.52 0.00 0.00 55.73 54.02 2jt4 s ARG 8 Cb -0.12 -1.09 0.05 0.00 0.52 0.00 0.00 34.95 34.31 2jt4 s ARG 8 CO 0.52 0.18 0.74 0.20 0.02 0.00 0.00 175.30 176.96 2jt4 s GLY 9 N -3.25 -0.32 -0.14 -3.53 0.00 -0.47 -3.54 107.32 96.07 2jt4 s GLY 9 Ca 0.21 0.14 0.02 0.00 0.00 0.00 0.00 44.72 45.10 2jt4 s GLY 9 CO 0.06 0.05 -0.21 -0.42 0.00 0.00 0.00 173.10 172.58 2jt4 s ILE 10 N -3.68 1.97 0.01 0.90 1.01 -0.66 -1.97 121.20 118.78 2jt4 s ILE 10 Ca 0.07 -0.92 -0.30 0.00 0.00 0.00 0.00 60.65 59.50 2jt4 s ILE 10 Cb -0.03 -1.76 -0.05 0.00 0.01 0.00 0.00 42.46 40.63 2jt4 s ILE 10 CO -0.02 0.53 1.31 0.54 0.00 0.00 0.00 174.94 177.31 2jt4 s VAL 11 N 0.92 3.84 -0.10 2.92 0.11 -1.21 -0.39 120.40 126.49 2jt4 s VAL 11 Ca -0.05 1.25 -0.01 0.00 -2.93 0.00 0.00 61.98 60.25 2jt4 s VAL 11 Cb -0.15 -3.80 -0.00 0.00 -1.53 0.00 0.00 36.38 30.89 2jt4 s VAL 11 CO -0.04 0.03 -0.01 1.56 -3.33 0.00 0.00 175.10 173.31 2jt4 h GLN 12 N 7.41 0.00 0.00 1.54 1.08 -0.20 0.59 115.11 125.54 2jt4 h GLN 12 Ca -0.38 0.00 -0.45 0.00 -1.45 0.00 0.00 58.65 56.37 2jt4 h GLN 12 Cb 1.19 0.00 0.15 0.00 -0.05 0.00 0.00 27.48 28.76 2jt4 h GLN 12 CO 0.87 0.00 0.32 0.66 -0.95 0.00 0.00 178.83 179.74 2jt4 n TYR 13 N -4.67 -3.64 -3.83 2.96 4.01 -1.26 -4.22 117.16 106.51 2jt4 n TYR 13 Ca -0.01 -1.40 -0.36 0.00 -0.16 0.00 0.00 57.90 55.98 2jt4 n TYR 13 Cb 0.02 -0.94 -0.13 0.00 -0.31 0.00 0.00 39.34 37.98 2jt4 n TYR 13 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2jt4 s ASP 14 N -5.67 5.09 -0.24 7.72 2.15 -1.26 -3.34 116.67 121.12 2jt4 s ASP 14 Ca 0.73 -1.32 -0.06 0.00 0.43 0.00 0.00 52.55 52.34 2jt4 s ASP 14 Cb -0.03 -1.78 -0.01 0.00 -0.30 0.00 0.00 42.92 40.80 2jt4 s ASP 14 CO 0.51 -0.32 0.02 0.12 -0.17 0.00 0.00 175.17 175.32 2jt4 s PHE 15 N 1.29 3.03 -0.13 -5.34 5.36 0.46 -4.92 117.98 117.73 2jt4 s PHE 15 Ca -0.02 -0.75 -0.17 0.00 -0.96 0.00 0.00 56.93 55.03 2jt4 s PHE 15 Cb -0.20 -2.17 -0.04 0.00 -0.34 0.00 0.00 43.02 40.26 2jt4 s PHE 15 CO -0.00 -0.48 0.43 -1.64 -1.46 0.00 0.00 175.22 172.07 2jt4 s MET 16 N 1.53 4.31 0.15 10.12 -1.94 -1.26 -0.81 119.30 131.40 2jt4 s MET 16 Ca 0.06 0.35 0.04 0.00 -1.71 0.00 0.00 55.69 54.42 2jt4 s MET 16 Cb -0.15 -3.44 -0.04 0.00 2.01 0.00 0.00 34.83 33.21 2jt4 s MET 16 CO 0.00 0.16 0.18 0.00 -0.01 0.00 0.00 175.02 175.35 2jt4 s ALA 17 N 0.64 3.72 -0.02 3.03 0.00 -1.26 -4.94 121.76 122.93 2jt4 s ALA 17 Ca 0.23 -1.12 -0.00 0.00 0.00 0.00 0.00 51.96 51.07 2jt4 s ALA 17 Cb -0.15 -1.52 -0.01 0.00 0.00 0.00 0.00 23.12 21.44 2jt4 s ALA 17 CO 0.09 0.55 -0.02 -1.91 0.00 0.00 0.00 175.76 174.47 2jt4 n GLU 18 N -0.31 0.05 -2.72 0.00 2.13 -1.26 -4.87 120.64 113.66 2jt4 n GLU 18 Ca -0.08 0.01 -0.27 0.00 0.66 0.00 0.00 57.16 57.48 2jt4 n GLU 18 Cb 0.54 -0.94 -0.01 0.00 0.27 0.00 0.00 31.44 31.30 2jt4 n GLU 18 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2jt4 s SER 19 N -4.41 6.29 0.49 4.31 0.01 -1.26 -4.97 113.70 114.16 2jt4 s SER 19 Ca -0.03 0.91 0.29 0.00 1.31 0.00 0.00 55.95 58.44 2jt4 s SER 19 Cb 0.01 -2.24 0.98 0.00 0.21 0.00 0.00 66.02 64.98 2jt4 s SER 19 CO 0.04 -0.53 1.84 0.06 0.41 0.00 0.00 173.24 175.06 2jt4 h GLN 20 N 0.39 0.00 -0.52 12.44 -0.00 -2.03 -2.43 115.11 122.96 2jt4 h GLN 20 Ca -0.47 0.00 -0.09 0.00 -0.00 0.00 0.00 58.65 58.09 2jt4 h GLN 20 Cb 1.20 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.66 2jt4 h GLN 20 CO 0.62 0.00 -0.04 -0.44 -0.00 0.00 0.00 178.83 178.97 2jt4 h ASP 21 N 0.00 0.89 -4.02 0.06 5.19 -1.96 -3.45 116.42 113.12 2jt4 h ASP 21 Ca 0.00 -0.25 -0.50 0.00 -0.62 0.00 0.00 57.03 55.66 2jt4 h ASP 21 Cb 0.68 -0.24 0.05 0.00 0.18 0.00 0.00 39.33 40.01 2jt4 h ASP 21 CO 0.00 0.98 0.29 -1.61 -3.12 0.00 0.00 179.24 175.77 2jt4 s GLU 22 N -4.93 3.38 -0.14 3.56 2.02 -0.92 0.38 118.70 122.05 2jt4 s GLU 22 Ca -0.10 0.42 0.01 0.00 0.02 0.00 0.00 54.97 55.32 2jt4 s GLU 22 Cb 0.14 -2.19 0.02 0.00 0.10 0.00 0.00 34.13 32.19 2jt4 s GLU 22 CO 0.84 -0.54 -0.16 -1.17 0.02 0.00 0.00 175.26 174.24 2jt4 s LEU 23 N -5.04 1.79 -0.36 1.80 2.96 -0.71 -4.55 118.68 114.57 2jt4 s LEU 23 Ca 0.53 -0.50 -0.29 0.00 -0.22 0.00 0.00 54.13 53.65 2jt4 s LEU 23 Cb -0.11 -1.21 -0.00 0.00 0.50 0.00 0.00 46.19 45.37 2jt4 s LEU 23 CO 0.50 -0.01 1.57 -0.89 -1.32 0.00 0.00 176.35 176.19 2jt4 s THR 24 N 1.23 3.73 -0.15 3.68 2.01 -1.26 -4.58 115.64 120.30 2jt4 s THR 24 Ca -0.00 0.75 0.02 0.00 0.31 0.00 0.00 61.69 62.77 2jt4 s THR 24 Cb -0.14 -3.95 0.01 0.00 0.01 0.00 0.00 72.50 68.43 2jt4 s THR 24 CO -0.07 -0.58 -0.21 0.27 -0.69 0.00 0.00 174.62 173.33 2jt4 s ILE 25 N 5.93 2.05 0.25 1.82 -4.36 0.01 -4.95 121.20 121.95 2jt4 s ILE 25 Ca 0.69 -0.96 -0.21 0.00 -0.26 0.00 0.00 60.65 59.91 2jt4 s ILE 25 Cb -0.18 -1.82 -0.09 0.00 1.25 0.00 0.00 42.46 41.62 2jt4 s ILE 25 CO 0.33 0.55 0.78 -1.59 0.24 0.00 0.00 174.94 175.24 2jt4 s LYS 26 N 0.96 4.33 0.13 0.37 -2.85 -1.26 -0.40 119.74 121.01 2jt4 s LYS 26 Ca -0.03 0.97 -0.34 0.00 -1.00 0.00 0.00 55.97 55.57 2jt4 s LYS 26 Cb -0.15 -2.85 -0.13 0.00 -2.06 0.00 0.00 37.83 32.64 2jt4 s LYS 26 CO -0.05 0.36 1.64 0.45 0.10 0.00 0.00 175.35 177.85 2jt4 n SER 27 N 0.66 3.23 0.00 0.03 2.88 -1.21 -2.40 113.62 116.81 2jt4 n SER 27 Ca -0.01 1.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.59 2jt4 n SER 27 Cb 0.51 -1.43 0.00 0.00 -0.75 0.00 0.00 64.21 62.54 2jt4 n SER 27 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jt4 n GLY 28 N 3.61 0.67 3.37 0.46 0.00 0.20 -5.01 105.19 108.49 2jt4 n GLY 28 Ca 0.18 -0.15 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 2jt4 n GLY 28 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jt4 n ASP 29 N 0.26 0.52 -4.26 1.61 2.03 -1.01 -4.88 116.55 110.83 2jt4 n ASP 29 Ca 0.00 -1.65 -0.35 0.00 0.52 0.00 0.00 54.79 53.32 2jt4 n ASP 29 Cb 0.00 -0.76 -0.14 0.00 -0.72 0.00 0.00 41.12 39.50 2jt4 n ASP 29 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2jt4 s LYS 30 N -5.23 3.16 0.00 -0.67 -0.14 -1.26 -3.31 119.74 112.29 2jt4 s LYS 30 Ca 0.63 -0.76 0.05 0.00 -1.36 0.00 0.00 55.97 54.53 2jt4 s LYS 30 Cb -0.02 -2.97 -0.02 0.00 -1.68 0.00 0.00 37.83 33.14 2jt4 s LYS 30 CO 0.43 -0.27 -0.17 0.14 -0.76 0.00 0.00 175.35 174.72 2jt4 s VAL 31 N 1.41 1.34 0.27 3.17 -7.23 -0.83 -1.52 120.40 117.01 2jt4 s VAL 31 Ca 0.04 -0.81 -0.23 0.00 -1.81 0.00 0.00 61.98 59.17 2jt4 s VAL 31 Cb -0.15 -1.13 -0.09 0.00 0.56 0.00 0.00 36.38 35.57 2jt4 s VAL 31 CO -0.05 0.31 0.84 -0.31 -0.31 0.00 0.00 175.10 175.58 2jt4 s TYR 32 N -0.50 3.70 -0.38 2.82 2.02 0.13 -1.37 117.35 123.77 2jt4 s TYR 32 Ca 0.06 1.61 -0.10 0.00 -0.37 0.00 0.00 57.07 58.27 2jt4 s TYR 32 Cb -0.07 -2.78 0.04 0.00 -0.40 0.00 0.00 41.96 38.75 2jt4 s TYR 32 CO -0.00 0.30 0.21 0.42 -1.57 0.00 0.00 175.55 174.91 2jt4 s ILE 33 N -1.53 4.47 -0.05 2.71 1.01 0.16 -1.02 121.20 126.95 2jt4 s ILE 33 Ca 0.46 -0.99 -0.01 0.00 0.00 0.00 0.00 60.65 60.11 2jt4 s ILE 33 Cb -0.18 -3.55 -0.00 0.00 0.01 0.00 0.00 42.46 38.74 2jt4 s ILE 33 CO 0.23 -0.29 -0.02 -0.07 0.00 0.00 0.00 174.94 174.79 2jt4 h LEU 34 N 8.42 0.00 -7.26 2.97 -0.00 -1.25 -2.55 115.31 115.64 2jt4 h LEU 34 Ca -0.25 0.00 -0.51 0.00 -0.00 0.00 0.00 57.88 57.12 2jt4 h LEU 34 Cb 1.10 0.00 -0.40 0.00 -0.00 0.00 0.00 40.66 41.36 2jt4 h LEU 34 CO 0.68 0.23 -0.76 -0.62 -0.00 0.00 0.00 178.44 177.98 2jt4 s ASP 35 N -4.15 2.89 -0.25 -0.43 -1.08 -1.19 -4.84 116.67 107.61 2jt4 s ASP 35 Ca -0.02 -0.81 0.10 0.00 -0.52 0.00 0.00 52.55 51.30 2jt4 s ASP 35 Cb 0.00 -0.58 0.68 0.00 -1.46 0.00 0.00 42.92 41.57 2jt4 s ASP 35 CO 0.02 -0.31 1.64 -0.90 0.52 0.00 0.00 175.17 176.15 2jt4 n ASP 36 N 5.06 4.78 -0.64 -0.34 5.68 -1.26 -0.78 116.55 129.05 2jt4 n ASP 36 Ca -0.09 -2.96 -0.00 0.00 -0.50 0.00 0.00 54.79 51.25 2jt4 n ASP 36 Cb 0.47 -0.70 -0.00 0.00 -1.14 0.00 0.00 41.12 39.75 2jt4 n ASP 36 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 2jt4 n LYS 37 N 0.18 0.00 -0.00 0.11 2.85 -1.26 -4.84 118.16 115.20 2jt4 n LYS 37 Ca 0.31 -0.76 -0.12 0.00 -1.05 0.00 0.00 58.31 56.68 2jt4 n LYS 37 Cb 1.19 -0.21 -0.08 0.00 -0.65 0.00 0.00 35.03 35.28 2jt4 n LYS 37 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 2jt4 h LYS 38 N 0.10 0.06 0.00 -1.58 1.63 -1.74 -3.30 116.57 111.75 2jt4 h LYS 38 Ca -0.06 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.72 2jt4 h LYS 38 Cb 1.32 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.94 2jt4 h LYS 38 CO -0.01 0.32 -0.14 0.43 -3.45 0.00 0.00 179.45 176.60 2jt4 n SER 39 N -4.92 1.38 0.00 4.20 7.64 -0.87 -5.03 113.62 116.03 2jt4 n SER 39 Ca -0.07 -2.36 0.00 0.00 1.01 0.00 0.00 58.87 57.44 2jt4 n SER 39 Cb 0.16 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 2jt4 n SER 39 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2jt4 n LYS 40 N -0.72 0.00 0.08 1.43 4.81 -1.24 -3.63 118.16 118.89 2jt4 n LYS 40 Ca 0.07 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.45 2jt4 n LYS 40 Cb 0.57 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.57 2jt4 n LYS 40 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2jt4 h ASP 41 N 0.00 0.00 -4.03 3.14 5.19 -1.95 -3.45 116.42 115.32 2jt4 h ASP 41 Ca 0.00 0.00 -0.65 0.00 -0.62 0.00 0.00 57.03 55.76 2jt4 h ASP 41 Cb 0.00 0.00 -0.31 0.00 0.18 0.00 0.00 39.33 39.20 2jt4 h ASP 41 CO 0.00 0.91 -0.87 0.26 -3.12 0.00 0.00 179.24 176.42 2jt4 s TRP 42 N -2.91 2.22 0.37 4.55 0.52 -1.24 -2.03 118.94 120.42 2jt4 s TRP 42 Ca 0.01 -0.63 0.08 0.00 0.02 0.00 0.00 56.10 55.57 2jt4 s TRP 42 Cb 0.11 -1.46 -0.05 0.00 -1.15 0.00 0.00 33.47 30.91 2jt4 s TRP 42 CO 0.81 -0.19 0.09 -1.58 0.02 0.00 0.00 176.95 176.10 2jt4 s TRP 43 N -0.15 2.59 -0.29 -1.98 0.51 0.68 -2.04 118.94 118.26 2jt4 s TRP 43 Ca -0.03 -0.50 -0.13 0.00 -2.12 0.00 0.00 56.10 53.32 2jt4 s TRP 43 Cb -0.13 -1.70 -0.04 0.00 -0.81 0.00 0.00 33.47 30.79 2jt4 s TRP 43 CO 0.03 0.35 0.27 -1.64 -0.51 0.00 0.00 176.95 175.46 2jt4 s MET 44 N -3.80 3.87 0.09 4.98 -1.94 0.04 -0.56 119.30 121.98 2jt4 s MET 44 Ca 0.37 -0.25 0.02 0.00 -1.71 0.00 0.00 55.69 54.12 2jt4 s MET 44 Cb 0.02 -3.69 -0.04 0.00 2.01 0.00 0.00 34.83 33.13 2jt4 s MET 44 CO 0.21 -0.28 -0.07 0.00 -0.01 0.00 0.00 175.02 174.86 2jt4 s GLN 46 N -3.25 1.12 -0.07 0.00 0.74 -0.19 -0.79 119.66 117.22 2jt4 s GLN 46 Ca 0.07 -0.20 -0.30 0.00 0.05 0.00 0.00 55.36 54.98 2jt4 s GLN 46 Cb 0.01 -1.05 -0.06 0.00 1.10 0.00 0.00 33.01 33.01 2jt4 s GLN 46 CO -0.03 -0.07 1.75 -0.51 -0.55 0.00 0.00 175.29 175.88 2jt4 s LEU 47 N 0.93 4.23 0.27 3.68 1.43 0.15 0.20 118.68 129.57 2jt4 s LEU 47 Ca -0.11 2.22 -0.02 0.00 -1.03 0.00 0.00 54.13 55.19 2jt4 s LEU 47 Cb -0.15 -3.53 0.41 0.00 0.03 0.00 0.00 46.19 42.96 2jt4 s LEU 47 CO 0.01 -1.07 1.91 0.58 0.23 0.00 0.00 176.35 178.01 2jt4 h VAL 48 N 5.77 1.12 0.26 -1.59 2.07 -1.60 0.17 116.25 122.45 2jt4 h VAL 48 Ca -0.41 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 66.70 2jt4 h VAL 48 Cb 1.19 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 2jt4 h VAL 48 CO 0.96 0.21 -0.12 -0.78 0.02 0.00 0.00 177.57 177.86 2jt4 h ASP 49 N 1.18 -0.30 0.60 0.57 3.58 -1.90 -3.36 116.42 116.79 2jt4 h ASP 49 Ca 0.40 -0.24 -0.23 0.00 0.42 0.00 0.00 57.03 57.39 2jt4 h ASP 49 Cb 0.09 0.08 -0.04 0.00 1.72 0.00 0.00 39.33 41.18 2jt4 h ASP 49 CO -0.14 0.16 -1.56 -0.24 -2.88 0.00 0.00 179.24 174.58 2jt4 n SER 50 N -5.05 0.86 0.00 2.28 2.88 -1.20 -4.96 113.62 108.44 2jt4 n SER 50 Ca -0.09 0.40 0.00 0.00 -1.33 0.00 0.00 58.87 57.85 2jt4 n SER 50 Cb 0.26 0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.78 2jt4 n SER 50 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jt4 n GLY 51 N 1.47 0.64 3.66 0.46 0.00 0.58 -5.03 105.19 106.98 2jt4 n GLY 51 Ca -0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 2jt4 n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jt4 s LYS 52 N -0.74 4.19 0.11 1.61 1.02 -1.24 -4.71 119.74 119.98 2jt4 s LYS 52 Ca 0.00 2.18 0.11 0.00 0.02 0.00 0.00 55.97 58.28 2jt4 s LYS 52 Cb 0.00 -3.93 -0.04 0.00 -0.52 0.00 0.00 37.83 33.34 2jt4 s LYS 52 CO 0.00 -0.82 -0.27 -1.54 -0.92 0.00 0.00 175.35 171.80 2jt4 s SER 53 N 3.17 3.30 -0.00 2.83 1.04 -1.26 0.33 113.70 123.10 2jt4 s SER 53 Ca 0.73 -0.72 -0.02 0.00 0.48 0.00 0.00 55.95 56.42 2jt4 s SER 53 Cb -0.34 -0.24 0.01 0.00 0.10 0.00 0.00 66.02 65.55 2jt4 s SER 53 CO 0.29 0.19 0.10 0.61 0.98 0.00 0.00 173.24 175.42 2jt4 n GLY 54 N 1.07 0.49 3.73 7.32 0.00 0.03 -4.89 105.19 112.94 2jt4 n GLY 54 Ca -0.18 -0.83 -0.40 0.00 0.00 0.00 0.00 46.02 44.61 2jt4 n GLY 54 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jt4 s LEU 55 N 0.00 4.37 0.10 0.99 2.01 0.16 -1.32 118.68 124.99 2jt4 s LEU 55 Ca 0.02 1.29 0.05 0.00 0.01 0.00 0.00 54.13 55.51 2jt4 s LEU 55 Cb -0.00 -3.14 -0.03 0.00 0.01 0.00 0.00 46.19 43.03 2jt4 s LEU 55 CO -0.00 -0.06 -0.13 0.68 1.01 0.00 0.00 176.35 177.85 2jt4 s VAL 56 N 0.44 1.13 0.34 -1.59 -7.23 0.28 -1.73 120.40 112.03 2jt4 s VAL 56 Ca 0.38 -1.55 -0.28 0.00 -1.81 0.00 0.00 61.98 58.71 2jt4 s VAL 56 Cb -0.19 -1.31 -0.10 0.00 0.56 0.00 0.00 36.38 35.34 2jt4 s VAL 56 CO 0.20 -0.40 1.30 -2.84 -0.31 0.00 0.00 175.10 173.05 2jt4 s PRO 57 N -2.39 4.33 0.19 4.82 0.02 -1.26 -0.23 135.00 140.48 2jt4 s PRO 57 Ca 0.04 2.19 -0.12 0.00 0.02 0.00 0.00 61.00 63.13 2jt4 s PRO 57 Cb -0.06 -3.04 0.17 0.00 0.02 0.00 0.00 34.50 31.58 2jt4 s PRO 57 CO 0.02 -0.20 1.78 0.00 -0.33 0.00 0.00 177.00 178.27 2jt4 h ALA 58 N 3.33 0.68 0.00 -1.55 0.00 -1.71 -2.43 119.26 117.58 2jt4 h ALA 58 Ca -0.49 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2jt4 h ALA 58 Cb 1.23 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2jt4 h ALA 58 CO 0.65 -0.10 0.00 1.04 0.00 0.00 0.00 179.25 180.84 2jt4 n GLN 59 N -4.90 0.71 -0.04 0.00 3.00 -1.26 -2.98 117.38 111.90 2jt4 n GLN 59 Ca 0.05 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 57.04 2jt4 n GLN 59 Cb 0.16 -1.14 -0.12 0.00 0.00 0.00 0.00 30.24 29.14 2jt4 n GLN 59 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 2jt4 n PHE 60 N -0.24 0.00 -3.52 1.08 3.01 -0.91 -4.80 117.46 112.07 2jt4 n PHE 60 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.04 2jt4 n PHE 60 Cb 0.07 -0.56 -0.10 0.00 -0.01 0.00 0.00 39.48 38.88 2jt4 n PHE 60 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2jt4 s ILE 61 N -2.66 4.79 0.22 4.37 -1.09 -1.16 0.58 121.20 126.25 2jt4 s ILE 61 Ca -0.07 -0.98 -0.30 0.00 -2.23 0.00 0.00 60.65 57.07 2jt4 s ILE 61 Cb 0.07 -3.77 -0.09 0.00 -1.58 0.00 0.00 42.46 37.09 2jt4 s ILE 61 CO 0.62 -0.39 1.34 -0.70 -1.23 0.00 0.00 174.94 174.58 2jt4 s GLU 62 N 1.57 4.36 -0.02 2.79 2.12 0.48 -4.83 118.70 125.17 2jt4 s GLU 62 Ca 0.03 2.13 -0.30 0.00 0.36 0.00 0.00 54.97 57.19 2jt4 s GLU 62 Cb -0.21 -3.17 -0.03 0.00 0.26 0.00 0.00 34.13 30.98 2jt4 s GLU 62 CO 0.06 -0.29 1.10 -2.14 -0.54 0.00 0.00 175.26 173.45 2jt4 s PRO 63 N -0.27 4.44 0.22 4.30 0.02 -1.26 -1.66 135.00 140.79 2jt4 s PRO 63 Ca 0.57 1.57 0.24 0.00 0.02 0.00 0.00 61.00 63.40 2jt4 s PRO 63 Cb -0.38 -3.48 0.38 0.00 0.02 0.00 0.00 34.50 31.04 2jt4 s PRO 63 CO 0.40 -0.26 1.42 -0.39 -0.33 0.00 0.00 177.00 177.84 2jt4 h VAL 64 N 4.85 0.00 0.00 3.83 -1.51 -1.94 -3.46 116.25 118.02 2jt4 h VAL 64 Ca -0.37 -0.68 0.00 0.00 -1.23 0.00 0.00 66.70 64.42 2jt4 h VAL 64 Cb 1.19 1.42 0.00 0.00 -2.13 0.00 0.00 31.29 31.77 2jt4 h VAL 64 CO 0.82 0.00 0.00 -1.14 -1.23 0.00 0.00 177.57 176.02 2jt4 n ARG 65 N -2.44 0.00 0.00 5.19 0.63 -1.26 -5.12 116.66 113.66 2jt4 n ARG 65 Ca 0.03 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.96 2jt4 n ARG 65 Cb 0.48 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.39 2jt4 n ARG 65 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 2jt4 n ASP 66 N -0.01 0.00 0.00 6.15 5.75 -1.26 -4.95 116.55 122.23 2jt4 n ASP 66 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 2jt4 n ASP 66 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 2jt4 n ASP 66 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 2jt4 n LYS 67 N 0.00 0.00 -0.09 0.11 3.00 -1.26 -4.47 118.16 115.44 2jt4 n LYS 67 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.18 2jt4 n LYS 67 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 34.99 2jt4 n LYS 67 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 2jt4 h LYS 68 N 0.00 0.63 -3.89 1.64 3.64 -2.00 -3.38 116.57 113.21 2jt4 h LYS 68 Ca 0.00 -0.31 -0.71 0.00 -1.27 0.00 0.00 60.65 58.36 2jt4 h LYS 68 Cb 0.00 -0.00 -0.33 0.00 -0.41 0.00 0.00 32.23 31.49 2jt4 h LYS 68 CO 0.00 0.90 -0.35 -1.01 -2.27 0.00 0.00 179.45 176.72 2jt4 s HIS 69 N -4.45 3.48 -0.40 1.91 3.76 -1.26 -4.98 115.29 113.36 2jt4 s HIS 69 Ca -0.13 -2.46 0.01 0.00 -0.15 0.00 0.00 55.06 52.33 2jt4 s HIS 69 Cb 0.08 -3.32 0.13 0.00 1.11 0.00 0.00 32.58 30.58 2jt4 s HIS 69 CO 0.81 -0.90 0.19 0.99 -0.85 0.00 0.00 174.74 174.98 2jt4 s THR 70 N 0.39 1.26 -0.63 1.30 2.01 -1.26 -4.98 115.64 113.73 2jt4 s THR 70 Ca 0.14 -2.22 0.05 0.00 0.31 0.00 0.00 61.69 59.97 2jt4 s THR 70 Cb -0.20 -1.90 0.04 0.00 0.01 0.00 0.00 72.50 70.44 2jt4 s THR 70 CO -0.04 -0.83 0.66 -0.62 -0.69 0.00 0.00 174.62 173.10