#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 -0.98 0.29 1.61 1.04 -1.26 -5.15 113.70 109.25 2dj4 s SER 2 Ca 0.00 0.70 -0.29 0.00 0.48 0.00 0.00 55.95 56.85 2dj4 s SER 2 Cb 0.00 1.90 -0.09 0.00 0.10 0.00 0.00 66.02 67.93 2dj4 s SER 2 CO 0.00 -0.27 1.03 -0.94 0.98 0.00 0.00 173.24 174.04 2dj4 s SER 3 N 2.78 7.33 -0.04 7.02 1.04 -1.26 -5.00 113.70 125.57 2dj4 s SER 3 Ca 0.19 2.11 -0.03 0.00 0.48 0.00 0.00 55.95 58.69 2dj4 s SER 3 Cb -0.15 -2.61 -0.01 0.00 0.10 0.00 0.00 66.02 63.35 2dj4 s SER 3 CO -0.20 -0.09 -0.06 0.61 0.98 0.00 0.00 173.24 174.49 2dj4 n GLY 4 N 1.13 -0.57 2.65 7.32 0.00 -1.26 -4.92 105.19 109.54 2dj4 n GLY 4 Ca -0.00 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 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 -4.22 3.57 -0.31 1.61 0.15 -1.26 -4.99 113.70 108.26 2dj4 s SER 5 Ca -0.05 -2.21 -0.02 0.00 0.70 0.00 0.00 55.95 54.37 2dj4 s SER 5 Cb 0.01 -0.80 0.15 0.00 -1.71 0.00 0.00 66.02 63.67 2dj4 s SER 5 CO 0.07 -0.32 2.21 -0.24 1.20 0.00 0.00 173.24 176.17 2dj4 n SER 6 N 4.07 6.35 -3.50 5.45 2.88 -1.26 -4.81 113.62 122.80 2dj4 n SER 6 Ca 0.06 -3.02 -0.24 0.00 -1.33 0.00 0.00 58.87 54.33 2dj4 n SER 6 Cb 0.37 -1.11 0.05 0.00 -0.75 0.00 0.00 64.21 62.78 2dj4 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dj4 n GLY 7 N 0.60 -1.07 3.40 0.46 0.00 -1.26 -5.01 105.19 102.31 2dj4 n GLY 7 Ca 0.32 0.51 -0.30 0.00 0.00 0.00 0.00 46.02 46.55 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 -3.42 2.37 -0.14 1.61 0.11 -1.26 -5.13 120.40 114.54 2dj4 s VAL 8 Ca 0.46 -1.52 -0.06 0.00 -2.93 0.00 0.00 61.98 57.92 2dj4 s VAL 8 Cb -0.12 -2.00 -0.04 0.00 -1.53 0.00 0.00 36.38 32.68 2dj4 s VAL 8 CO 0.81 0.22 0.08 -0.69 -3.33 0.00 0.00 175.10 172.19 2dj4 s VAL 9 N -0.97 4.98 -0.34 2.04 1.01 -1.26 -4.74 120.40 121.13 2dj4 s VAL 9 Ca 0.14 0.02 -0.00 0.00 0.00 0.00 0.00 61.98 62.14 2dj4 s VAL 9 Cb -0.10 -3.18 0.11 0.00 0.00 0.00 0.00 36.38 33.21 2dj4 s VAL 9 CO 0.05 0.56 0.14 -1.81 0.00 0.00 0.00 175.10 174.03 2dj4 s ASP 10 N -0.48 3.87 0.00 3.32 1.11 0.68 -4.97 116.67 120.21 2dj4 s ASP 10 Ca 0.11 -1.89 0.15 0.00 0.18 0.00 0.00 52.55 51.10 2dj4 s ASP 10 Cb -0.12 -0.87 0.87 0.00 1.07 0.00 0.00 42.92 43.87 2dj4 s ASP 10 CO 0.02 -0.38 1.37 -0.81 1.18 0.00 0.00 175.17 176.55 2dj4 n PRO 11 N 4.51 0.39 -0.72 8.23 -0.04 -1.26 -2.24 135.00 143.86 2dj4 n PRO 11 Ca 0.01 0.05 0.08 0.00 -0.04 0.00 0.00 63.50 63.61 2dj4 n PRO 11 Cb 0.40 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.73 2dj4 n PRO 11 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dj4 n SER 12 N -1.10 5.11 0.00 3.54 3.41 -1.26 -4.10 113.62 119.22 2dj4 n SER 12 Ca 0.10 -2.73 0.00 0.00 -0.26 0.00 0.00 58.87 55.98 2dj4 n SER 12 Cb 0.08 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.41 2dj4 n SER 12 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2dj4 n LYS 13 N 0.70 4.64 -2.94 4.33 4.76 -0.95 -4.98 118.16 123.73 2dj4 n LYS 13 Ca 0.26 -0.12 -0.41 0.00 -2.87 0.00 0.00 58.31 55.17 2dj4 n LYS 13 Cb 1.03 -0.61 -0.04 0.00 -1.84 0.00 0.00 35.03 33.57 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 -0.70 4.97 0.34 -0.18 0.11 -1.26 -4.37 120.40 119.32 2dj4 s VAL 14 Ca 0.00 1.62 0.06 0.00 -2.93 0.00 0.00 61.98 60.73 2dj4 s VAL 14 Cb 0.00 -4.12 -0.07 0.00 -1.53 0.00 0.00 36.38 30.66 2dj4 s VAL 14 CO 0.00 0.18 -0.00 -0.54 -3.33 0.00 0.00 175.10 171.41 2dj4 s LYS 15 N 1.16 1.73 -0.07 1.54 1.02 -0.49 -4.91 119.74 119.72 2dj4 s LYS 15 Ca 0.41 -1.94 -0.05 0.00 0.02 0.00 0.00 55.97 54.41 2dj4 s LYS 15 Cb -0.18 -1.25 0.03 0.00 -0.52 0.00 0.00 37.83 35.90 2dj4 s LYS 15 CO 0.19 -0.05 0.18 0.96 -0.92 0.00 0.00 175.35 175.71 2dj4 s ILE 16 N -2.98 -0.02 -0.05 2.17 -4.36 -1.26 -0.03 121.20 114.67 2dj4 s ILE 16 Ca 0.34 0.09 -0.02 0.00 -0.26 0.00 0.00 60.65 60.80 2dj4 s ILE 16 Cb 0.07 -0.28 0.03 0.00 1.25 0.00 0.00 42.46 43.54 2dj4 s ILE 16 CO 0.15 0.04 0.10 0.00 0.24 0.00 0.00 174.94 175.47 2dj4 s ALA 17 N 0.68 -0.13 0.00 2.27 0.00 -0.44 -4.99 121.76 119.14 2dj4 s ALA 17 Ca -0.05 0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.42 2dj4 s ALA 17 Cb -0.06 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.70 2dj4 s ALA 17 CO -0.04 -0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.00 2dj4 n GLY 18 N 4.14 0.82 0.18 0.00 0.00 -1.26 -2.18 105.19 106.89 2dj4 n GLY 18 Ca -0.26 -0.88 -0.02 0.00 0.00 0.00 0.00 46.02 44.85 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 0.20 -0.71 1.61 0.13 -1.97 -2.94 132.00 128.31 2dj4 h PRO 19 Ca 0.00 -0.10 0.08 0.00 -0.87 0.00 0.00 66.00 65.11 2dj4 h PRO 19 Cb 0.00 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.07 2dj4 h PRO 19 CO 0.00 0.63 0.38 0.78 -0.23 0.00 0.00 178.00 179.56 2dj4 h GLY 20 N 1.32 1.07 2.00 1.56 0.00 -1.83 -1.51 103.07 105.68 2dj4 h GLY 20 Ca 0.01 -0.25 -0.12 0.00 0.00 0.00 0.00 47.33 46.97 2dj4 h GLY 20 CO 0.07 0.10 -0.57 1.41 0.00 0.00 0.00 176.54 177.55 2dj4 h LEU 21 N 0.66 0.00 -9.37 3.11 3.38 -1.83 -3.46 115.31 107.79 2dj4 h LEU 21 Ca 0.34 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.93 2dj4 h LEU 21 Cb 0.31 0.00 0.20 0.00 0.09 0.00 0.00 40.66 41.26 2dj4 h LEU 21 CO -0.24 0.57 -1.09 0.61 0.09 0.00 0.00 178.44 178.38 2dj4 n GLY 22 N 1.04 -2.56 0.13 0.83 0.00 -0.57 -4.71 105.19 99.34 2dj4 n GLY 22 Ca 0.01 -0.69 0.12 0.00 0.00 0.00 0.00 46.02 45.46 2dj4 n GLY 22 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dj4 h SER 23 N -2.11 0.00 -0.22 1.61 0.02 -1.89 -3.37 113.55 107.59 2dj4 h SER 23 Ca -0.42 -0.04 -0.19 0.00 -0.84 0.00 0.00 61.79 60.29 2dj4 h SER 23 Cb 1.18 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.64 2dj4 h SER 23 CO 0.28 0.02 -0.04 0.61 -1.14 0.00 0.00 176.83 176.56 2dj4 n GLY 24 N 1.20 3.18 3.86 -3.77 0.00 -1.26 -4.72 105.19 103.68 2dj4 n GLY 24 Ca 0.02 -0.91 -0.36 0.00 0.00 0.00 0.00 46.02 44.77 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 -0.23 5.14 0.28 1.61 1.01 -1.26 -5.00 120.40 121.94 2dj4 s VAL 25 Ca 0.40 0.53 0.11 0.00 0.00 0.00 0.00 61.98 63.02 2dj4 s VAL 25 Cb 0.22 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 2dj4 s VAL 25 CO -0.03 0.45 -0.14 -0.13 0.00 0.00 0.00 175.10 175.25 2dj4 s ARG 26 N -1.47 1.87 0.44 2.72 0.52 -1.26 0.97 118.95 122.74 2dj4 s ARG 26 Ca 0.27 -1.66 -0.21 0.00 -0.52 0.00 0.00 55.73 53.61 2dj4 s ARG 26 Cb -0.15 -1.89 -0.10 0.00 0.52 0.00 0.00 34.95 33.33 2dj4 s ARG 26 CO 0.14 0.34 0.98 0.00 0.02 0.00 0.00 175.30 176.79 2dj4 s ALA 27 N -2.45 3.00 -1.42 2.13 0.00 0.25 -3.55 121.76 119.71 2dj4 s ALA 27 Ca 0.30 0.48 -0.03 0.00 0.00 0.00 0.00 51.96 52.72 2dj4 s ALA 27 Cb -0.05 -3.19 0.01 0.00 0.00 0.00 0.00 23.12 19.89 2dj4 s ALA 27 CO 0.17 -0.02 0.22 0.54 0.00 0.00 0.00 175.76 176.66 2dj4 n ARG 28 N -0.66 -2.88 -5.20 0.00 1.74 0.38 -4.36 116.66 105.68 2dj4 n ARG 28 Ca 0.07 0.77 -0.30 0.00 -0.77 0.00 0.00 57.85 57.63 2dj4 n ARG 28 Cb 0.53 -5.47 -0.16 0.00 -1.02 0.00 0.00 32.46 26.34 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 -2.92 1.90 -0.27 1.55 1.01 -1.23 -5.00 120.40 115.44 2dj4 s VAL 29 Ca 0.13 -1.03 -0.28 0.00 0.00 0.00 0.00 61.98 60.80 2dj4 s VAL 29 Cb -0.06 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 2dj4 s VAL 29 CO 0.16 0.54 1.90 -0.22 0.00 0.00 0.00 175.10 177.48 2dj4 s LEU 30 N -0.57 3.56 -0.11 3.92 2.96 -1.26 -4.24 118.68 122.95 2dj4 s LEU 30 Ca 0.09 1.55 0.00 0.00 -0.22 0.00 0.00 54.13 55.55 2dj4 s LEU 30 Cb -0.09 -3.52 -0.02 0.00 0.50 0.00 0.00 46.19 43.05 2dj4 s LEU 30 CO -0.01 -1.70 -0.12 -1.10 -1.32 0.00 0.00 176.35 172.10 2dj4 s GLN 31 N 5.69 3.17 0.04 1.98 -1.52 0.54 -4.98 119.66 124.57 2dj4 s GLN 31 Ca 0.85 -0.65 -0.09 0.00 -1.95 0.00 0.00 55.36 53.51 2dj4 s GLN 31 Cb -0.26 -2.61 0.00 0.00 -0.22 0.00 0.00 33.01 29.92 2dj4 s GLN 31 CO 0.34 0.35 0.19 0.45 -0.25 0.00 0.00 175.29 176.36 2dj4 s SER 32 N 0.00 0.04 0.31 5.90 0.15 -1.26 -0.40 113.70 118.44 2dj4 s SER 32 Ca -0.03 -0.36 -0.01 0.00 0.70 0.00 0.00 55.95 56.25 2dj4 s SER 32 Cb -0.14 0.28 0.01 0.00 -1.71 0.00 0.00 66.02 64.45 2dj4 s SER 32 CO 0.04 -0.54 0.42 2.22 1.20 0.00 0.00 173.24 176.58 2dj4 n PHE 33 N 0.76 -1.30 -5.08 3.44 -1.74 -1.10 -2.48 117.46 109.97 2dj4 n PHE 33 Ca -0.19 -2.10 -0.30 0.00 -0.56 0.00 0.00 57.45 54.30 2dj4 n PHE 33 Cb 0.59 0.48 -0.17 0.00 1.52 0.00 0.00 39.48 41.89 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 -2.79 1.82 -0.37 1.97 2.01 -0.93 -2.89 115.64 114.47 2dj4 s THR 34 Ca 0.26 -0.90 -0.04 0.00 0.31 0.00 0.00 61.69 61.32 2dj4 s THR 34 Cb -0.01 -1.58 0.08 0.00 0.01 0.00 0.00 72.50 71.00 2dj4 s THR 34 CO 0.19 0.51 0.14 -0.69 -0.69 0.00 0.00 174.62 174.08 2dj4 s VAL 35 N 0.23 3.42 -0.73 3.82 1.01 -0.53 -1.33 120.40 126.28 2dj4 s VAL 35 Ca -0.12 -1.62 -0.23 0.00 0.00 0.00 0.00 61.98 60.00 2dj4 s VAL 35 Cb -0.16 -3.13 0.07 0.00 0.00 0.00 0.00 36.38 33.16 2dj4 s VAL 35 CO 0.06 -0.42 1.08 -0.62 0.00 0.00 0.00 175.10 175.20 2dj4 s ASP 36 N 1.64 6.24 -0.24 3.32 2.15 0.95 -1.14 116.67 129.60 2dj4 s ASP 36 Ca 0.02 -1.03 0.13 0.00 0.43 0.00 0.00 52.55 52.10 2dj4 s ASP 36 Cb -0.21 -2.45 0.49 0.00 -0.30 0.00 0.00 42.92 40.44 2dj4 s ASP 36 CO -0.01 -1.49 1.42 -1.54 -0.17 0.00 0.00 175.17 173.38 2dj4 n SER 37 N 8.00 2.95 -0.00 -0.34 3.41 -1.20 -1.40 113.62 125.03 2dj4 n SER 37 Ca 0.03 -3.45 -0.13 0.00 -0.26 0.00 0.00 58.87 55.07 2dj4 n SER 37 Cb 0.47 -0.58 -0.00 0.00 -0.26 0.00 0.00 64.21 63.83 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 1.19 0.73 1.38 4.04 0.87 -1.81 -2.99 113.55 116.96 2dj4 h SER 38 Ca 0.12 -0.44 -0.01 0.00 -1.23 0.00 0.00 61.79 60.23 2dj4 h SER 38 Cb 1.51 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 63.26 2dj4 h SER 38 CO 0.29 1.20 -0.06 0.11 -0.53 0.00 0.00 176.83 177.84 2dj4 h LYS 39 N 0.45 0.00 -0.11 2.24 1.79 -1.82 -3.12 116.57 116.00 2dj4 h LYS 39 Ca -0.02 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.23 2dj4 h LYS 39 Cb 1.26 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.92 2dj4 h LYS 39 CO 0.13 0.06 -0.82 0.00 -1.08 0.00 0.00 179.45 177.73 2dj4 h ALA 40 N 1.94 0.34 0.00 3.86 0.00 -1.68 -3.44 119.26 120.29 2dj4 h ALA 40 Ca -0.00 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2dj4 h ALA 40 Cb 0.76 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2dj4 h ALA 40 CO 0.01 0.71 0.00 0.41 0.00 0.00 0.00 179.25 180.38 2dj4 n GLY 41 N 0.75 0.43 0.21 0.00 0.00 -1.15 -0.23 105.19 105.19 2dj4 n GLY 41 Ca -0.07 -1.28 0.10 0.00 0.00 0.00 0.00 46.02 44.76 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 2.60 -4.81 0.99 -0.00 -1.26 -4.65 117.00 109.87 2dj4 n LEU 42 Ca 0.00 -3.08 -0.33 0.00 -0.00 0.00 0.00 56.01 52.60 2dj4 n LEU 42 Cb 0.00 -0.45 -0.04 0.00 -0.00 0.00 0.00 43.42 42.94 2dj4 n LEU 42 CO 0.00 0.70 0.69 0.00 -0.00 0.00 0.00 177.39 178.79 2dj4 s ALA 43 N -2.87 2.92 0.94 1.47 0.00 -1.26 -5.05 121.76 117.91 2dj4 s ALA 43 Ca 0.34 0.44 -0.12 0.00 0.00 0.00 0.00 51.96 52.62 2dj4 s ALA 43 Cb 0.29 -3.20 0.15 0.00 0.00 0.00 0.00 23.12 20.36 2dj4 s ALA 43 CO 0.04 -0.28 1.09 -1.25 0.00 0.00 0.00 175.76 175.36 2dj4 s PRO 44 N -3.53 0.93 -0.05 0.00 0.04 -1.26 -4.83 135.00 126.31 2dj4 s PRO 44 Ca 0.64 0.70 0.05 0.00 0.04 0.00 0.00 61.00 62.43 2dj4 s PRO 44 Cb -0.13 -1.78 -0.00 0.00 0.04 0.00 0.00 34.50 32.62 2dj4 s PRO 44 CO 0.23 -2.43 -0.19 -1.17 0.04 0.00 0.00 177.00 173.48 2dj4 s LEU 45 N -6.31 1.95 0.06 -3.56 2.96 -1.26 -3.15 118.68 109.35 2dj4 s LEU 45 Ca 0.64 -0.39 0.08 0.00 -0.22 0.00 0.00 54.13 54.24 2dj4 s LEU 45 Cb -0.18 -1.06 -0.03 0.00 0.50 0.00 0.00 46.19 45.42 2dj4 s LEU 45 CO 0.57 0.17 -0.20 -0.70 -1.32 0.00 0.00 176.35 174.88 2dj4 s GLU 46 N 0.01 1.96 0.04 1.98 2.12 -0.74 -4.96 118.70 119.11 2dj4 s GLU 46 Ca -0.04 -1.04 0.03 0.00 0.36 0.00 0.00 54.97 54.28 2dj4 s GLU 46 Cb -0.12 -2.14 -0.02 0.00 0.26 0.00 0.00 34.13 32.11 2dj4 s GLU 46 CO 0.03 0.52 -0.09 0.08 -0.54 0.00 0.00 175.26 175.26 2dj4 s VAL 47 N -0.94 0.70 -0.17 3.70 1.01 -1.26 -1.37 120.40 122.07 2dj4 s VAL 47 Ca 0.15 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 61.05 2dj4 s VAL 47 Cb -0.10 -0.70 0.05 0.00 0.00 0.00 0.00 36.38 35.63 2dj4 s VAL 47 CO 0.05 -0.21 0.43 -0.13 0.00 0.00 0.00 175.10 175.24 2dj4 s ARG 48 N -1.30 0.44 -0.16 2.72 0.52 0.52 -4.89 118.95 116.81 2dj4 s ARG 48 Ca -0.05 0.75 0.00 0.00 -0.52 0.00 0.00 55.73 55.91 2dj4 s ARG 48 Cb -0.08 0.07 0.00 0.00 0.52 0.00 0.00 34.95 35.46 2dj4 s ARG 48 CO 0.01 -0.13 -0.16 0.08 0.02 0.00 0.00 175.30 175.12 2dj4 s VAL 49 N 1.03 2.57 -0.14 3.52 1.01 -1.25 0.54 120.40 127.66 2dj4 s VAL 49 Ca -0.06 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.12 2dj4 s VAL 49 Cb -0.06 -2.08 0.02 0.00 0.00 0.00 0.00 36.38 34.26 2dj4 s VAL 49 CO -0.09 0.52 -0.16 -0.76 0.00 0.00 0.00 175.10 174.61 2dj4 s LEU 50 N 0.85 1.79 1.24 3.92 2.01 0.41 -3.07 118.68 125.84 2dj4 s LEU 50 Ca -0.05 -0.51 -0.16 0.00 0.01 0.00 0.00 54.13 53.43 2dj4 s LEU 50 Cb -0.15 -1.22 0.31 0.00 0.01 0.00 0.00 46.19 45.13 2dj4 s LEU 50 CO -0.01 -0.02 1.00 -0.83 1.01 0.00 0.00 176.35 177.50 2dj4 s GLY 51 N 1.29 1.50 0.00 -3.19 0.00 0.69 -1.65 107.32 105.96 2dj4 s GLY 51 Ca 0.01 -0.41 -0.24 0.00 0.00 0.00 0.00 44.72 44.09 2dj4 s GLY 51 CO -0.08 0.41 1.30 -0.56 0.00 0.00 0.00 173.10 174.17 2dj4 h PRO 52 N -2.85 0.15 -0.24 2.90 0.13 -1.89 -3.29 132.00 126.91 2dj4 h PRO 52 Ca -0.56 -0.08 -0.19 0.00 -0.87 0.00 0.00 66.00 64.30 2dj4 h PRO 52 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 2dj4 h PRO 52 CO 0.44 0.59 -0.61 0.00 -0.23 0.00 0.00 178.00 178.19 2dj4 h ARG 53 N -0.29 0.80 0.00 0.86 -0.00 -1.93 -3.47 114.38 110.36 2dj4 h ARG 53 Ca 0.01 -0.54 0.00 0.00 -0.50 0.00 0.00 59.98 58.95 2dj4 h ARG 53 Cb 0.56 0.08 0.00 0.00 0.00 0.00 0.00 29.97 30.61 2dj4 h ARG 53 CO 0.01 1.17 0.00 0.41 0.00 0.00 0.00 179.97 181.56 2dj4 n GLY 54 N 0.43 0.00 3.89 0.04 0.00 -1.24 -5.16 105.19 103.16 2dj4 n GLY 54 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 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 4.07 -0.12 0.99 2.96 -1.26 -4.85 118.68 120.47 2dj4 s LEU 55 Ca 0.00 0.81 0.01 0.00 -0.22 0.00 0.00 54.13 54.73 2dj4 s LEU 55 Cb 0.00 -3.62 -0.01 0.00 0.50 0.00 0.00 46.19 43.06 2dj4 s LEU 55 CO 0.00 -0.18 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.01 2dj4 s VAL 56 N -2.03 2.84 -0.00 1.68 1.01 -1.26 -0.23 120.40 122.40 2dj4 s VAL 56 Ca 0.46 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.72 2dj4 s VAL 56 Cb -0.11 -2.17 -0.01 0.00 0.00 0.00 0.00 36.38 34.09 2dj4 s VAL 56 CO 0.28 0.53 -0.09 -1.61 0.00 0.00 0.00 175.10 174.21 2dj4 s GLU 57 N 0.34 0.72 1.03 2.72 0.41 -1.18 -5.01 118.70 117.73 2dj4 s GLU 57 Ca -0.13 -0.37 -0.13 0.00 -0.41 0.00 0.00 54.97 53.94 2dj4 s GLU 57 Cb -0.16 -0.69 0.21 0.00 -1.78 0.00 0.00 34.13 31.70 2dj4 s GLU 57 CO 0.06 0.19 1.09 -1.25 -0.49 0.00 0.00 175.26 174.86 2dj4 s PRO 58 N -0.33 0.15 0.04 0.39 0.04 -1.26 -3.97 135.00 130.06 2dj4 s PRO 58 Ca 0.03 0.43 -0.02 0.00 0.04 0.00 0.00 61.00 61.47 2dj4 s PRO 58 Cb -0.04 -1.71 -0.02 0.00 0.04 0.00 0.00 34.50 32.77 2dj4 s PRO 58 CO -0.00 -2.90 0.02 0.08 0.04 0.00 0.00 177.00 174.24 2dj4 s VAL 59 N -2.97 0.15 -0.14 -0.36 1.01 -1.26 -4.87 120.40 111.97 2dj4 s VAL 59 Ca 0.66 -1.23 -0.07 0.00 0.00 0.00 0.00 61.98 61.34 2dj4 s VAL 59 Cb -0.18 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 2dj4 s VAL 59 CO 0.58 -0.68 0.13 0.21 0.00 0.00 0.00 175.10 175.34 2dj4 s ASN 60 N -2.12 6.29 -0.12 3.32 2.47 -0.83 -5.00 114.94 118.95 2dj4 s ASN 60 Ca -0.05 0.40 -0.02 0.00 0.42 0.00 0.00 52.86 53.61 2dj4 s ASN 60 Cb -0.02 -2.05 0.04 0.00 -1.45 0.00 0.00 41.25 37.77 2dj4 s ASN 60 CO -0.05 0.36 -0.01 0.54 -3.72 0.00 0.00 177.10 174.22 2dj4 s VAL 61 N -0.70 0.61 -0.03 -5.21 0.11 -1.26 -3.38 120.40 110.54 2dj4 s VAL 61 Ca 0.13 -0.23 0.00 0.00 -2.93 0.00 0.00 61.98 58.96 2dj4 s VAL 61 Cb -0.12 -0.85 0.03 0.00 -1.53 0.00 0.00 36.38 33.91 2dj4 s VAL 61 CO 0.03 0.13 0.01 -0.69 -3.33 0.00 0.00 175.10 171.24 2dj4 s VAL 62 N 1.86 0.12 0.21 2.04 1.01 -0.33 -5.00 120.40 120.31 2dj4 s VAL 62 Ca 0.03 0.11 -0.27 0.00 0.00 0.00 0.00 61.98 61.85 2dj4 s VAL 62 Cb -0.14 -0.22 -0.09 0.00 0.00 0.00 0.00 36.38 35.93 2dj4 s VAL 62 CO -0.07 0.13 0.85 -0.62 0.00 0.00 0.00 175.10 175.39 2dj4 s ASP 63 N 0.99 7.47 -0.06 3.32 2.15 -1.26 0.70 116.67 129.97 2dj4 s ASP 63 Ca -0.10 1.77 -0.23 0.00 0.43 0.00 0.00 52.55 54.42 2dj4 s ASP 63 Cb -0.13 -2.54 -0.31 0.00 -0.30 0.00 0.00 42.92 39.64 2dj4 s ASP 63 CO -0.02 0.17 0.88 0.78 -0.17 0.00 0.00 175.17 176.81 2dj4 h ASN 64 N 4.14 0.40 0.00 -0.34 2.35 -1.64 -3.46 115.58 117.03 2dj4 h ASN 64 Ca -0.46 -0.96 0.00 0.00 -0.55 0.00 0.00 56.30 54.33 2dj4 h ASN 64 Cb 1.20 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.44 2dj4 h ASN 64 CO 0.67 1.33 0.00 0.61 -1.65 0.00 0.00 177.43 178.39 2dj4 n GLY 65 N 1.65 1.56 0.13 2.83 0.00 -1.26 -4.93 105.19 105.18 2dj4 n GLY 65 Ca -0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 2dj4 n GLY 65 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2dj4 h ASP 66 N 0.89 0.43 0.00 1.61 3.58 -2.04 -3.47 116.42 117.42 2dj4 h ASP 66 Ca 0.00 -0.89 0.00 0.00 0.42 0.00 0.00 57.03 56.56 2dj4 h ASP 66 Cb 0.00 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 40.91 2dj4 h ASP 66 CO 0.00 1.76 0.00 0.61 -2.88 0.00 0.00 179.24 178.73 2dj4 n GLY 67 N 1.86 0.00 3.52 -0.78 0.00 -1.26 -5.02 105.19 103.51 2dj4 n GLY 67 Ca -0.29 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.11 2.61 -4.23 -1.26 -3.17 115.64 109.48 2dj4 s THR 68 Ca 0.00 -1.53 -0.05 0.00 -1.18 0.00 0.00 61.69 58.93 2dj4 s THR 68 Cb 0.00 -2.62 0.05 0.00 1.34 0.00 0.00 72.50 71.28 2dj4 s THR 68 CO 0.00 0.00 0.23 -1.00 -0.54 0.00 0.00 174.62 173.31 2dj4 s HIS 69 N -3.10 -0.33 0.08 3.99 0.09 -0.29 -1.49 115.29 114.23 2dj4 s HIS 69 Ca 0.28 0.82 -0.24 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 32.46 2dj4 s HIS 69 CO 0.18 -0.29 0.74 0.99 -0.00 0.00 0.00 174.74 176.36 2dj4 s THR 70 N 1.96 4.65 -0.19 1.30 2.01 0.22 -1.45 115.64 124.13 2dj4 s THR 70 Ca -0.02 1.59 -0.01 0.00 0.31 0.00 0.00 61.69 63.56 2dj4 s THR 70 Cb -0.11 -4.09 0.05 0.00 0.01 0.00 0.00 72.50 68.36 2dj4 s THR 70 CO -0.08 0.43 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.55 2dj4 s VAL 71 N -0.44 1.12 0.02 3.82 1.01 -1.14 -1.18 120.40 123.61 2dj4 s VAL 71 Ca 0.36 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.55 2dj4 s VAL 71 Cb -0.21 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 2dj4 s VAL 71 CO 0.23 -0.00 0.10 0.42 0.00 0.00 0.00 175.10 175.85 2dj4 s THR 72 N 1.60 4.79 0.23 3.92 -4.23 -1.22 -2.70 115.64 118.05 2dj4 s THR 72 Ca -0.02 -0.46 -0.21 0.00 -1.18 0.00 0.00 61.69 59.83 2dj4 s THR 72 Cb -0.17 -3.23 0.07 0.00 1.34 0.00 0.00 72.50 70.51 2dj4 s THR 72 CO -0.07 0.29 0.96 -0.72 -0.54 0.00 0.00 174.62 174.53 2dj4 s TYR 73 N -1.27 0.05 -0.25 3.99 1.13 0.46 -1.95 117.35 119.51 2dj4 s TYR 73 Ca 0.25 -0.51 -0.04 0.00 -1.41 0.00 0.00 57.07 55.36 2dj4 s TYR 73 Cb -0.12 0.73 0.13 0.00 -1.10 0.00 0.00 41.96 41.60 2dj4 s TYR 73 CO 0.17 -1.08 0.47 0.99 -2.51 0.00 0.00 175.55 173.58 2dj4 s THR 74 N -2.40 -0.74 -0.79 -3.49 2.01 -1.26 -0.34 115.64 108.63 2dj4 s THR 74 Ca 0.19 0.02 -0.25 0.00 0.31 0.00 0.00 61.69 61.95 2dj4 s THR 74 Cb -0.03 -0.83 -0.04 0.00 0.01 0.00 0.00 72.50 71.61 2dj4 s THR 74 CO 0.06 -0.03 1.91 -2.16 -0.69 0.00 0.00 174.62 173.71 2dj4 s PRO 75 N 2.67 2.59 0.11 4.92 0.04 -1.26 -4.82 135.00 139.25 2dj4 s PRO 75 Ca 0.09 0.06 -0.22 0.00 0.04 0.00 0.00 61.00 60.97 2dj4 s PRO 75 Cb -0.14 -4.80 -0.04 0.00 0.04 0.00 0.00 34.50 29.56 2dj4 s PRO 75 CO -0.16 -3.12 1.09 0.45 0.04 0.00 0.00 177.00 175.30 2dj4 n SER 76 N 13.47 -0.74 -4.66 6.66 2.88 -1.26 -0.47 113.62 129.49 2dj4 n SER 76 Ca 0.32 1.26 -0.25 0.00 -1.33 0.00 0.00 58.87 58.86 2dj4 n SER 76 Cb 0.49 -0.17 -0.09 0.00 -0.75 0.00 0.00 64.21 63.70 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 -5.37 2.09 0.67 -1.46 -2.07 -1.26 -3.40 119.66 108.86 2dj4 s GLN 77 Ca -0.09 -1.87 -0.08 0.00 -1.82 0.00 0.00 55.36 51.50 2dj4 s GLN 77 Cb 0.08 -1.87 0.03 0.00 -1.09 0.00 0.00 33.01 30.16 2dj4 s GLN 77 CO 0.44 0.01 1.01 -1.83 -1.32 0.00 0.00 175.29 173.59 2dj4 s GLU 78 N -3.78 2.66 0.00 9.60 -1.05 -1.26 -4.76 118.70 120.11 2dj4 s GLU 78 Ca 0.37 0.08 0.00 0.00 -0.15 0.00 0.00 54.97 55.27 2dj4 s GLU 78 Cb 0.04 -2.15 0.00 0.00 -0.44 0.00 0.00 34.13 31.58 2dj4 s GLU 78 CO 0.20 -0.99 0.00 0.41 0.95 0.00 0.00 175.26 175.83 2dj4 n GLY 79 N -2.84 3.02 3.56 -3.83 0.00 -0.83 -4.94 105.19 99.33 2dj4 n GLY 79 Ca 0.06 -1.89 -0.28 0.00 0.00 0.00 0.00 46.02 43.91 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 -2.07 2.58 0.79 1.61 0.04 -1.26 -0.76 135.00 135.94 2dj4 s PRO 80 Ca 0.00 -0.20 -0.10 0.00 0.04 0.00 0.00 61.00 60.74 2dj4 s PRO 80 Cb 0.00 -4.98 0.10 0.00 0.04 0.00 0.00 34.50 29.65 2dj4 s PRO 80 CO 0.00 -3.27 1.13 0.71 0.04 0.00 0.00 177.00 175.60 2dj4 s TYR 81 N 9.85 2.58 -0.07 0.56 1.51 0.20 -3.74 117.35 128.24 2dj4 s TYR 81 Ca 0.69 0.47 -0.03 0.00 -1.01 0.00 0.00 57.07 57.20 2dj4 s TYR 81 Cb -0.07 -3.46 0.04 0.00 -0.11 0.00 0.00 41.96 38.35 2dj4 s TYR 81 CO 0.02 -1.80 0.09 1.41 -1.11 0.00 0.00 175.55 174.16 2dj4 s MET 82 N -5.48 -0.04 -0.51 -0.62 1.75 -0.66 -1.62 119.30 112.13 2dj4 s MET 82 Ca 0.64 0.36 -0.05 0.00 -1.25 0.00 0.00 55.69 55.39 2dj4 s MET 82 Cb -0.09 -0.62 0.13 0.00 2.84 0.00 0.00 34.83 37.09 2dj4 s MET 82 CO 0.48 -0.37 0.34 0.08 -0.65 0.00 0.00 175.02 174.90 2dj4 s VAL 83 N 2.19 3.82 0.31 10.11 1.01 -0.14 -0.44 120.40 137.26 2dj4 s VAL 83 Ca 0.04 -2.24 -0.24 0.00 0.00 0.00 0.00 61.98 59.55 2dj4 s VAL 83 Cb -0.13 -3.53 -0.10 0.00 0.00 0.00 0.00 36.38 32.63 2dj4 s VAL 83 CO -0.04 -0.79 0.88 -0.44 0.00 0.00 0.00 175.10 174.71 2dj4 s SER 84 N 1.80 7.22 -0.01 3.32 0.01 0.19 -1.55 113.70 124.68 2dj4 s SER 84 Ca 0.10 1.70 0.00 0.00 1.31 0.00 0.00 55.95 59.07 2dj4 s SER 84 Cb -0.22 -2.53 0.01 0.00 0.21 0.00 0.00 66.02 63.48 2dj4 s SER 84 CO -0.03 -0.07 -0.01 -0.69 0.41 0.00 0.00 173.24 172.85 2dj4 s VAL 85 N -1.65 0.11 0.36 3.43 1.01 -1.26 -0.35 120.40 122.05 2dj4 s VAL 85 Ca 0.50 -0.01 0.06 0.00 0.00 0.00 0.00 61.98 62.52 2dj4 s VAL 85 Cb -0.17 -0.13 -0.07 0.00 0.00 0.00 0.00 36.38 36.00 2dj4 s VAL 85 CO 0.22 0.06 0.01 -0.75 0.00 0.00 0.00 175.10 174.64 2dj4 s LYS 86 N 0.25 1.81 -0.27 2.72 2.20 -0.47 -3.35 119.74 122.64 2dj4 s LYS 86 Ca -0.02 -2.00 -0.03 0.00 -0.36 0.00 0.00 55.97 53.56 2dj4 s LYS 86 Cb -0.04 -1.34 0.15 0.00 -1.51 0.00 0.00 37.83 35.09 2dj4 s LYS 86 CO -0.01 -0.07 0.49 -0.47 -0.36 0.00 0.00 175.35 174.93 2dj4 s TYR 87 N -2.92 -1.19 -1.27 4.03 5.04 -1.02 -1.79 117.35 118.22 2dj4 s TYR 87 Ca 0.35 1.36 -0.06 0.00 -2.44 0.00 0.00 57.07 56.28 2dj4 s TYR 87 Cb 0.08 0.33 0.01 0.00 0.35 0.00 0.00 41.96 42.73 2dj4 s TYR 87 CO 0.16 -0.76 0.82 0.00 -1.34 0.00 0.00 175.55 174.43 2dj4 n ALA 88 N 5.40 -1.02 -2.79 3.97 0.00 -1.19 -2.13 120.51 122.75 2dj4 n ALA 88 Ca -0.03 0.31 -0.15 0.00 0.00 0.00 0.00 53.44 53.57 2dj4 n ALA 88 Cb 0.50 -4.29 0.03 0.00 0.00 0.00 0.00 19.45 15.69 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 -2.25 -4.71 -3.45 0.00 9.92 -1.26 -5.00 116.55 109.80 2dj4 n ASP 89 Ca -0.04 -0.20 -0.18 0.00 -0.53 0.00 0.00 54.79 53.83 2dj4 n ASP 89 Cb 0.58 -3.56 -0.12 0.00 -0.64 0.00 0.00 41.12 37.38 2dj4 n ASP 89 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2dj4 s GLU 90 N -5.35 0.25 -0.28 -1.24 2.02 -0.90 -5.11 118.70 108.10 2dj4 s GLU 90 Ca 0.21 0.01 -0.35 0.00 0.02 0.00 0.00 54.97 54.86 2dj4 s GLU 90 Cb -0.09 -0.95 -0.11 0.00 0.10 0.00 0.00 34.13 33.08 2dj4 s GLU 90 CO 0.27 -0.84 2.09 0.39 0.02 0.00 0.00 175.26 177.18 2dj4 n GLU 91 N 5.31 1.37 -1.30 1.61 1.02 -1.26 -2.45 120.64 124.95 2dj4 n GLU 91 Ca -0.04 0.42 -0.36 0.00 -0.02 0.00 0.00 57.16 57.16 2dj4 n GLU 91 Cb 0.48 -2.53 0.07 0.00 -0.02 0.00 0.00 31.44 29.43 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 6.59 1.95 0.98 -3.67 -5.35 -1.21 -4.81 119.36 113.84 2dj4 n ILE 92 Ca 0.35 -0.41 0.04 0.00 -0.27 0.00 0.00 62.75 62.46 2dj4 n ILE 92 Cb 0.25 -0.76 0.24 0.00 -1.74 0.00 0.00 39.64 37.63 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 -0.73 0.49 -0.01 6.28 -0.04 -1.26 -1.70 135.00 138.04 2dj4 n PRO 93 Ca 0.10 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.58 2dj4 n PRO 93 Cb 0.49 -1.26 0.02 0.00 -0.04 0.00 0.00 33.50 32.72 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 -0.76 0.04 -4.33 0.54 5.12 -1.26 -5.02 116.66 110.99 2dj4 n ARG 94 Ca 0.06 -0.86 -0.27 0.00 -1.93 0.00 0.00 57.85 54.85 2dj4 n ARG 94 Cb 0.03 -1.07 -0.10 0.00 -1.16 0.00 0.00 32.46 30.16 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 -0.41 4.01 1.19 0.55 0.15 -0.69 -4.24 113.70 114.27 2dj4 s SER 95 Ca 0.05 -0.67 -0.19 0.00 0.70 0.00 0.00 55.95 55.84 2dj4 s SER 95 Cb 0.03 -0.58 0.28 0.00 -1.71 0.00 0.00 66.02 64.04 2dj4 s SER 95 CO 0.05 0.11 1.11 -2.16 1.20 0.00 0.00 173.24 173.54 2dj4 s PRO 96 N -2.78 -1.16 0.06 5.44 0.04 -1.26 -4.79 135.00 130.55 2dj4 s PRO 96 Ca 0.24 -0.05 0.08 0.00 0.04 0.00 0.00 61.00 61.31 2dj4 s PRO 96 Cb -0.09 -1.60 -0.03 0.00 0.04 0.00 0.00 34.50 32.82 2dj4 s PRO 96 CO 0.14 -3.68 -0.20 -0.06 0.04 0.00 0.00 177.00 173.24 2dj4 s PHE 97 N -3.01 2.51 -0.18 0.56 0.08 -0.59 -4.94 117.98 112.41 2dj4 s PHE 97 Ca 0.71 -0.28 -0.09 0.00 0.12 0.00 0.00 56.93 57.39 2dj4 s PHE 97 Cb -0.10 -1.42 -0.05 0.00 -0.57 0.00 0.00 43.02 40.88 2dj4 s PHE 97 CO 0.56 0.27 0.11 0.15 -0.10 0.00 0.00 175.22 176.21 2dj4 s LYS 98 N -1.59 4.02 -0.28 0.44 3.01 -1.26 -0.97 119.74 123.10 2dj4 s LYS 98 Ca 0.15 -0.24 -0.02 0.00 -1.01 0.00 0.00 55.97 54.85 2dj4 s LYS 98 Cb -0.10 -3.33 0.09 0.00 -1.01 0.00 0.00 37.83 33.48 2dj4 s LYS 98 CO 0.06 0.36 0.10 0.08 0.51 0.00 0.00 175.35 176.46 2dj4 s VAL 99 N 0.16 0.51 -0.88 3.17 1.01 -0.64 -4.91 120.40 118.82 2dj4 s VAL 99 Ca 0.08 -1.06 -0.23 0.00 0.00 0.00 0.00 61.98 60.77 2dj4 s VAL 99 Cb -0.11 -1.34 0.06 0.00 0.00 0.00 0.00 36.38 34.98 2dj4 s VAL 99 CO -0.01 -0.62 1.28 -0.75 0.00 0.00 0.00 175.10 175.01 2dj4 s LYS 100 N 1.81 3.42 0.42 2.72 2.20 -1.26 0.58 119.74 129.63 2dj4 s LYS 100 Ca 0.08 -0.96 -0.24 0.00 -0.36 0.00 0.00 55.97 54.48 2dj4 s LYS 100 Cb -0.17 -4.82 -0.08 0.00 -1.51 0.00 0.00 37.83 31.25 2dj4 s LYS 100 CO -0.26 -2.06 1.15 0.08 -0.36 0.00 0.00 175.35 173.89 2dj4 s VAL 101 N 4.65 3.24 0.21 4.02 1.01 0.06 -4.29 120.40 129.30 2dj4 s VAL 101 Ca 0.37 0.98 0.11 0.00 0.00 0.00 0.00 61.98 63.45 2dj4 s VAL 101 Cb -0.05 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.76 2dj4 s VAL 101 CO -0.01 0.04 -0.20 -0.76 0.00 0.00 0.00 175.10 174.18 2dj4 s LEU 102 N -2.70 2.59 -0.19 3.92 1.43 0.27 -1.97 118.68 122.04 2dj4 s LEU 102 Ca 0.59 -0.85 -0.29 0.00 -1.03 0.00 0.00 54.13 52.56 2dj4 s LEU 102 Cb -0.28 -1.26 -0.03 0.00 0.03 0.00 0.00 46.19 44.65 2dj4 s LEU 102 CO 0.35 0.09 1.59 -2.16 0.23 0.00 0.00 176.35 176.46 2dj4 s PRO 103 N -2.93 3.90 0.35 1.29 0.04 -1.26 0.84 135.00 137.22 2dj4 s PRO 103 Ca 0.24 1.75 0.29 0.00 0.04 0.00 0.00 61.00 63.32 2dj4 s PRO 103 Cb -0.07 -4.00 1.13 0.00 0.04 0.00 0.00 34.50 31.60 2dj4 s PRO 103 CO 0.12 -1.17 1.10 2.41 0.04 0.00 0.00 177.00 179.51 2dj4 n THR 104 N 6.15 -0.10 -0.99 1.26 -1.04 -1.26 -0.03 114.28 118.28 2dj4 n THR 104 Ca 0.18 1.17 -0.12 0.00 -2.04 0.00 0.00 64.05 63.24 2dj4 n THR 104 Cb 0.45 -1.93 -0.12 0.00 -1.82 0.00 0.00 70.33 66.90 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 -3.75 0.28 -0.60 -1.42 4.02 -1.26 -4.53 117.16 109.89 2dj4 n TYR 105 Ca 0.30 -1.50 -0.16 0.00 -0.01 0.00 0.00 57.90 56.53 2dj4 n TYR 105 Cb 1.26 -1.38 0.06 0.00 -0.02 0.00 0.00 39.34 39.26 2dj4 n TYR 105 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2dj4 n ASP 106 N 2.04 5.26 -1.63 7.72 -0.08 0.95 -4.61 116.55 126.21 2dj4 n ASP 106 Ca 0.37 -2.99 -0.04 0.00 -1.51 0.00 0.00 54.79 50.61 2dj4 n ASP 106 Cb 0.79 -0.90 -0.02 0.00 2.34 0.00 0.00 41.12 43.33 2dj4 n ASP 106 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2dj4 n ALA 107 N 0.02 4.51 0.18 -1.67 0.00 -1.26 -5.13 120.51 117.16 2dj4 n ALA 107 Ca 0.31 -0.50 0.02 0.00 0.00 0.00 0.00 53.44 53.28 2dj4 n ALA 107 Cb 0.79 -1.25 0.02 0.00 0.00 0.00 0.00 19.45 19.01 2dj4 n ALA 107 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93