#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jt4 h ALA 2 N 0.00 0.89 -1.71 3.04 0.00 -2.12 -3.37 119.26 115.99 2jt4 h ALA 2 Ca 0.00 -0.40 -0.57 0.00 0.00 0.00 0.00 54.91 53.93 2jt4 h ALA 2 Cb 0.00 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 17.58 2jt4 h ALA 2 CO 0.00 0.63 0.83 -1.12 0.00 0.00 0.00 179.25 179.59 2jt4 s SER 3 N -6.82 6.48 -0.48 0.00 0.01 -1.26 -4.91 113.70 106.73 2jt4 s SER 3 Ca -0.08 0.12 0.01 0.00 1.31 0.00 0.00 55.95 57.31 2jt4 s SER 3 Cb 0.13 -2.52 0.50 0.00 0.21 0.00 0.00 66.02 64.34 2jt4 s SER 3 CO 0.82 -1.31 1.90 0.29 0.41 0.00 0.00 173.24 175.36 2jt4 n LYS 4 N 7.92 2.26 -2.99 12.44 5.02 -1.26 -4.93 118.16 136.61 2jt4 n LYS 4 Ca 0.08 -2.72 -0.00 0.00 -2.02 0.00 0.00 58.31 53.65 2jt4 n LYS 4 Cb 0.49 -2.07 -0.00 0.00 -0.02 0.00 0.00 35.03 33.43 2jt4 n LYS 4 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2jt4 n SER 5 N -0.78 -7.02 -4.68 4.39 3.41 -1.26 -4.78 113.62 102.89 2jt4 n SER 5 Ca 0.53 0.84 -0.43 0.00 -0.26 0.00 0.00 58.87 59.55 2jt4 n SER 5 Cb 1.13 -3.10 -0.03 0.00 -0.26 0.00 0.00 64.21 61.95 2jt4 n SER 5 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2jt4 n LYS 6 N 1.12 2.74 -1.72 4.33 4.81 -1.26 -4.84 118.16 123.34 2jt4 n LYS 6 Ca -0.01 1.00 -0.67 0.00 -0.87 0.00 0.00 58.31 57.76 2jt4 n LYS 6 Cb 0.30 -2.90 -0.10 0.00 0.02 0.00 0.00 35.03 32.35 2jt4 n LYS 6 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 2jt4 n LYS 7 N 6.02 0.09 -4.08 1.64 2.85 -1.26 -4.85 118.16 118.57 2jt4 n LYS 7 Ca 0.19 0.03 -0.26 0.00 -1.05 0.00 0.00 58.31 57.22 2jt4 n LYS 7 Cb 0.37 -1.55 -0.05 0.00 -0.65 0.00 0.00 35.03 33.15 2jt4 n LYS 7 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2jt4 s ARG 8 N 3.19 2.92 0.21 -1.58 0.52 -1.26 -0.62 118.95 122.32 2jt4 s ARG 8 Ca 1.05 -0.88 -0.08 0.00 -0.52 0.00 0.00 55.73 55.31 2jt4 s ARG 8 Cb -1.47 -2.65 -0.02 0.00 0.52 0.00 0.00 34.95 31.34 2jt4 s ARG 8 CO 0.80 0.48 0.31 0.20 0.02 0.00 0.00 175.30 177.11 2jt4 s GLY 9 N -3.16 0.82 -0.05 -3.53 0.00 0.26 -2.56 107.32 99.10 2jt4 s GLY 9 Ca 0.31 -1.15 0.02 0.00 0.00 0.00 0.00 44.72 43.90 2jt4 s GLY 9 CO 0.24 -0.94 -0.10 -0.42 0.00 0.00 0.00 173.10 171.88 2jt4 s ILE 10 N -4.05 0.97 0.05 0.90 1.01 -0.33 -1.84 121.20 117.90 2jt4 s ILE 10 Ca 0.27 -0.40 -0.26 0.00 0.00 0.00 0.00 60.65 60.25 2jt4 s ILE 10 Cb 0.03 -0.89 -0.05 0.00 0.01 0.00 0.00 42.46 41.55 2jt4 s ILE 10 CO 0.08 0.31 0.80 0.54 0.00 0.00 0.00 174.94 176.67 2jt4 s VAL 11 N 0.58 4.72 -0.82 2.92 0.11 -1.21 -0.68 120.40 126.02 2jt4 s VAL 11 Ca -0.11 1.71 0.21 0.00 -2.93 0.00 0.00 61.98 60.86 2jt4 s VAL 11 Cb -0.14 -4.15 -0.23 0.00 -1.53 0.00 0.00 36.38 30.32 2jt4 s VAL 11 CO 0.02 0.34 0.85 0.00 -3.33 0.00 0.00 175.10 172.99 2jt4 n GLN 12 N 2.90 0.12 -4.49 1.54 1.13 0.13 -2.37 117.38 116.34 2jt4 n GLN 12 Ca -0.01 -0.03 -0.23 0.00 -1.94 0.00 0.00 57.00 54.78 2jt4 n GLN 12 Cb 0.50 -1.51 -0.10 0.00 0.11 0.00 0.00 30.24 29.24 2jt4 n GLN 12 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 2jt4 s TYR 13 N -3.10 1.98 0.17 1.08 1.51 -1.26 -4.77 117.35 112.96 2jt4 s TYR 13 Ca 0.05 -0.98 0.02 0.00 -1.01 0.00 0.00 57.07 55.15 2jt4 s TYR 13 Cb 0.16 -1.32 -0.04 0.00 -0.11 0.00 0.00 41.96 40.65 2jt4 s TYR 13 CO 0.87 0.01 0.32 -0.51 -1.11 0.00 0.00 175.55 175.12 2jt4 s ASP 14 N -3.54 6.35 -0.28 2.29 1.11 -1.26 -2.55 116.67 118.79 2jt4 s ASP 14 Ca 0.33 0.22 -0.18 0.00 0.18 0.00 0.00 52.55 53.10 2jt4 s ASP 14 Cb 0.08 -1.93 0.08 0.00 1.07 0.00 0.00 42.92 42.21 2jt4 s ASP 14 CO 0.15 0.02 0.70 0.12 1.18 0.00 0.00 175.17 177.34 2jt4 s PHE 15 N -1.80 -0.99 -0.22 4.23 5.36 0.52 -4.96 117.98 120.12 2jt4 s PHE 15 Ca 0.35 2.07 -0.10 0.00 -0.96 0.00 0.00 56.93 58.29 2jt4 s PHE 15 Cb -0.11 0.55 -0.05 0.00 -0.34 0.00 0.00 43.02 43.07 2jt4 s PHE 15 CO 0.29 -0.49 0.15 -1.64 -1.46 0.00 0.00 175.22 172.06 2jt4 s MET 16 N 1.34 4.12 0.52 10.12 -1.94 -1.26 -1.02 119.30 131.18 2jt4 s MET 16 Ca -0.08 -0.25 -0.14 0.00 -1.71 0.00 0.00 55.69 53.51 2jt4 s MET 16 Cb -0.05 -3.48 -0.07 0.00 2.01 0.00 0.00 34.83 33.24 2jt4 s MET 16 CO -0.15 0.16 0.96 0.00 -0.01 0.00 0.00 175.02 175.98 2jt4 s ALA 17 N 0.76 3.13 -0.07 3.03 0.00 -1.26 -4.93 121.76 122.41 2jt4 s ALA 17 Ca 0.08 0.03 -0.02 0.00 0.00 0.00 0.00 51.96 52.05 2jt4 s ALA 17 Cb -0.12 -3.03 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 2jt4 s ALA 17 CO 0.02 -0.32 -0.08 -1.91 0.00 0.00 0.00 175.76 173.46 2jt4 n GLU 18 N -1.86 0.16 -3.11 0.00 4.07 -1.26 -4.95 120.64 113.69 2jt4 n GLU 18 Ca 0.06 0.06 -0.18 0.00 -0.06 0.00 0.00 57.16 57.03 2jt4 n GLU 18 Cb 0.54 -0.89 0.01 0.00 -0.06 0.00 0.00 31.44 31.04 2jt4 n GLU 18 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 2jt4 s SER 19 N -5.29 5.73 0.48 4.31 0.15 -1.26 -5.00 113.70 112.81 2jt4 s SER 19 Ca -0.10 -0.30 0.27 0.00 0.70 0.00 0.00 55.95 56.52 2jt4 s SER 19 Cb 0.03 -0.87 1.03 0.00 -1.71 0.00 0.00 66.02 64.51 2jt4 s SER 19 CO 0.14 -0.69 1.87 -0.61 1.20 0.00 0.00 173.24 175.14 2jt4 h GLN 20 N 0.66 0.00 -0.33 5.44 4.15 -2.03 -2.72 115.11 120.29 2jt4 h GLN 20 Ca -0.42 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 58.93 2jt4 h GLN 20 Cb 1.27 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.95 2jt4 h GLN 20 CO 0.48 0.15 -0.09 -0.44 -1.93 0.00 0.00 178.83 177.00 2jt4 h ASP 21 N 0.00 0.53 -3.38 -0.69 5.19 -1.96 -3.45 116.42 112.66 2jt4 h ASP 21 Ca -0.00 -0.13 -0.49 0.00 -0.62 0.00 0.00 57.03 55.79 2jt4 h ASP 21 Cb 0.68 -0.14 0.03 0.00 0.18 0.00 0.00 39.33 40.08 2jt4 h ASP 21 CO 0.02 0.66 0.04 -1.61 -3.12 0.00 0.00 179.24 175.23 2jt4 s GLU 22 N -4.80 3.50 -0.11 3.56 2.02 -1.03 -0.09 118.70 121.75 2jt4 s GLU 22 Ca -0.08 0.06 0.01 0.00 0.02 0.00 0.00 54.97 54.98 2jt4 s GLU 22 Cb 0.15 -2.44 0.02 0.00 0.10 0.00 0.00 34.13 31.95 2jt4 s GLU 22 CO 0.78 -0.14 -0.13 -1.17 0.02 0.00 0.00 175.26 174.62 2jt4 s LEU 23 N -4.65 1.61 -0.12 1.80 2.96 -0.36 -4.60 118.68 115.32 2jt4 s LEU 23 Ca 0.46 -0.41 -0.29 0.00 -0.22 0.00 0.00 54.13 53.67 2jt4 s LEU 23 Cb -0.10 -1.04 -0.03 0.00 0.50 0.00 0.00 46.19 45.52 2jt4 s LEU 23 CO 0.43 -0.02 1.44 -0.89 -1.32 0.00 0.00 176.35 175.98 2jt4 s THR 24 N 1.19 3.97 0.16 3.68 2.01 -1.26 -4.60 115.64 120.79 2jt4 s THR 24 Ca -0.03 1.17 0.09 0.00 0.31 0.00 0.00 61.69 63.24 2jt4 s THR 24 Cb -0.14 -3.77 -0.04 0.00 0.01 0.00 0.00 72.50 68.56 2jt4 s THR 24 CO -0.04 -0.11 -0.21 0.27 -0.69 0.00 0.00 174.62 173.84 2jt4 s ILE 25 N 3.78 1.95 0.08 1.82 -4.36 -0.19 -4.96 121.20 119.32 2jt4 s ILE 25 Ca 0.63 -1.87 0.07 0.00 -0.26 0.00 0.00 60.65 59.22 2jt4 s ILE 25 Cb -0.27 -1.86 -0.03 0.00 1.25 0.00 0.00 42.46 41.55 2jt4 s ILE 25 CO 0.21 -0.20 -0.18 -0.54 0.24 0.00 0.00 174.94 174.47 2jt4 s LYS 26 N -2.56 1.01 -0.16 0.37 1.02 -1.26 -0.35 119.74 117.80 2jt4 s LYS 26 Ca 0.15 -1.05 -0.34 0.00 0.02 0.00 0.00 55.97 54.75 2jt4 s LYS 26 Cb -0.07 -1.16 -0.11 0.00 -0.52 0.00 0.00 37.83 35.97 2jt4 s LYS 26 CO 0.07 0.27 1.98 0.43 -0.92 0.00 0.00 175.35 177.18 2jt4 n SER 27 N 1.23 3.17 0.00 2.83 7.64 -1.06 -1.24 113.62 126.19 2jt4 n SER 27 Ca -0.20 0.77 0.00 0.00 1.01 0.00 0.00 58.87 60.45 2jt4 n SER 27 Cb 0.54 -1.37 0.00 0.00 -1.01 0.00 0.00 64.21 62.37 2jt4 n SER 27 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jt4 n GLY 28 N 4.98 0.84 3.70 0.23 0.00 -1.00 -5.00 105.19 108.94 2jt4 n GLY 28 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 2jt4 n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jt4 s ASP 29 N -1.99 6.71 -0.06 1.61 1.01 -0.38 -4.91 116.67 118.67 2jt4 s ASP 29 Ca 0.00 2.38 -0.30 0.00 0.71 0.00 0.00 52.55 55.34 2jt4 s ASP 29 Cb 0.00 -2.57 -0.02 0.00 1.01 0.00 0.00 42.92 41.34 2jt4 s ASP 29 CO 0.00 -0.78 1.02 -0.75 0.21 0.00 0.00 175.17 174.87 2jt4 s LYS 30 N 1.97 4.46 0.09 8.23 2.47 -1.26 -3.31 119.74 132.39 2jt4 s LYS 30 Ca 0.69 1.44 0.06 0.00 -1.56 0.00 0.00 55.97 56.60 2jt4 s LYS 30 Cb -0.38 -3.51 -0.03 0.00 -1.46 0.00 0.00 37.83 32.45 2jt4 s LYS 30 CO 0.30 -0.24 -0.16 0.14 0.16 0.00 0.00 175.35 175.55 2jt4 s VAL 31 N 1.67 1.36 -0.15 4.02 -7.23 -0.77 -0.33 120.40 118.97 2jt4 s VAL 31 Ca 0.51 -1.46 -0.13 0.00 -1.81 0.00 0.00 61.98 59.09 2jt4 s VAL 31 Cb -0.20 -1.31 -0.05 0.00 0.56 0.00 0.00 36.38 35.38 2jt4 s VAL 31 CO 0.22 -0.20 0.29 -0.31 -0.31 0.00 0.00 175.10 174.79 2jt4 s TYR 32 N -1.38 3.48 -0.44 2.82 2.02 0.79 -0.57 117.35 124.08 2jt4 s TYR 32 Ca 0.03 0.61 -0.21 0.00 -0.37 0.00 0.00 57.07 57.12 2jt4 s TYR 32 Cb -0.09 -2.31 0.02 0.00 -0.40 0.00 0.00 41.96 39.18 2jt4 s TYR 32 CO 0.03 0.29 0.66 0.42 -1.57 0.00 0.00 175.55 175.39 2jt4 s ILE 33 N 0.28 4.80 0.00 2.71 1.01 0.21 -0.85 121.20 129.36 2jt4 s ILE 33 Ca 0.17 0.16 0.00 0.00 0.00 0.00 0.00 60.65 60.98 2jt4 s ILE 33 Cb -0.13 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.12 2jt4 s ILE 33 CO 0.04 -0.61 0.00 0.18 0.00 0.00 0.00 174.94 174.55 2jt4 n LEU 34 N 6.33 1.42 -4.24 2.97 4.77 0.11 -4.51 117.00 123.84 2jt4 n LEU 34 Ca -0.01 0.26 -0.30 0.00 -0.03 0.00 0.00 56.01 55.93 2jt4 n LEU 34 Cb 0.48 -0.26 -0.16 0.00 -2.33 0.00 0.00 43.42 41.14 2jt4 n LEU 34 CO 0.54 -0.26 -0.55 -1.81 -1.33 0.00 0.00 177.39 173.98 2jt4 s ASP 35 N -2.06 2.83 0.13 -1.43 1.11 -1.24 -5.00 116.67 111.02 2jt4 s ASP 35 Ca 0.00 -0.46 0.00 0.00 0.18 0.00 0.00 52.55 52.27 2jt4 s ASP 35 Cb 0.00 -0.68 0.00 0.00 1.07 0.00 0.00 42.92 43.31 2jt4 s ASP 35 CO 0.00 0.24 0.00 -0.90 1.18 0.00 0.00 175.17 175.69 2jt4 n ASP 36 N 2.89 0.40 0.08 0.27 5.68 -1.26 -1.83 116.55 122.78 2jt4 n ASP 36 Ca -0.17 0.21 0.20 0.00 -0.50 0.00 0.00 54.79 54.53 2jt4 n ASP 36 Cb 0.52 -0.01 0.75 0.00 -1.14 0.00 0.00 41.12 41.24 2jt4 n ASP 36 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 2jt4 h LYS 37 N 0.00 0.00 0.00 0.11 1.57 -1.99 0.11 116.57 116.37 2jt4 h LYS 37 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2jt4 h LYS 37 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2jt4 h LYS 37 CO 0.00 0.00 0.00 0.87 -0.57 0.00 0.00 179.45 179.75 2jt4 h LYS 38 N 0.00 0.00 -5.50 3.15 1.57 -1.98 -3.44 116.57 110.38 2jt4 h LYS 38 Ca 0.20 0.00 -0.43 0.00 -1.87 0.00 0.00 60.65 58.55 2jt4 h LYS 38 Cb 1.02 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 33.17 2jt4 h LYS 38 CO -0.00 0.00 -0.75 -1.12 -0.57 0.00 0.00 179.45 177.01 2jt4 s SER 39 N -5.60 2.30 0.00 0.86 0.01 0.40 -5.03 113.70 106.63 2jt4 s SER 39 Ca 0.02 -0.93 0.00 0.00 1.31 0.00 0.00 55.95 56.35 2jt4 s SER 39 Cb 0.09 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.22 2jt4 s SER 39 CO 0.54 -0.17 0.47 1.17 0.41 0.00 0.00 173.24 175.67 2jt4 n LYS 40 N 0.02 0.04 0.01 12.44 4.81 -1.26 -4.83 118.16 129.38 2jt4 n LYS 40 Ca -0.11 -0.56 0.00 0.00 -0.87 0.00 0.00 58.31 56.76 2jt4 n LYS 40 Cb 0.59 -0.84 0.00 0.00 0.02 0.00 0.00 35.03 34.80 2jt4 n LYS 40 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2jt4 n ASP 41 N -0.09 0.13 -4.05 3.14 5.68 -1.26 -4.79 116.55 115.32 2jt4 n ASP 41 Ca 0.00 0.04 -0.31 0.00 -0.50 0.00 0.00 54.79 54.02 2jt4 n ASP 41 Cb 0.14 -0.03 -0.16 0.00 -1.14 0.00 0.00 41.12 39.94 2jt4 n ASP 41 CO 0.00 0.00 0.00 0.26 -1.33 0.00 0.00 177.20 176.13 2jt4 s TRP 42 N -2.00 2.48 0.19 2.11 0.52 -1.26 0.23 118.94 121.21 2jt4 s TRP 42 Ca 0.00 -1.50 0.04 0.00 0.02 0.00 0.00 56.10 54.67 2jt4 s TRP 42 Cb 0.00 -1.72 -0.03 0.00 -1.15 0.00 0.00 33.47 30.56 2jt4 s TRP 42 CO 0.00 -0.74 0.26 -1.58 0.02 0.00 0.00 176.95 174.91 2jt4 s TRP 43 N 1.38 3.35 -0.41 -1.98 0.51 0.97 -4.71 118.94 118.07 2jt4 s TRP 43 Ca 0.03 0.02 -0.24 0.00 -2.12 0.00 0.00 56.10 53.79 2jt4 s TRP 43 Cb -0.14 -1.57 0.02 0.00 -0.81 0.00 0.00 33.47 30.97 2jt4 s TRP 43 CO -0.11 0.50 0.81 -1.64 -0.51 0.00 0.00 176.95 176.00 2jt4 s MET 44 N -3.51 3.61 0.07 4.98 -1.94 -0.76 -0.60 119.30 121.15 2jt4 s MET 44 Ca 0.33 0.17 0.06 0.00 -1.71 0.00 0.00 55.69 54.54 2jt4 s MET 44 Cb -0.10 -3.87 -0.03 0.00 2.01 0.00 0.00 34.83 32.84 2jt4 s MET 44 CO 0.27 -1.00 -0.15 0.00 -0.01 0.00 0.00 175.02 174.13 2jt4 s GLN 46 N -1.71 2.59 -0.02 0.00 0.74 -0.03 -1.28 119.66 119.94 2jt4 s GLN 46 Ca -0.01 -0.69 -0.30 0.00 0.05 0.00 0.00 55.36 54.41 2jt4 s GLN 46 Cb -0.10 -2.15 -0.06 0.00 1.10 0.00 0.00 33.01 31.80 2jt4 s GLN 46 CO 0.02 -0.05 1.60 -0.51 -0.55 0.00 0.00 175.29 175.80 2jt4 s LEU 47 N 0.94 4.33 0.47 3.68 1.43 0.29 -0.15 118.68 129.67 2jt4 s LEU 47 Ca -0.06 2.26 0.24 0.00 -1.03 0.00 0.00 54.13 55.54 2jt4 s LEU 47 Cb -0.15 -3.55 1.18 0.00 0.03 0.00 0.00 46.19 43.70 2jt4 s LEU 47 CO -0.02 -0.88 1.97 0.58 0.23 0.00 0.00 176.35 178.23 2jt4 h VAL 48 N 5.27 0.71 0.00 -1.59 2.07 -1.02 0.51 116.25 122.20 2jt4 h VAL 48 Ca -0.39 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.31 2jt4 h VAL 48 Cb 1.18 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.46 2jt4 h VAL 48 CO 0.94 0.19 -0.51 -0.67 0.02 0.00 0.00 177.57 177.54 2jt4 n ASP 49 N -3.68 0.53 0.00 0.57 2.03 -1.26 -4.44 116.55 110.31 2jt4 n ASP 49 Ca -0.01 -0.05 0.00 0.00 0.52 0.00 0.00 54.79 55.24 2jt4 n ASP 49 Cb 0.31 0.16 0.00 0.00 -0.72 0.00 0.00 41.12 40.88 2jt4 n ASP 49 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2jt4 n SER 50 N -1.73 2.89 0.00 1.67 2.88 -1.01 -5.02 113.62 113.29 2jt4 n SER 50 Ca 0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 2jt4 n SER 50 Cb 0.37 0.14 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 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 2.53 0.90 3.75 0.46 0.00 0.18 -5.01 105.19 107.99 2jt4 n GLY 51 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.66 4.63 0.22 1.61 1.02 -1.26 -4.79 119.74 120.52 2jt4 s LYS 52 Ca 0.00 1.27 0.10 0.00 0.02 0.00 0.00 55.97 57.36 2jt4 s LYS 52 Cb 0.00 -3.32 -0.04 0.00 -0.52 0.00 0.00 37.83 33.94 2jt4 s LYS 52 CO 0.00 0.39 -0.10 -1.54 -0.92 0.00 0.00 175.35 173.18 2jt4 s SER 53 N -0.55 4.16 0.00 2.83 1.04 -1.26 -0.55 113.70 119.37 2jt4 s SER 53 Ca 0.40 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 56.15 2jt4 s SER 53 Cb -0.23 -0.65 0.00 0.00 0.10 0.00 0.00 66.02 65.24 2jt4 s SER 53 CO 0.27 0.07 0.00 0.61 0.98 0.00 0.00 173.24 175.17 2jt4 n GLY 54 N -0.26 -1.39 3.67 7.32 0.00 -0.40 -4.91 105.19 109.23 2jt4 n GLY 54 Ca -0.09 -1.00 -0.40 0.00 0.00 0.00 0.00 46.02 44.53 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 4.17 0.15 0.99 2.01 0.87 -1.55 118.68 125.32 2jt4 s LEU 55 Ca 0.00 0.99 0.09 0.00 0.01 0.00 0.00 54.13 55.21 2jt4 s LEU 55 Cb 0.00 -3.02 -0.04 0.00 0.01 0.00 0.00 46.19 43.14 2jt4 s LEU 55 CO 0.00 -0.29 -0.19 0.68 1.01 0.00 0.00 176.35 177.55 2jt4 s VAL 56 N 1.85 1.81 -0.19 -1.59 -7.23 0.23 -1.22 120.40 114.06 2jt4 s VAL 56 Ca 0.33 -1.83 -0.33 0.00 -1.81 0.00 0.00 61.98 58.33 2jt4 s VAL 56 Cb -0.16 -1.79 -0.10 0.00 0.56 0.00 0.00 36.38 34.89 2jt4 s VAL 56 CO 0.12 -0.25 2.03 -2.65 -0.31 0.00 0.00 175.10 174.04 2jt4 n PRO 57 N 0.48 1.82 -0.32 4.82 -0.02 -1.26 -0.02 135.00 140.51 2jt4 n PRO 57 Ca -0.15 0.60 0.08 0.00 -2.02 0.00 0.00 63.50 62.02 2jt4 n PRO 57 Cb 0.56 -2.71 0.29 0.00 -0.02 0.00 0.00 33.50 31.62 2jt4 n PRO 57 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jt4 h ALA 58 N 11.25 1.63 0.00 3.55 0.00 -0.52 0.07 119.26 135.23 2jt4 h ALA 58 Ca -0.41 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2jt4 h ALA 58 Cb 1.28 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2jt4 h ALA 58 CO 0.97 0.15 0.00 0.94 0.00 0.00 0.00 179.25 181.31 2jt4 n GLN 59 N -4.58 0.09 0.00 0.00 7.27 -1.26 -2.18 117.38 116.73 2jt4 n GLN 59 Ca 0.17 0.33 0.11 0.00 0.07 0.00 0.00 57.00 57.69 2jt4 n GLN 59 Cb 0.36 -1.67 0.12 0.00 2.41 0.00 0.00 30.24 31.47 2jt4 n GLN 59 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 2jt4 n PHE 60 N -1.85 0.00 -4.00 3.69 3.01 0.01 -4.89 117.46 113.43 2jt4 n PHE 60 Ca 0.03 0.00 -0.36 0.00 1.01 0.00 0.00 57.45 58.13 2jt4 n PHE 60 Cb 0.20 -0.12 -0.08 0.00 -0.01 0.00 0.00 39.48 39.48 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 -2.84 5.09 -0.30 4.37 -1.09 -0.93 -0.69 121.20 124.81 2jt4 s ILE 61 Ca 0.14 0.06 0.00 0.00 -2.23 0.00 0.00 60.65 58.62 2jt4 s ILE 61 Cb 0.17 -3.23 0.06 0.00 -1.58 0.00 0.00 42.46 37.89 2jt4 s ILE 61 CO 0.70 0.57 -0.02 -0.70 -1.23 0.00 0.00 174.94 174.27 2jt4 s GLU 62 N -0.61 2.23 -0.22 2.79 2.56 0.15 -4.96 118.70 120.64 2jt4 s GLU 62 Ca 0.12 -1.40 -0.29 0.00 0.00 0.00 0.00 54.97 53.40 2jt4 s GLU 62 Cb -0.12 -3.11 -0.02 0.00 2.00 0.00 0.00 34.13 32.88 2jt4 s GLU 62 CO 0.02 -0.67 1.54 -2.14 -0.56 0.00 0.00 175.26 173.45 2jt4 s PRO 63 N 1.16 3.86 0.00 4.30 0.02 -1.26 -1.19 135.00 141.88 2jt4 s PRO 63 Ca -0.04 1.61 0.22 0.00 0.02 0.00 0.00 61.00 62.81 2jt4 s PRO 63 Cb -0.20 -3.99 -0.03 0.00 0.02 0.00 0.00 34.50 30.30 2jt4 s PRO 63 CO -0.03 -1.21 1.04 1.55 -0.33 0.00 0.00 177.00 178.02 2jt4 n VAL 64 N 6.27 0.00 0.28 3.83 3.14 -1.06 -2.67 118.33 128.12 2jt4 n VAL 64 Ca 0.18 -0.03 0.15 0.00 -2.96 0.00 0.00 64.34 61.67 2jt4 n VAL 64 Cb 0.45 0.86 0.73 0.00 -1.06 0.00 0.00 33.84 34.82 2jt4 n VAL 64 CO 0.00 0.00 0.00 0.08 -6.46 0.00 0.00 176.83 170.45 2jt4 h ARG 65 N 0.30 0.00 0.00 1.45 -0.00 -1.85 -3.35 114.38 110.92 2jt4 h ARG 65 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2jt4 h ARG 65 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.50 2jt4 h ARG 65 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 179.97 176.50 2jt4 n ASP 66 N -2.58 0.00 -0.25 0.08 -0.08 -1.26 -4.98 116.55 107.48 2jt4 n ASP 66 Ca -0.01 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.30 2jt4 n ASP 66 Cb 0.14 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.58 2jt4 n ASP 66 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2jt4 n LYS 67 N 0.00 -0.57 -2.69 -0.67 5.02 -1.09 -4.93 118.16 113.23 2jt4 n LYS 67 Ca 0.00 0.47 -0.33 0.00 -2.02 0.00 0.00 58.31 56.43 2jt4 n LYS 67 Cb 0.00 -0.67 -0.05 0.00 -0.02 0.00 0.00 35.03 34.28 2jt4 n LYS 67 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2jt4 s LYS 68 N -3.11 4.09 0.00 1.97 1.02 -1.26 -5.00 119.74 117.45 2jt4 s LYS 68 Ca 0.00 1.00 0.00 0.00 0.02 0.00 0.00 55.97 56.99 2jt4 s LYS 68 Cb 0.00 -2.19 0.00 0.00 -0.52 0.00 0.00 37.83 35.12 2jt4 s LYS 68 CO 0.00 -0.10 0.00 0.72 -0.92 0.00 0.00 175.35 175.05 2jt4 n HIS 69 N -0.99 0.00 -3.59 3.18 8.25 -1.26 -5.00 115.22 115.80 2jt4 n HIS 69 Ca 0.06 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.12 2jt4 n HIS 69 Cb 0.54 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.58 2jt4 n HIS 69 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2jt4 s THR 70 N 0.00 4.31 -2.81 1.59 2.01 -1.26 -5.34 115.64 114.14 2jt4 s THR 70 Ca 0.00 -2.73 0.26 0.00 0.31 0.00 0.00 61.69 59.52 2jt4 s THR 70 Cb 0.00 -3.76 0.33 0.00 0.01 0.00 0.00 72.50 69.08 2jt4 s THR 70 CO 0.00 -0.92 1.45 -0.62 -0.69 0.00 0.00 174.62 173.84