#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dj4 s SER 2 N 0.00 -0.12 -0.24 1.61 0.01 -1.26 -5.15 113.70 108.56 2dj4 s SER 2 Ca 0.00 -0.63 -0.13 0.00 1.31 0.00 0.00 55.95 56.49 2dj4 s SER 2 Cb 0.00 0.50 -0.04 0.00 0.21 0.00 0.00 66.02 66.69 2dj4 s SER 2 CO 0.00 -0.96 0.29 -0.55 0.41 0.00 0.00 173.24 172.43 2dj4 s SER 3 N -2.91 6.25 0.08 2.44 0.15 -1.26 -4.94 113.70 113.51 2dj4 s SER 3 Ca 0.12 0.28 0.00 0.00 0.70 0.00 0.00 55.95 57.04 2dj4 s SER 3 Cb 0.01 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 62.15 2dj4 s SER 3 CO -0.03 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 174.97 2dj4 n GLY 4 N 4.32 -2.83 3.80 9.45 0.00 -1.26 -4.94 105.19 113.74 2dj4 n GLY 4 Ca -0.11 -1.33 -0.37 0.00 0.00 0.00 0.00 46.02 44.21 2dj4 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dj4 s SER 5 N -3.94 6.59 0.40 1.61 0.15 -1.26 -5.09 113.70 112.16 2dj4 s SER 5 Ca 0.00 0.70 0.01 0.00 0.70 0.00 0.00 55.95 57.37 2dj4 s SER 5 Cb 0.00 -2.20 -0.01 0.00 -1.71 0.00 0.00 66.02 62.10 2dj4 s SER 5 CO 0.00 0.24 0.60 -0.94 1.20 0.00 0.00 173.24 174.34 2dj4 s SER 6 N -0.42 6.01 -0.45 5.45 1.04 -1.26 -5.08 113.70 119.00 2dj4 s SER 6 Ca 0.20 0.28 0.06 0.00 0.48 0.00 0.00 55.95 56.97 2dj4 s SER 6 Cb -0.14 -1.67 0.22 0.00 0.10 0.00 0.00 66.02 64.53 2dj4 s SER 6 CO 0.08 -0.52 0.65 0.61 0.98 0.00 0.00 173.24 175.04 2dj4 n GLY 7 N -1.91 1.09 3.23 7.32 0.00 -1.26 -5.13 105.19 108.53 2dj4 n GLY 7 Ca -0.01 -0.54 -0.27 0.00 0.00 0.00 0.00 46.02 45.20 2dj4 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dj4 s VAL 8 N 0.09 1.63 -0.13 1.61 0.11 -1.26 -5.13 120.40 117.31 2dj4 s VAL 8 Ca 0.33 -0.97 -0.03 0.00 -2.93 0.00 0.00 61.98 58.37 2dj4 s VAL 8 Cb 0.13 -1.37 -0.03 0.00 -1.53 0.00 0.00 36.38 33.57 2dj4 s VAL 8 CO -0.16 0.38 -0.01 -0.69 -3.33 0.00 0.00 175.10 171.30 2dj4 s VAL 9 N -0.57 4.17 -0.35 2.04 1.01 -1.26 -4.75 120.40 120.69 2dj4 s VAL 9 Ca 0.08 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.79 2dj4 s VAL 9 Cb -0.08 -2.81 0.11 0.00 0.00 0.00 0.00 36.38 33.60 2dj4 s VAL 9 CO -0.00 0.53 0.14 -1.81 0.00 0.00 0.00 175.10 173.96 2dj4 s ASP 10 N -0.10 3.95 0.00 3.32 1.11 0.59 -4.97 116.67 120.57 2dj4 s ASP 10 Ca 0.04 -2.00 0.15 0.00 0.18 0.00 0.00 52.55 50.92 2dj4 s ASP 10 Cb -0.13 -0.96 0.90 0.00 1.07 0.00 0.00 42.92 43.80 2dj4 s ASP 10 CO 0.02 -0.36 1.32 -0.81 1.18 0.00 0.00 175.17 176.52 2dj4 n PRO 11 N 4.38 0.49 0.00 8.23 -0.04 -1.26 -1.89 135.00 144.90 2dj4 n PRO 11 Ca 0.02 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.59 2dj4 n PRO 11 Cb 0.40 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 2dj4 n PRO 11 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dj4 n SER 12 N -0.99 1.45 -0.33 3.54 7.64 -1.26 -4.03 113.62 119.65 2dj4 n SER 12 Ca 0.11 -1.18 0.12 0.00 1.01 0.00 0.00 58.87 58.93 2dj4 n SER 12 Cb 0.05 0.63 0.22 0.00 -1.01 0.00 0.00 64.21 64.10 2dj4 n SER 12 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2dj4 n LYS 13 N -0.73 0.94 -3.30 1.43 4.76 -0.79 -4.89 118.16 115.58 2dj4 n LYS 13 Ca 0.07 -0.67 -0.38 0.00 -2.87 0.00 0.00 58.31 54.46 2dj4 n LYS 13 Cb 0.40 -1.49 -0.06 0.00 -1.84 0.00 0.00 35.03 32.04 2dj4 n LYS 13 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2dj4 s VAL 14 N -2.51 4.96 0.25 -0.18 0.11 -1.26 -4.31 120.40 117.46 2dj4 s VAL 14 Ca 0.21 1.10 0.02 0.00 -2.93 0.00 0.00 61.98 60.38 2dj4 s VAL 14 Cb 0.19 -3.86 -0.05 0.00 -1.53 0.00 0.00 36.38 31.13 2dj4 s VAL 14 CO 0.55 0.45 0.07 -0.54 -3.33 0.00 0.00 175.10 172.31 2dj4 s LYS 15 N -0.35 1.40 -0.04 1.54 1.02 -0.19 -4.90 119.74 118.23 2dj4 s LYS 15 Ca 0.28 -1.75 -0.04 0.00 0.02 0.00 0.00 55.97 54.49 2dj4 s LYS 15 Cb -0.17 -0.37 0.01 0.00 -0.52 0.00 0.00 37.83 36.78 2dj4 s LYS 15 CO 0.15 -0.24 0.11 0.96 -0.92 0.00 0.00 175.35 175.40 2dj4 s ILE 16 N -3.66 -0.00 0.03 2.17 -4.36 -1.26 -0.13 121.20 113.99 2dj4 s ILE 16 Ca 0.35 0.01 -0.04 0.00 -0.26 0.00 0.00 60.65 60.71 2dj4 s ILE 16 Cb 0.08 -0.16 -0.01 0.00 1.25 0.00 0.00 42.46 43.61 2dj4 s ILE 16 CO 0.12 0.00 0.06 0.00 0.24 0.00 0.00 174.94 175.37 2dj4 s ALA 17 N 0.12 -0.01 0.00 2.27 0.00 -0.33 -4.99 121.76 118.83 2dj4 s ALA 17 Ca -0.01 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.39 2dj4 s ALA 17 Cb -0.01 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.32 2dj4 s ALA 17 CO -0.00 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 175.89 2dj4 n GLY 18 N 0.97 2.32 0.17 0.00 0.00 -1.26 -0.26 105.19 107.12 2dj4 n GLY 18 Ca -0.20 -1.51 0.02 0.00 0.00 0.00 0.00 46.02 44.34 2dj4 n GLY 18 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dj4 h PRO 19 N 0.00 0.00 -0.02 1.61 0.13 -1.95 -2.49 132.00 129.28 2dj4 h PRO 19 Ca 0.00 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.14 2dj4 h PRO 19 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2dj4 h PRO 19 CO 0.00 0.45 0.02 0.78 -0.23 0.00 0.00 178.00 179.01 2dj4 h GLY 20 N 1.51 0.00 0.30 1.56 0.00 -1.88 -2.40 103.07 102.15 2dj4 h GLY 20 Ca -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.10 2dj4 h GLY 20 CO 0.06 0.00 -2.01 1.04 0.00 0.00 0.00 176.54 175.63 2dj4 n LEU 21 N -4.45 0.26 -4.39 3.11 4.77 -1.14 -4.90 117.00 110.27 2dj4 n LEU 21 Ca -0.03 0.12 -0.31 0.00 -0.03 0.00 0.00 56.01 55.77 2dj4 n LEU 21 Cb 0.11 0.25 0.21 0.00 -2.33 0.00 0.00 43.42 41.66 2dj4 n LEU 21 CO 0.33 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 2dj4 n GLY 22 N 1.53 -2.17 0.70 -0.72 0.00 -0.90 -4.80 105.19 98.82 2dj4 n GLY 22 Ca -0.19 -0.96 0.01 0.00 0.00 0.00 0.00 46.02 44.89 2dj4 n GLY 22 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dj4 n SER 23 N -3.23 1.75 -2.09 1.61 3.41 -1.26 -3.89 113.62 109.92 2dj4 n SER 23 Ca 0.03 -2.15 -0.25 0.00 -0.26 0.00 0.00 58.87 56.23 2dj4 n SER 23 Cb 0.58 -0.47 0.02 0.00 -0.26 0.00 0.00 64.21 64.08 2dj4 n SER 23 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dj4 n GLY 24 N 0.21 6.33 3.87 5.00 0.00 -1.26 -4.98 105.19 114.36 2dj4 n GLY 24 Ca 0.05 -2.65 -0.33 0.00 0.00 0.00 0.00 46.02 43.09 2dj4 n GLY 24 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dj4 s VAL 25 N -4.69 5.03 0.21 1.61 1.01 -1.25 -5.00 120.40 117.31 2dj4 s VAL 25 Ca 0.52 0.42 0.10 0.00 0.00 0.00 0.00 61.98 63.02 2dj4 s VAL 25 Cb 0.42 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 33.11 2dj4 s VAL 25 CO 0.02 0.13 -0.19 -0.13 0.00 0.00 0.00 175.10 174.93 2dj4 s ARG 26 N -2.32 1.44 0.47 2.72 0.52 -1.26 0.04 118.95 120.56 2dj4 s ARG 26 Ca 0.39 -1.56 -0.21 0.00 -0.52 0.00 0.00 55.73 53.83 2dj4 s ARG 26 Cb -0.13 -1.50 -0.09 0.00 0.52 0.00 0.00 34.95 33.75 2dj4 s ARG 26 CO 0.20 0.29 1.03 0.00 0.02 0.00 0.00 175.30 176.85 2dj4 s ALA 27 N -2.29 2.91 -1.27 2.13 0.00 0.13 -3.35 121.76 120.02 2dj4 s ALA 27 Ca 0.22 0.61 -0.00 0.00 0.00 0.00 0.00 51.96 52.78 2dj4 s ALA 27 Cb -0.05 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.82 2dj4 s ALA 27 CO 0.09 -0.27 0.03 0.54 0.00 0.00 0.00 175.76 176.16 2dj4 n ARG 28 N -0.82 -2.17 -4.90 0.00 1.74 0.63 -4.44 116.66 106.70 2dj4 n ARG 28 Ca 0.09 0.72 -0.30 0.00 -0.77 0.00 0.00 57.85 57.58 2dj4 n ARG 28 Cb 0.52 -5.34 -0.15 0.00 -1.02 0.00 0.00 32.46 26.47 2dj4 n ARG 28 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2dj4 s VAL 29 N -2.75 2.15 -0.32 1.55 1.01 -1.21 -4.99 120.40 115.83 2dj4 s VAL 29 Ca 0.02 -1.40 -0.28 0.00 0.00 0.00 0.00 61.98 60.31 2dj4 s VAL 29 Cb -0.01 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.52 2dj4 s VAL 29 CO 0.02 0.36 1.80 -0.22 0.00 0.00 0.00 175.10 177.06 2dj4 s LEU 30 N -1.26 3.52 -0.16 3.92 2.96 -1.26 -4.22 118.68 122.18 2dj4 s LEU 30 Ca 0.12 1.34 -0.01 0.00 -0.22 0.00 0.00 54.13 55.36 2dj4 s LEU 30 Cb -0.10 -3.53 -0.01 0.00 0.50 0.00 0.00 46.19 43.05 2dj4 s LEU 30 CO 0.02 -1.69 -0.10 -1.10 -1.32 0.00 0.00 176.35 172.16 2dj4 s GLN 31 N 5.62 3.40 0.02 1.98 -1.52 0.87 -4.98 119.66 125.04 2dj4 s GLN 31 Ca 0.80 -0.66 -0.05 0.00 -1.95 0.00 0.00 55.36 53.50 2dj4 s GLN 31 Cb -0.23 -2.75 -0.01 0.00 -0.22 0.00 0.00 33.01 29.80 2dj4 s GLN 31 CO 0.34 0.09 0.08 0.45 -0.25 0.00 0.00 175.29 176.00 2dj4 s SER 32 N 0.68 0.15 0.23 5.90 0.15 -1.26 -0.18 113.70 119.38 2dj4 s SER 32 Ca -0.05 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.16 2dj4 s SER 32 Cb -0.15 0.19 -0.00 0.00 -1.71 0.00 0.00 66.02 64.35 2dj4 s SER 32 CO 0.02 -0.43 0.29 2.22 1.20 0.00 0.00 173.24 176.55 2dj4 n PHE 33 N 1.12 -0.97 -5.11 3.44 -1.74 -1.09 -3.16 117.46 109.95 2dj4 n PHE 33 Ca -0.21 -1.66 -0.29 0.00 -0.56 0.00 0.00 57.45 54.73 2dj4 n PHE 33 Cb 0.57 0.33 -0.16 0.00 1.52 0.00 0.00 39.48 41.73 2dj4 n PHE 33 CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 2dj4 s THR 34 N -2.74 1.82 -0.32 1.97 2.01 0.64 -2.76 115.64 116.25 2dj4 s THR 34 Ca 0.21 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 61.24 2dj4 s THR 34 Cb -0.00 -1.55 0.05 0.00 0.01 0.00 0.00 72.50 71.02 2dj4 s THR 34 CO 0.15 0.51 0.05 -0.69 -0.69 0.00 0.00 174.62 173.96 2dj4 s VAL 35 N -0.11 3.23 -0.55 3.82 1.01 0.27 -1.18 120.40 126.89 2dj4 s VAL 35 Ca -0.03 -1.40 -0.21 0.00 0.00 0.00 0.00 61.98 60.34 2dj4 s VAL 35 Cb -0.13 -2.90 0.06 0.00 0.00 0.00 0.00 36.38 33.42 2dj4 s VAL 35 CO 0.03 -0.20 0.76 -0.62 0.00 0.00 0.00 175.10 175.08 2dj4 s ASP 36 N 1.36 6.24 -0.20 3.32 2.15 0.82 -0.78 116.67 129.58 2dj4 s ASP 36 Ca -0.03 -0.86 0.12 0.00 0.43 0.00 0.00 52.55 52.22 2dj4 s ASP 36 Cb -0.20 -2.35 0.42 0.00 -0.30 0.00 0.00 42.92 40.50 2dj4 s ASP 36 CO -0.00 -1.08 1.22 -1.54 -0.17 0.00 0.00 175.17 173.59 2dj4 n SER 37 N 6.73 1.72 0.02 -0.34 3.41 -1.21 -1.02 113.62 122.92 2dj4 n SER 37 Ca -0.05 -3.77 -0.12 0.00 -0.26 0.00 0.00 58.87 54.67 2dj4 n SER 37 Cb 0.45 -0.51 0.01 0.00 -0.26 0.00 0.00 64.21 63.90 2dj4 n SER 37 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2dj4 h SER 38 N 1.02 0.64 1.69 4.04 0.87 -1.84 -3.02 113.55 116.95 2dj4 h SER 38 Ca -0.01 -0.40 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 2dj4 h SER 38 Cb 1.07 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 2dj4 h SER 38 CO 0.02 1.16 0.00 0.11 -0.53 0.00 0.00 176.83 177.59 2dj4 h LYS 39 N 0.38 0.00 -0.10 2.24 1.79 -1.85 -3.24 116.57 115.78 2dj4 h LYS 39 Ca -0.03 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.22 2dj4 h LYS 39 Cb 1.29 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.95 2dj4 h LYS 39 CO 0.13 0.00 -0.83 0.00 -1.08 0.00 0.00 179.45 177.67 2dj4 h ALA 40 N 2.30 0.34 0.00 3.86 0.00 -1.68 -3.43 119.26 120.65 2dj4 h ALA 40 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2dj4 h ALA 40 Cb 0.85 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2dj4 h ALA 40 CO 0.00 0.71 0.00 0.41 0.00 0.00 0.00 179.25 180.37 2dj4 n GLY 41 N 0.76 0.38 0.12 0.00 0.00 -1.18 -0.30 105.19 104.98 2dj4 n GLY 41 Ca -0.07 -1.36 0.09 0.00 0.00 0.00 0.00 46.02 44.68 2dj4 n GLY 41 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2dj4 n LEU 42 N 0.00 2.43 -4.81 0.99 -0.00 -1.26 -4.71 117.00 109.64 2dj4 n LEU 42 Ca 0.00 -2.97 -0.33 0.00 -0.00 0.00 0.00 56.01 52.71 2dj4 n LEU 42 Cb 0.00 -0.39 -0.03 0.00 -0.00 0.00 0.00 43.42 43.00 2dj4 n LEU 42 CO 0.00 0.69 0.70 0.00 -0.00 0.00 0.00 177.39 178.78 2dj4 s ALA 43 N -2.67 2.90 0.93 1.47 0.00 -1.26 -5.04 121.76 118.08 2dj4 s ALA 43 Ca 0.29 0.45 -0.12 0.00 0.00 0.00 0.00 51.96 52.59 2dj4 s ALA 43 Cb 0.25 -3.21 0.15 0.00 0.00 0.00 0.00 23.12 20.31 2dj4 s ALA 43 CO 0.03 -0.36 1.09 -1.25 0.00 0.00 0.00 175.76 175.28 2dj4 s PRO 44 N -3.57 0.95 -0.05 0.00 0.04 -1.26 -4.84 135.00 126.28 2dj4 s PRO 44 Ca 0.64 0.71 0.04 0.00 0.04 0.00 0.00 61.00 62.43 2dj4 s PRO 44 Cb -0.14 -1.78 -0.00 0.00 0.04 0.00 0.00 34.50 32.62 2dj4 s PRO 44 CO 0.25 -2.42 -0.17 -1.17 0.04 0.00 0.00 177.00 173.53 2dj4 s LEU 45 N -6.31 1.89 0.09 -3.56 2.96 -1.26 -3.09 118.68 109.41 2dj4 s LEU 45 Ca 0.64 -0.35 0.10 0.00 -0.22 0.00 0.00 54.13 54.29 2dj4 s LEU 45 Cb -0.18 -0.97 -0.04 0.00 0.50 0.00 0.00 46.19 45.50 2dj4 s LEU 45 CO 0.57 0.14 -0.25 -0.70 -1.32 0.00 0.00 176.35 174.79 2dj4 s GLU 46 N 0.12 1.63 0.03 1.98 2.12 -0.73 -4.97 118.70 118.89 2dj4 s GLU 46 Ca -0.06 -1.22 0.01 0.00 0.36 0.00 0.00 54.97 54.07 2dj4 s GLU 46 Cb -0.12 -1.97 -0.02 0.00 0.26 0.00 0.00 34.13 32.28 2dj4 s GLU 46 CO 0.03 0.48 -0.06 0.08 -0.54 0.00 0.00 175.26 175.25 2dj4 s VAL 47 N -0.96 0.40 -0.17 3.70 1.01 -1.26 -1.06 120.40 122.06 2dj4 s VAL 47 Ca 0.14 -1.00 -0.14 0.00 0.00 0.00 0.00 61.98 60.97 2dj4 s VAL 47 Cb -0.10 -0.49 0.05 0.00 0.00 0.00 0.00 36.38 35.84 2dj4 s VAL 47 CO 0.05 -0.41 0.44 -0.13 0.00 0.00 0.00 175.10 175.05 2dj4 s ARG 48 N -1.51 0.48 -0.13 2.72 0.52 0.82 -4.86 118.95 116.99 2dj4 s ARG 48 Ca -0.12 0.68 0.02 0.00 -0.52 0.00 0.00 55.73 55.80 2dj4 s ARG 48 Cb -0.10 0.17 0.01 0.00 0.52 0.00 0.00 34.95 35.55 2dj4 s ARG 48 CO -0.00 -0.09 -0.21 0.08 0.02 0.00 0.00 175.30 175.09 2dj4 s VAL 49 N 0.61 2.15 -0.13 3.52 1.01 -1.25 0.89 120.40 127.20 2dj4 s VAL 49 Ca -0.03 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.01 2dj4 s VAL 49 Cb -0.05 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.49 2dj4 s VAL 49 CO -0.04 0.55 -0.16 -0.76 0.00 0.00 0.00 175.10 174.68 2dj4 s LEU 50 N 0.71 1.81 0.00 3.92 2.01 0.31 -2.53 118.68 124.91 2dj4 s LEU 50 Ca -0.09 -0.50 -0.23 0.00 0.01 0.00 0.00 54.13 53.32 2dj4 s LEU 50 Cb -0.16 -1.22 0.36 0.00 0.01 0.00 0.00 46.19 45.18 2dj4 s LEU 50 CO 0.01 -0.00 0.81 0.61 1.01 0.00 0.00 176.35 178.78 2dj4 n GLY 51 N 4.42 -3.89 0.10 -3.19 0.00 0.76 -1.71 105.19 101.68 2dj4 n GLY 51 Ca -0.19 -1.26 -0.13 0.00 0.00 0.00 0.00 46.02 44.44 2dj4 n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dj4 h PRO 52 N 0.00 0.20 -0.04 1.61 0.13 -1.89 -3.29 132.00 128.72 2dj4 h PRO 52 Ca -0.37 -0.10 -0.23 0.00 -0.87 0.00 0.00 66.00 64.43 2dj4 h PRO 52 Cb 1.24 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.38 2dj4 h PRO 52 CO 0.22 0.63 -0.91 0.00 -0.23 0.00 0.00 178.00 177.71 2dj4 h ARG 53 N -0.23 0.54 0.00 0.86 -0.00 -1.92 -3.47 114.38 110.16 2dj4 h ARG 53 Ca 0.01 -0.53 0.00 0.00 -0.50 0.00 0.00 59.98 58.96 2dj4 h ARG 53 Cb 0.59 0.14 0.00 0.00 0.00 0.00 0.00 29.97 30.70 2dj4 h ARG 53 CO 0.02 1.16 0.00 0.41 0.00 0.00 0.00 179.97 181.56 2dj4 n GLY 54 N 0.88 0.00 3.83 0.04 0.00 -1.24 -5.15 105.19 103.55 2dj4 n GLY 54 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 2dj4 n GLY 54 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dj4 s LEU 55 N 0.00 4.16 -0.19 0.99 2.96 -1.26 -4.80 118.68 120.54 2dj4 s LEU 55 Ca 0.00 1.36 -0.05 0.00 -0.22 0.00 0.00 54.13 55.22 2dj4 s LEU 55 Cb 0.00 -3.93 -0.03 0.00 0.50 0.00 0.00 46.19 42.73 2dj4 s LEU 55 CO 0.00 -0.13 0.01 -0.69 -1.32 0.00 0.00 176.35 174.22 2dj4 s VAL 56 N -1.82 4.07 -0.01 1.68 1.01 -1.26 -0.17 120.40 123.89 2dj4 s VAL 56 Ca 0.51 -0.28 0.05 0.00 0.00 0.00 0.00 61.98 62.26 2dj4 s VAL 56 Cb -0.13 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.41 2dj4 s VAL 56 CO 0.19 0.44 -0.16 -1.61 0.00 0.00 0.00 175.10 173.96 2dj4 s GLU 57 N 0.84 1.26 0.98 2.72 0.41 -1.05 -5.01 118.70 118.85 2dj4 s GLU 57 Ca 0.01 -0.58 -0.12 0.00 -0.41 0.00 0.00 54.97 53.87 2dj4 s GLU 57 Cb -0.14 -1.23 0.18 0.00 -1.78 0.00 0.00 34.13 31.16 2dj4 s GLU 57 CO 0.02 0.34 1.09 -1.25 -0.49 0.00 0.00 175.26 174.97 2dj4 s PRO 58 N -0.42 0.56 0.02 0.39 0.04 -1.26 -3.84 135.00 130.49 2dj4 s PRO 58 Ca 0.06 0.57 0.00 0.00 0.04 0.00 0.00 61.00 61.67 2dj4 s PRO 58 Cb -0.06 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 32.71 2dj4 s PRO 58 CO -0.00 -2.66 -0.03 0.08 0.04 0.00 0.00 177.00 174.43 2dj4 s VAL 59 N -2.96 0.11 -0.10 -0.36 1.01 -1.26 -4.85 120.40 111.99 2dj4 s VAL 59 Ca 0.65 -0.85 -0.09 0.00 0.00 0.00 0.00 61.98 61.69 2dj4 s VAL 59 Cb -0.18 -0.25 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 2dj4 s VAL 59 CO 0.57 -0.46 0.19 0.21 0.00 0.00 0.00 175.10 175.61 2dj4 s ASN 60 N -1.36 6.46 -0.08 3.32 2.47 -0.94 -5.01 114.94 119.80 2dj4 s ASN 60 Ca -0.15 0.55 0.00 0.00 0.42 0.00 0.00 52.86 53.68 2dj4 s ASN 60 Cb -0.09 -2.11 0.02 0.00 -1.45 0.00 0.00 41.25 37.62 2dj4 s ASN 60 CO -0.01 0.37 -0.06 0.54 -3.72 0.00 0.00 177.10 174.23 2dj4 s VAL 61 N -0.92 0.77 -0.04 -5.21 0.11 -1.26 -3.43 120.40 110.42 2dj4 s VAL 61 Ca 0.16 -0.18 -0.01 0.00 -2.93 0.00 0.00 61.98 59.02 2dj4 s VAL 61 Cb -0.13 -0.81 0.03 0.00 -1.53 0.00 0.00 36.38 33.94 2dj4 s VAL 61 CO 0.05 0.31 0.07 -0.69 -3.33 0.00 0.00 175.10 171.52 2dj4 s VAL 62 N 1.46 -0.06 -0.02 2.04 1.01 -0.33 -5.00 120.40 119.50 2dj4 s VAL 62 Ca -0.01 0.22 -0.24 0.00 0.00 0.00 0.00 61.98 61.95 2dj4 s VAL 62 Cb -0.13 -0.14 -0.04 0.00 0.00 0.00 0.00 36.38 36.06 2dj4 s VAL 62 CO -0.04 0.09 0.71 -0.62 0.00 0.00 0.00 175.10 175.24 2dj4 s ASP 63 N 1.18 7.06 -0.03 3.32 -1.08 -1.26 0.53 116.67 126.39 2dj4 s ASP 63 Ca -0.08 1.27 -0.24 0.00 -0.52 0.00 0.00 52.55 52.98 2dj4 s ASP 63 Cb -0.12 -2.43 -0.21 0.00 -1.46 0.00 0.00 42.92 38.70 2dj4 s ASP 63 CO -0.04 -0.05 1.14 0.78 0.52 0.00 0.00 175.17 177.52 2dj4 h ASN 64 N 6.27 0.19 0.00 -0.34 2.35 -1.70 -3.47 115.58 118.88 2dj4 h ASN 64 Ca -0.42 -0.65 0.00 0.00 -0.55 0.00 0.00 56.30 54.67 2dj4 h ASN 64 Cb 1.20 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.52 2dj4 h ASN 64 CO 0.73 0.81 0.00 0.61 -1.65 0.00 0.00 177.43 177.93 2dj4 n GLY 65 N 0.69 2.19 0.13 2.83 0.00 -1.26 -4.94 105.19 104.82 2dj4 n GLY 65 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 2dj4 n GLY 65 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dj4 n ASP 66 N 0.00 2.02 0.00 1.61 8.00 -1.26 -4.95 116.55 121.98 2dj4 n ASP 66 Ca 0.00 0.29 0.00 0.00 0.71 0.00 0.00 54.79 55.79 2dj4 n ASP 66 Cb 0.00 -0.90 0.00 0.00 -0.02 0.00 0.00 41.12 40.20 2dj4 n ASP 66 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dj4 n GLY 67 N 1.77 0.00 3.57 0.44 0.00 -1.26 -5.03 105.19 104.68 2dj4 n GLY 67 Ca -0.33 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.56 2dj4 n GLY 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dj4 s THR 68 N 0.00 0.00 -0.10 2.61 -4.23 -1.26 -3.34 115.64 109.31 2dj4 s THR 68 Ca 0.00 -1.45 -0.06 0.00 -1.18 0.00 0.00 61.69 59.00 2dj4 s THR 68 Cb 0.00 -2.65 0.04 0.00 1.34 0.00 0.00 72.50 71.23 2dj4 s THR 68 CO 0.00 0.00 0.25 -1.00 -0.54 0.00 0.00 174.62 173.33 2dj4 s HIS 69 N -2.98 -0.33 0.03 3.99 0.09 0.04 -1.69 115.29 114.44 2dj4 s HIS 69 Ca 0.26 0.78 -0.19 0.00 -0.00 0.00 0.00 55.06 55.92 2dj4 s HIS 69 Cb -0.01 0.05 -0.06 0.00 -0.00 0.00 0.00 32.58 32.56 2dj4 s HIS 69 CO 0.17 -0.22 0.53 0.99 -0.00 0.00 0.00 174.74 176.21 2dj4 s THR 70 N 1.14 4.86 -0.21 1.30 2.01 0.19 -0.57 115.64 124.36 2dj4 s THR 70 Ca -0.08 1.13 -0.01 0.00 0.31 0.00 0.00 61.69 63.03 2dj4 s THR 70 Cb -0.09 -3.86 0.06 0.00 0.01 0.00 0.00 72.50 68.61 2dj4 s THR 70 CO -0.08 0.52 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.67 2dj4 s VAL 71 N -0.82 1.00 -0.02 3.82 1.01 -1.11 -1.18 120.40 123.09 2dj4 s VAL 71 Ca 0.28 -0.85 -0.03 0.00 0.00 0.00 0.00 61.98 61.39 2dj4 s VAL 71 Cb -0.18 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 2dj4 s VAL 71 CO 0.17 -0.14 0.15 0.42 0.00 0.00 0.00 175.10 175.70 2dj4 s THR 72 N 1.64 5.28 0.17 3.92 -4.23 -1.22 -2.67 115.64 118.53 2dj4 s THR 72 Ca -0.03 -0.18 -0.24 0.00 -1.18 0.00 0.00 61.69 60.06 2dj4 s THR 72 Cb -0.18 -3.44 0.06 0.00 1.34 0.00 0.00 72.50 70.28 2dj4 s THR 72 CO -0.07 0.36 0.89 -0.72 -0.54 0.00 0.00 174.62 174.54 2dj4 s TYR 73 N -1.26 -0.17 -0.19 3.99 1.13 0.75 -2.21 117.35 119.39 2dj4 s TYR 73 Ca 0.25 -0.16 -0.04 0.00 -1.41 0.00 0.00 57.07 55.71 2dj4 s TYR 73 Cb -0.12 0.65 0.09 0.00 -1.10 0.00 0.00 41.96 41.47 2dj4 s TYR 73 CO 0.16 -0.91 0.25 0.99 -2.51 0.00 0.00 175.55 173.53 2dj4 s THR 74 N -3.44 -0.38 -0.78 -3.49 2.01 -1.26 -0.09 115.64 108.22 2dj4 s THR 74 Ca 0.11 -0.00 -0.25 0.00 0.31 0.00 0.00 61.69 61.85 2dj4 s THR 74 Cb -0.02 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.82 2dj4 s THR 74 CO 0.02 -0.11 1.91 -2.16 -0.69 0.00 0.00 174.62 173.59 2dj4 s PRO 75 N 2.38 2.59 0.12 4.92 0.04 -1.26 -4.82 135.00 138.96 2dj4 s PRO 75 Ca 0.06 0.10 -0.21 0.00 0.04 0.00 0.00 61.00 60.99 2dj4 s PRO 75 Cb -0.15 -4.77 -0.03 0.00 0.04 0.00 0.00 34.50 29.60 2dj4 s PRO 75 CO -0.12 -3.09 1.10 0.45 0.04 0.00 0.00 177.00 175.38 2dj4 n SER 76 N 13.43 -0.73 -4.68 6.66 2.88 -1.26 -0.26 113.62 129.66 2dj4 n SER 76 Ca 0.31 1.26 -0.26 0.00 -1.33 0.00 0.00 58.87 58.86 2dj4 n SER 76 Cb 0.49 -0.18 -0.09 0.00 -0.75 0.00 0.00 64.21 63.69 2dj4 n SER 76 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dj4 s GLN 77 N -5.39 2.11 0.62 -1.46 -2.07 -1.26 -3.38 119.66 108.83 2dj4 s GLN 77 Ca -0.09 -1.90 -0.03 0.00 -1.82 0.00 0.00 55.36 51.52 2dj4 s GLN 77 Cb 0.08 -1.86 0.04 0.00 -1.09 0.00 0.00 33.01 30.18 2dj4 s GLN 77 CO 0.45 -0.04 0.89 -1.83 -1.32 0.00 0.00 175.29 173.44 2dj4 s GLU 78 N -3.80 2.43 0.00 9.60 1.03 -1.26 -4.75 118.70 121.95 2dj4 s GLU 78 Ca 0.38 -0.48 0.00 0.00 0.03 0.00 0.00 54.97 54.90 2dj4 s GLU 78 Cb 0.05 -2.33 0.00 0.00 -0.80 0.00 0.00 34.13 31.05 2dj4 s GLU 78 CO 0.20 -0.93 0.00 0.41 -1.33 0.00 0.00 175.26 173.61 2dj4 n GLY 79 N -2.61 1.38 3.56 -3.83 0.00 -1.01 -4.93 105.19 97.75 2dj4 n GLY 79 Ca 0.07 -2.12 -0.31 0.00 0.00 0.00 0.00 46.02 43.67 2dj4 n GLY 79 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dj4 s PRO 80 N -1.23 2.57 0.70 1.61 0.04 -1.26 0.07 135.00 137.51 2dj4 s PRO 80 Ca 0.00 0.07 -0.04 0.00 0.04 0.00 0.00 61.00 61.07 2dj4 s PRO 80 Cb 0.00 -4.80 0.09 0.00 0.04 0.00 0.00 34.50 29.83 2dj4 s PRO 80 CO 0.00 -3.14 0.99 0.71 0.04 0.00 0.00 177.00 175.60 2dj4 s TYR 81 N 9.74 2.40 -0.13 0.56 1.51 0.21 -3.43 117.35 128.21 2dj4 s TYR 81 Ca 0.69 0.13 -0.04 0.00 -1.01 0.00 0.00 57.07 56.85 2dj4 s TYR 81 Cb -0.09 -3.15 0.06 0.00 -0.11 0.00 0.00 41.96 38.67 2dj4 s TYR 81 CO 0.08 -1.51 0.19 1.41 -1.11 0.00 0.00 175.55 174.61 2dj4 s MET 82 N -5.18 0.10 -0.56 -0.62 1.75 -0.69 -2.11 119.30 111.98 2dj4 s MET 82 Ca 0.63 0.49 -0.07 0.00 -1.25 0.00 0.00 55.69 55.49 2dj4 s MET 82 Cb -0.08 -0.52 0.14 0.00 2.84 0.00 0.00 34.83 37.21 2dj4 s MET 82 CO 0.44 -0.40 0.41 0.08 -0.65 0.00 0.00 175.02 174.90 2dj4 s VAL 83 N 2.32 4.11 0.38 10.11 1.01 -0.02 -0.53 120.40 137.79 2dj4 s VAL 83 Ca 0.04 -2.29 -0.23 0.00 0.00 0.00 0.00 61.98 59.49 2dj4 s VAL 83 Cb -0.13 -3.69 -0.10 0.00 0.00 0.00 0.00 36.38 32.46 2dj4 s VAL 83 CO -0.08 -0.83 0.95 -0.55 0.00 0.00 0.00 175.10 174.59 2dj4 s SER 84 N 1.86 7.11 -0.05 3.32 0.15 0.26 -1.37 113.70 124.98 2dj4 s SER 84 Ca 0.11 1.78 -0.03 0.00 0.70 0.00 0.00 55.95 58.51 2dj4 s SER 84 Cb -0.22 -2.56 0.02 0.00 -1.71 0.00 0.00 66.02 61.56 2dj4 s SER 84 CO -0.03 -0.24 0.10 -0.69 1.20 0.00 0.00 173.24 173.59 2dj4 s VAL 85 N -1.89 -0.03 0.38 4.45 1.01 -1.26 -0.13 120.40 122.93 2dj4 s VAL 85 Ca 0.56 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.72 2dj4 s VAL 85 Cb -0.14 -0.17 -0.07 0.00 0.00 0.00 0.00 36.38 35.99 2dj4 s VAL 85 CO 0.19 0.05 -0.01 -0.75 0.00 0.00 0.00 175.10 174.57 2dj4 s LYS 86 N 0.68 1.86 -0.27 2.72 2.20 -0.22 -3.20 119.74 123.51 2dj4 s LYS 86 Ca -0.05 -2.03 -0.00 0.00 -0.36 0.00 0.00 55.97 53.53 2dj4 s LYS 86 Cb -0.07 -1.52 0.16 0.00 -1.51 0.00 0.00 37.83 34.89 2dj4 s LYS 86 CO -0.03 -0.02 0.47 -0.47 -0.36 0.00 0.00 175.35 174.94 2dj4 s TYR 87 N -2.79 -1.20 -0.97 4.03 5.04 -0.99 -1.77 117.35 118.70 2dj4 s TYR 87 Ca 0.34 1.01 -0.05 0.00 -2.44 0.00 0.00 57.07 55.93 2dj4 s TYR 87 Cb 0.08 0.17 0.01 0.00 0.35 0.00 0.00 41.96 42.57 2dj4 s TYR 87 CO 0.17 -0.86 0.84 0.00 -1.34 0.00 0.00 175.55 174.36 2dj4 n ALA 88 N 5.39 -1.07 -2.87 3.97 0.00 -1.18 -2.58 120.51 122.17 2dj4 n ALA 88 Ca -0.01 0.22 -0.19 0.00 0.00 0.00 0.00 53.44 53.46 2dj4 n ALA 88 Cb 0.51 -3.68 0.03 0.00 0.00 0.00 0.00 19.45 16.30 2dj4 n ALA 88 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2dj4 n ASP 89 N -1.97 -5.48 -3.44 0.00 8.00 -1.26 -4.98 116.55 107.41 2dj4 n ASP 89 Ca -0.04 -0.23 -0.18 0.00 0.71 0.00 0.00 54.79 55.05 2dj4 n ASP 89 Cb 0.56 -4.33 -0.11 0.00 -0.02 0.00 0.00 41.12 37.22 2dj4 n ASP 89 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2dj4 s GLU 90 N -5.49 0.26 -0.27 -1.24 2.02 -1.06 -5.11 118.70 107.81 2dj4 s GLU 90 Ca 0.24 0.04 -0.36 0.00 0.02 0.00 0.00 54.97 54.91 2dj4 s GLU 90 Cb -0.11 -0.90 -0.12 0.00 0.10 0.00 0.00 34.13 33.10 2dj4 s GLU 90 CO 0.30 -0.84 2.00 0.39 0.02 0.00 0.00 175.26 177.13 2dj4 n GLU 91 N 5.32 1.35 -1.32 1.61 1.02 -1.26 -2.35 120.64 125.01 2dj4 n GLU 91 Ca -0.04 0.44 -0.36 0.00 -0.02 0.00 0.00 57.16 57.18 2dj4 n GLU 91 Cb 0.48 -2.42 0.08 0.00 -0.02 0.00 0.00 31.44 29.56 2dj4 n GLU 91 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2dj4 n ILE 92 N 6.06 2.32 0.97 -3.67 -5.35 -1.19 -4.82 119.36 113.68 2dj4 n ILE 92 Ca 0.33 -0.39 0.03 0.00 -0.27 0.00 0.00 62.75 62.45 2dj4 n ILE 92 Cb 0.22 -0.92 0.19 0.00 -1.74 0.00 0.00 39.64 37.39 2dj4 n ILE 92 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 2dj4 n PRO 93 N -1.28 0.48 -0.01 6.28 -0.04 -1.26 -1.70 135.00 137.47 2dj4 n PRO 93 Ca 0.12 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.59 2dj4 n PRO 93 Cb 0.49 -1.21 0.01 0.00 -0.04 0.00 0.00 33.50 32.76 2dj4 n PRO 93 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2dj4 n ARG 94 N -0.71 0.60 -4.38 0.54 5.12 -1.26 -5.03 116.66 111.54 2dj4 n ARG 94 Ca 0.05 -0.96 -0.27 0.00 -1.93 0.00 0.00 57.85 54.73 2dj4 n ARG 94 Cb 0.02 -1.04 -0.11 0.00 -1.16 0.00 0.00 32.46 30.17 2dj4 n ARG 94 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2dj4 s SER 95 N -0.46 3.63 1.17 0.55 0.15 -0.69 -4.21 113.70 113.86 2dj4 s SER 95 Ca 0.03 -0.76 -0.18 0.00 0.70 0.00 0.00 55.95 55.73 2dj4 s SER 95 Cb 0.02 -0.37 0.27 0.00 -1.71 0.00 0.00 66.02 64.23 2dj4 s SER 95 CO 0.02 0.13 1.11 -2.16 1.20 0.00 0.00 173.24 173.54 2dj4 s PRO 96 N -2.57 -1.00 -0.19 5.44 0.04 -1.26 -4.79 135.00 130.67 2dj4 s PRO 96 Ca 0.20 0.01 -0.02 0.00 0.04 0.00 0.00 61.00 61.24 2dj4 s PRO 96 Cb -0.09 -1.62 -0.00 0.00 0.04 0.00 0.00 34.50 32.84 2dj4 s PRO 96 CO 0.10 -3.58 -0.11 -0.06 0.04 0.00 0.00 177.00 173.40 2dj4 s PHE 97 N -3.00 2.87 -0.53 0.56 0.40 -0.47 -4.95 117.98 112.85 2dj4 s PHE 97 Ca 0.70 -1.11 -0.28 0.00 -0.60 0.00 0.00 56.93 55.64 2dj4 s PHE 97 Cb -0.11 -2.00 0.03 0.00 0.51 0.00 0.00 43.02 41.45 2dj4 s PHE 97 CO 0.56 -0.58 1.13 -1.59 0.70 0.00 0.00 175.22 175.45 2dj4 s LYS 98 N 1.23 3.57 -0.30 0.44 -2.85 -1.26 -0.84 119.74 119.74 2dj4 s LYS 98 Ca 0.03 0.30 0.03 0.00 -1.00 0.00 0.00 55.97 55.33 2dj4 s LYS 98 Cb -0.14 -3.98 0.07 0.00 -2.06 0.00 0.00 37.83 31.73 2dj4 s LYS 98 CO -0.05 -1.53 -0.04 0.08 0.10 0.00 0.00 175.35 173.92 2dj4 s VAL 99 N 4.62 2.33 -0.67 1.79 1.01 -0.89 -5.00 120.40 123.57 2dj4 s VAL 99 Ca 0.43 -1.86 -0.22 0.00 0.00 0.00 0.00 61.98 60.34 2dj4 s VAL 99 Cb -0.08 -2.49 0.08 0.00 0.00 0.00 0.00 36.38 33.89 2dj4 s VAL 99 CO 0.27 -0.24 0.94 -0.75 0.00 0.00 0.00 175.10 175.32 2dj4 s LYS 100 N 1.05 3.14 0.60 2.72 2.20 -1.26 0.64 119.74 128.84 2dj4 s LYS 100 Ca -0.02 -0.98 -0.18 0.00 -0.36 0.00 0.00 55.97 54.43 2dj4 s LYS 100 Cb -0.20 -4.30 -0.03 0.00 -1.51 0.00 0.00 37.83 31.80 2dj4 s LYS 100 CO -0.06 -1.78 1.19 0.08 -0.36 0.00 0.00 175.35 174.43 2dj4 s VAL 101 N 3.76 2.69 0.20 4.02 1.01 0.11 -4.57 120.40 127.62 2dj4 s VAL 101 Ca 0.22 0.42 0.11 0.00 0.00 0.00 0.00 61.98 62.72 2dj4 s VAL 101 Cb -0.17 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 2dj4 s VAL 101 CO 0.08 -0.11 -0.21 -0.76 0.00 0.00 0.00 175.10 174.10 2dj4 s LEU 102 N -4.19 2.55 -0.12 3.92 1.43 0.11 -2.39 118.68 119.99 2dj4 s LEU 102 Ca 0.76 -0.83 -0.29 0.00 -1.03 0.00 0.00 54.13 52.74 2dj4 s LEU 102 Cb -0.29 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.64 2dj4 s LEU 102 CO 0.34 0.11 1.54 -2.16 0.23 0.00 0.00 176.35 176.41 2dj4 s PRO 103 N -2.76 4.13 0.57 1.29 0.04 -1.26 0.21 135.00 137.21 2dj4 s PRO 103 Ca 0.22 1.95 0.37 0.00 0.04 0.00 0.00 61.00 63.58 2dj4 s PRO 103 Cb -0.08 -3.93 1.27 0.00 0.04 0.00 0.00 34.50 31.80 2dj4 s PRO 103 CO 0.11 -0.89 1.38 2.41 0.04 0.00 0.00 177.00 180.06 2dj4 n THR 104 N 5.62 0.00 -0.40 1.26 -1.04 -1.26 0.24 114.28 118.69 2dj4 n THR 104 Ca 0.17 1.33 -0.04 0.00 -2.04 0.00 0.00 64.05 63.47 2dj4 n THR 104 Cb 0.44 -2.30 0.01 0.00 -1.82 0.00 0.00 70.33 66.66 2dj4 n THR 104 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2dj4 n TYR 105 N -3.51 0.36 -2.06 -1.42 4.02 -1.26 -4.77 117.16 108.53 2dj4 n TYR 105 Ca 0.33 -1.15 0.00 0.00 -0.01 0.00 0.00 57.90 57.07 2dj4 n TYR 105 Cb 1.72 -0.57 0.00 0.00 -0.02 0.00 0.00 39.34 40.48 2dj4 n TYR 105 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2dj4 n ASP 106 N 1.09 -0.77 -4.12 7.72 9.92 0.14 0.08 116.55 130.61 2dj4 n ASP 106 Ca 0.07 0.39 -0.28 0.00 -0.53 0.00 0.00 54.79 54.43 2dj4 n ASP 106 Cb 0.53 -0.80 -0.05 0.00 -0.64 0.00 0.00 41.12 40.17 2dj4 n ASP 106 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dj4 n ALA 107 N -1.98 -1.96 1.54 2.24 0.00 -1.13 -5.00 120.51 114.22 2dj4 n ALA 107 Ca 0.00 -0.32 0.14 0.00 0.00 0.00 0.00 53.44 53.27 2dj4 n ALA 107 Cb 0.39 -1.32 0.56 0.00 0.00 0.00 0.00 19.45 19.07 2dj4 n ALA 107 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95