#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 6.46 -0.08 1.61 0.15 -1.26 -5.03 113.70 115.55 2dj4 s SER 2 Ca 0.00 0.22 -0.06 0.00 0.70 0.00 0.00 55.95 56.81 2dj4 s SER 2 Cb 0.00 -2.34 0.03 0.00 -1.71 0.00 0.00 66.02 62.00 2dj4 s SER 2 CO 0.00 -0.61 0.21 -0.94 1.20 0.00 0.00 173.24 173.10 2dj4 s SER 3 N 1.78 -0.21 0.00 5.45 1.04 -1.26 -5.13 113.70 115.37 2dj4 s SER 3 Ca 0.26 0.42 0.00 0.00 0.48 0.00 0.00 55.95 57.11 2dj4 s SER 3 Cb -0.14 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.36 2dj4 s SER 3 CO 0.15 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 174.87 2dj4 n GLY 4 N 3.50 3.32 2.88 7.32 0.00 -1.26 -5.04 105.19 115.90 2dj4 n GLY 4 Ca -0.18 -1.72 -0.30 0.00 0.00 0.00 0.00 46.02 43.81 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 0.00 4.30 -0.05 1.61 0.15 -1.26 -5.09 113.70 113.36 2dj4 s SER 5 Ca 0.00 -2.21 -0.12 0.00 0.70 0.00 0.00 55.95 54.32 2dj4 s SER 5 Cb 0.00 -1.31 0.02 0.00 -1.71 0.00 0.00 66.02 63.02 2dj4 s SER 5 CO 0.00 -0.35 0.28 -0.55 1.20 0.00 0.00 173.24 173.82 2dj4 s SER 6 N 0.85 -0.21 -0.37 5.45 0.15 -1.26 -5.08 113.70 113.23 2dj4 s SER 6 Ca 0.13 0.26 0.13 0.00 0.70 0.00 0.00 55.95 57.16 2dj4 s SER 6 Cb -0.20 0.42 0.44 0.00 -1.71 0.00 0.00 66.02 64.97 2dj4 s SER 6 CO -0.11 -0.30 1.01 0.61 1.20 0.00 0.00 173.24 175.65 2dj4 n GLY 7 N 1.96 3.27 3.91 9.45 0.00 -1.26 -5.09 105.19 117.43 2dj4 n GLY 7 Ca -0.18 -1.87 -0.28 0.00 0.00 0.00 0.00 46.02 43.69 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 -4.02 5.06 -0.22 1.61 0.11 -1.26 -5.05 120.40 116.62 2dj4 s VAL 8 Ca 0.35 -0.04 -0.12 0.00 -2.93 0.00 0.00 61.98 59.24 2dj4 s VAL 8 Cb 0.43 -3.74 -0.05 0.00 -1.53 0.00 0.00 36.38 31.49 2dj4 s VAL 8 CO -0.05 -0.32 0.23 -0.69 -3.33 0.00 0.00 175.10 170.94 2dj4 s VAL 9 N -2.07 5.32 -0.45 2.04 1.01 -1.26 -4.76 120.40 120.22 2dj4 s VAL 9 Ca 0.43 0.34 0.02 0.00 0.00 0.00 0.00 61.98 62.78 2dj4 s VAL 9 Cb -0.11 -3.57 0.12 0.00 0.00 0.00 0.00 36.38 32.83 2dj4 s VAL 9 CO 0.30 0.33 0.20 -1.81 0.00 0.00 0.00 175.10 174.12 2dj4 s ASP 10 N 0.98 4.71 0.00 3.32 1.01 0.83 -4.94 116.67 122.58 2dj4 s ASP 10 Ca 0.11 -2.56 0.16 0.00 0.71 0.00 0.00 52.55 50.96 2dj4 s ASP 10 Cb -0.14 -1.69 0.93 0.00 1.01 0.00 0.00 42.92 43.04 2dj4 s ASP 10 CO 0.05 -0.34 1.35 -0.81 0.21 0.00 0.00 175.17 175.63 2dj4 n PRO 11 N 3.75 0.48 -0.07 8.23 -0.04 -1.26 -1.95 135.00 144.15 2dj4 n PRO 11 Ca 0.04 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.62 2dj4 n PRO 11 Cb 0.38 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.51 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 -1.01 3.05 -0.24 3.54 7.64 -1.26 -4.03 113.62 121.31 2dj4 n SER 12 Ca 0.12 -1.96 0.08 0.00 1.01 0.00 0.00 58.87 58.11 2dj4 n SER 12 Cb 0.06 -0.09 -0.04 0.00 -1.01 0.00 0.00 64.21 63.13 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 1.31 1.60 -3.22 1.43 4.76 -0.82 -4.94 118.16 118.28 2dj4 n LYS 13 Ca 0.16 -0.52 -0.39 0.00 -2.87 0.00 0.00 58.31 54.70 2dj4 n LYS 13 Cb 0.58 -1.30 -0.06 0.00 -1.84 0.00 0.00 35.03 32.42 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 -2.21 5.13 0.38 -0.18 0.11 -1.26 -4.38 120.40 117.99 2dj4 s VAL 14 Ca 0.11 1.11 0.04 0.00 -2.93 0.00 0.00 61.98 60.31 2dj4 s VAL 14 Cb 0.13 -3.89 -0.03 0.00 -1.53 0.00 0.00 36.38 31.06 2dj4 s VAL 14 CO 0.53 0.28 0.12 -0.54 -3.33 0.00 0.00 175.10 172.16 2dj4 s LYS 15 N 0.80 1.84 -0.08 1.54 -0.14 0.19 -4.88 119.74 119.02 2dj4 s LYS 15 Ca 0.29 -2.10 -0.06 0.00 -1.36 0.00 0.00 55.97 52.75 2dj4 s LYS 15 Cb -0.16 -0.60 0.03 0.00 -1.68 0.00 0.00 37.83 35.42 2dj4 s LYS 15 CO 0.13 -0.42 0.21 0.96 -0.76 0.00 0.00 175.35 175.46 2dj4 s ILE 16 N -3.27 -0.02 -0.05 2.17 -4.36 -1.26 -0.09 121.20 114.31 2dj4 s ILE 16 Ca 0.27 0.09 -0.02 0.00 -0.26 0.00 0.00 60.65 60.72 2dj4 s ILE 16 Cb 0.04 -0.31 0.03 0.00 1.25 0.00 0.00 42.46 43.47 2dj4 s ILE 16 CO 0.15 0.04 0.09 0.00 0.24 0.00 0.00 174.94 175.45 2dj4 s ALA 17 N 0.72 0.11 -0.08 2.27 0.00 -0.42 -4.97 121.76 119.39 2dj4 s ALA 17 Ca -0.05 0.30 -0.32 0.00 0.00 0.00 0.00 51.96 51.89 2dj4 s ALA 17 Cb -0.06 -0.65 0.14 0.00 0.00 0.00 0.00 23.12 22.54 2dj4 s ALA 17 CO -0.04 -0.48 1.35 0.20 0.00 0.00 0.00 175.76 176.79 2dj4 s GLY 18 N 2.12 -0.43 0.41 0.00 0.00 -1.26 -2.53 107.32 105.63 2dj4 s GLY 18 Ca 0.03 0.94 0.20 0.00 0.00 0.00 0.00 44.72 45.89 2dj4 s GLY 18 CO -0.04 0.20 1.82 -0.56 0.00 0.00 0.00 173.10 174.53 2dj4 h PRO 19 N 2.00 0.00 0.00 2.90 0.13 -1.97 -2.89 132.00 132.16 2dj4 h PRO 19 Ca -0.29 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.81 2dj4 h PRO 19 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2dj4 h PRO 19 CO 0.28 0.32 -0.13 0.78 -0.23 0.00 0.00 178.00 179.01 2dj4 h GLY 20 N 1.64 0.00 0.12 1.56 0.00 -1.75 -2.11 103.07 102.53 2dj4 h GLY 20 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2dj4 h GLY 20 CO 0.04 0.00 -0.93 1.04 0.00 0.00 0.00 176.54 176.69 2dj4 n LEU 21 N -3.74 0.94 0.00 3.11 4.77 -1.11 -4.88 117.00 116.10 2dj4 n LEU 21 Ca -0.02 -0.44 -0.26 0.00 -0.03 0.00 0.00 56.01 55.26 2dj4 n LEU 21 Cb 0.24 -0.03 0.22 0.00 -2.33 0.00 0.00 43.42 41.52 2dj4 n LEU 21 CO 0.31 0.23 0.49 0.61 -1.33 0.00 0.00 177.39 177.70 2dj4 n GLY 22 N 1.50 -2.94 0.17 -0.72 0.00 -0.79 -4.84 105.19 97.56 2dj4 n GLY 22 Ca 0.04 -1.45 0.12 0.00 0.00 0.00 0.00 46.02 44.73 2dj4 n GLY 22 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dj4 n SER 23 N -4.77 0.93 -2.51 1.61 7.64 -1.26 -4.27 113.62 111.00 2dj4 n SER 23 Ca 0.13 -0.74 -0.30 0.00 1.01 0.00 0.00 58.87 58.97 2dj4 n SER 23 Cb 0.51 0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.97 2dj4 n SER 23 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dj4 n GLY 24 N 1.41 4.85 3.87 0.23 0.00 -1.26 -4.85 105.19 109.43 2dj4 n GLY 24 Ca 0.09 -2.00 -0.37 0.00 0.00 0.00 0.00 46.02 43.74 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 -3.41 5.37 0.07 1.61 1.01 -1.26 -5.03 120.40 118.76 2dj4 s VAL 25 Ca 0.54 0.40 0.09 0.00 0.00 0.00 0.00 61.98 63.00 2dj4 s VAL 25 Cb 0.40 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 2dj4 s VAL 25 CO -0.22 0.61 -0.24 -0.13 0.00 0.00 0.00 175.10 175.11 2dj4 s ARG 26 N -1.02 1.52 0.66 2.72 0.52 -1.26 -0.10 118.95 121.99 2dj4 s ARG 26 Ca 0.18 -1.11 -0.17 0.00 -0.52 0.00 0.00 55.73 54.10 2dj4 s ARG 26 Cb -0.13 -1.75 0.00 0.00 0.52 0.00 0.00 34.95 33.58 2dj4 s ARG 26 CO 0.07 0.44 1.22 0.00 0.02 0.00 0.00 175.30 177.05 2dj4 s ALA 27 N -0.89 2.34 -1.44 2.13 0.00 0.12 -2.87 121.76 121.15 2dj4 s ALA 27 Ca 0.10 0.98 -0.10 0.00 0.00 0.00 0.00 51.96 52.95 2dj4 s ALA 27 Cb -0.10 -3.48 0.06 0.00 0.00 0.00 0.00 23.12 19.60 2dj4 s ALA 27 CO 0.03 -1.54 0.71 0.54 0.00 0.00 0.00 175.76 175.50 2dj4 n ARG 28 N -2.13 -4.66 -4.30 0.00 1.74 0.54 -4.38 116.66 103.47 2dj4 n ARG 28 Ca 0.14 0.64 -0.22 0.00 -0.77 0.00 0.00 57.85 57.64 2dj4 n ARG 28 Cb 0.50 -5.47 -0.13 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 -3.13 1.44 -0.34 1.55 1.01 -1.14 -5.01 120.40 114.79 2dj4 s VAL 29 Ca 0.47 -1.35 -0.29 0.00 0.00 0.00 0.00 61.98 60.81 2dj4 s VAL 29 Cb -0.23 -1.32 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 2dj4 s VAL 29 CO 0.58 -0.07 1.58 -0.22 0.00 0.00 0.00 175.10 176.96 2dj4 s LEU 30 N -1.66 3.64 -0.15 3.92 2.96 -1.26 -4.16 118.68 121.98 2dj4 s LEU 30 Ca 0.03 1.18 -0.00 0.00 -0.22 0.00 0.00 54.13 55.12 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 0.03 -1.46 -0.13 -1.10 -1.32 0.00 0.00 176.35 172.36 2dj4 s GLN 31 N 5.07 3.31 0.05 1.98 -1.52 0.64 -4.98 119.66 124.21 2dj4 s GLN 31 Ca 0.69 -0.71 -0.06 0.00 -1.95 0.00 0.00 55.36 53.33 2dj4 s GLN 31 Cb -0.19 -2.65 -0.01 0.00 -0.22 0.00 0.00 33.01 29.94 2dj4 s GLN 31 CO 0.32 0.11 0.12 0.45 -0.25 0.00 0.00 175.29 176.03 2dj4 s SER 32 N 0.61 0.17 0.30 5.90 0.15 -1.26 -0.02 113.70 119.55 2dj4 s SER 32 Ca -0.08 -0.55 -0.01 0.00 0.70 0.00 0.00 55.95 56.01 2dj4 s SER 32 Cb -0.16 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.41 2dj4 s SER 32 CO 0.03 -0.55 0.41 2.22 1.20 0.00 0.00 173.24 176.54 2dj4 n PHE 33 N 0.60 -1.26 -5.12 3.44 -1.74 -1.15 -2.03 117.46 110.19 2dj4 n PHE 33 Ca -0.18 -2.03 -0.31 0.00 -0.56 0.00 0.00 57.45 54.36 2dj4 n PHE 33 Cb 0.59 0.46 -0.17 0.00 1.52 0.00 0.00 39.48 41.88 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 -2.78 1.94 -0.39 1.97 2.01 -1.05 -2.96 115.64 114.37 2dj4 s THR 34 Ca 0.25 -0.95 -0.08 0.00 0.31 0.00 0.00 61.69 61.23 2dj4 s THR 34 Cb -0.01 -1.68 0.07 0.00 0.01 0.00 0.00 72.50 70.89 2dj4 s THR 34 CO 0.18 0.53 0.20 -0.69 -0.69 0.00 0.00 174.62 174.15 2dj4 s VAL 35 N 0.40 3.99 -0.41 3.82 1.01 0.61 -1.30 120.40 128.52 2dj4 s VAL 35 Ca -0.18 -1.35 -0.22 0.00 0.00 0.00 0.00 61.98 60.22 2dj4 s VAL 35 Cb -0.18 -3.40 0.02 0.00 0.00 0.00 0.00 36.38 32.82 2dj4 s VAL 35 CO 0.08 -0.40 0.74 -0.62 0.00 0.00 0.00 175.10 174.91 2dj4 s ASP 36 N 1.82 6.44 -0.10 3.32 -1.08 0.87 -0.80 116.67 127.14 2dj4 s ASP 36 Ca 0.02 0.01 0.14 0.00 -0.52 0.00 0.00 52.55 52.20 2dj4 s ASP 36 Cb -0.22 -2.37 0.28 0.00 -1.46 0.00 0.00 42.92 39.16 2dj4 s ASP 36 CO 0.02 -0.80 1.14 -1.54 0.52 0.00 0.00 175.17 174.50 2dj4 n SER 37 N 6.49 1.41 0.02 -0.34 3.41 -1.22 -0.63 113.62 122.75 2dj4 n SER 37 Ca 0.01 -2.86 -0.05 0.00 -0.26 0.00 0.00 58.87 55.72 2dj4 n SER 37 Cb 0.48 -0.38 0.17 0.00 -0.26 0.00 0.00 64.21 64.22 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 0.44 0.49 0.56 4.04 0.87 -1.84 -2.49 113.55 115.62 2dj4 h SER 38 Ca -0.04 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 2dj4 h SER 38 Cb 1.25 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 2dj4 h SER 38 CO 0.02 0.79 -0.26 0.29 -0.53 0.00 0.00 176.83 177.14 2dj4 n LYS 39 N -4.07 0.25 0.07 2.24 5.02 -1.26 -3.74 118.16 116.67 2dj4 n LYS 39 Ca -0.01 -0.11 -0.16 0.00 -2.02 0.00 0.00 58.31 56.01 2dj4 n LYS 39 Cb 0.46 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 33.83 2dj4 n LYS 39 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dj4 h ALA 40 N 3.22 0.23 0.00 7.82 0.00 -1.60 -3.43 119.26 125.49 2dj4 h ALA 40 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 54.91 53.87 2dj4 h ALA 40 Cb 0.47 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2dj4 h ALA 40 CO 0.00 1.10 0.00 0.41 0.00 0.00 0.00 179.25 180.76 2dj4 n GLY 41 N 1.62 0.35 0.88 0.00 0.00 -1.11 -0.12 105.19 106.81 2dj4 n GLY 41 Ca -0.14 -1.67 0.08 0.00 0.00 0.00 0.00 46.02 44.29 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 3.76 -4.80 0.99 -0.00 -1.26 -4.72 117.00 110.98 2dj4 n LEU 42 Ca 0.00 -2.79 -0.35 0.00 -0.00 0.00 0.00 56.01 52.88 2dj4 n LEU 42 Cb 0.00 -0.48 -0.04 0.00 -0.00 0.00 0.00 43.42 42.89 2dj4 n LEU 42 CO 0.00 0.69 0.71 0.00 -0.00 0.00 0.00 177.39 178.79 2dj4 s ALA 43 N -2.41 2.97 0.96 1.47 0.00 -1.26 -5.04 121.76 118.44 2dj4 s ALA 43 Ca 0.39 0.60 -0.12 0.00 0.00 0.00 0.00 51.96 52.83 2dj4 s ALA 43 Cb 0.30 -3.24 0.16 0.00 0.00 0.00 0.00 23.12 20.34 2dj4 s ALA 43 CO 0.11 -0.20 1.09 -1.25 0.00 0.00 0.00 175.76 175.51 2dj4 s PRO 44 N -2.97 0.75 -0.10 0.00 0.04 -1.26 -4.81 135.00 126.65 2dj4 s PRO 44 Ca 0.63 0.64 0.02 0.00 0.04 0.00 0.00 61.00 62.33 2dj4 s PRO 44 Cb -0.17 -1.76 0.01 0.00 0.04 0.00 0.00 34.50 32.62 2dj4 s PRO 44 CO 0.21 -2.54 -0.16 -1.17 0.04 0.00 0.00 177.00 173.38 2dj4 s LEU 45 N -6.37 1.75 0.07 -3.56 2.96 -1.26 -3.07 118.68 109.21 2dj4 s LEU 45 Ca 0.65 -0.41 0.05 0.00 -0.22 0.00 0.00 54.13 54.20 2dj4 s LEU 45 Cb -0.18 -1.07 -0.04 0.00 0.50 0.00 0.00 46.19 45.40 2dj4 s LEU 45 CO 0.57 0.04 -0.06 -0.70 -1.32 0.00 0.00 176.35 174.89 2dj4 s GLU 46 N 0.81 2.38 0.04 1.98 2.56 -0.63 -4.96 118.70 120.88 2dj4 s GLU 46 Ca -0.11 -0.88 -0.00 0.00 0.00 0.00 0.00 54.97 53.98 2dj4 s GLU 46 Cb -0.16 -2.44 -0.03 0.00 2.00 0.00 0.00 34.13 33.51 2dj4 s GLU 46 CO 0.01 0.54 -0.04 0.08 -0.56 0.00 0.00 175.26 175.30 2dj4 s VAL 47 N -1.19 0.21 -0.24 3.70 1.01 -1.26 -1.01 120.40 121.62 2dj4 s VAL 47 Ca 0.22 -1.28 -0.20 0.00 0.00 0.00 0.00 61.98 60.71 2dj4 s VAL 47 Cb -0.11 -0.79 0.06 0.00 0.00 0.00 0.00 36.38 35.54 2dj4 s VAL 47 CO 0.14 -0.68 0.62 -0.13 0.00 0.00 0.00 175.10 175.05 2dj4 s ARG 48 N -2.42 0.71 -0.22 2.72 0.52 0.12 -4.90 118.95 115.47 2dj4 s ARG 48 Ca -0.06 0.91 0.00 0.00 -0.52 0.00 0.00 55.73 56.06 2dj4 s ARG 48 Cb -0.03 0.30 0.03 0.00 0.52 0.00 0.00 34.95 35.77 2dj4 s ARG 48 CO -0.04 -0.10 -0.13 0.08 0.02 0.00 0.00 175.30 175.13 2dj4 s VAL 49 N 0.57 2.42 -0.20 3.52 1.01 -1.25 0.10 120.40 126.57 2dj4 s VAL 49 Ca -0.02 -1.07 -0.04 0.00 0.00 0.00 0.00 61.98 60.86 2dj4 s VAL 49 Cb -0.05 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.15 2dj4 s VAL 49 CO -0.03 0.32 -0.04 -0.76 0.00 0.00 0.00 175.10 174.59 2dj4 s LEU 50 N 1.28 3.00 1.42 3.92 2.01 0.62 -2.22 118.68 128.71 2dj4 s LEU 50 Ca 0.01 -0.31 -0.23 0.00 0.01 0.00 0.00 54.13 53.61 2dj4 s LEU 50 Cb -0.16 -1.75 0.36 0.00 0.01 0.00 0.00 46.19 44.66 2dj4 s LEU 50 CO -0.08 0.04 0.85 0.61 1.01 0.00 0.00 176.35 178.78 2dj4 n GLY 51 N 4.39 -3.64 0.26 -3.19 0.00 0.30 -1.37 105.19 101.95 2dj4 n GLY 51 Ca -0.18 -1.59 -0.12 0.00 0.00 0.00 0.00 46.02 44.13 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 -3.50 0.87 0.00 1.61 0.13 -1.89 -3.23 132.00 125.99 2dj4 h PRO 52 Ca -0.42 -0.46 -0.23 0.00 -0.87 0.00 0.00 66.00 64.02 2dj4 h PRO 52 Cb 1.30 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.41 2dj4 h PRO 52 CO 0.27 1.10 -1.41 0.00 -0.23 0.00 0.00 178.00 177.74 2dj4 h ARG 53 N 0.71 0.00 0.00 0.86 -0.00 -1.92 -3.48 114.38 110.56 2dj4 h ARG 53 Ca 0.06 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.54 2dj4 h ARG 53 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.94 2dj4 h ARG 53 CO 0.09 0.56 0.00 0.41 0.00 0.00 0.00 179.97 181.03 2dj4 n GLY 54 N 1.45 0.32 3.87 0.04 0.00 -1.22 -5.15 105.19 104.50 2dj4 n GLY 54 Ca -0.10 0.00 -0.31 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 3.62 -0.25 0.99 2.96 -1.26 -4.76 118.68 119.98 2dj4 s LEU 55 Ca 0.00 1.30 0.02 0.00 -0.22 0.00 0.00 54.13 55.23 2dj4 s LEU 55 Cb 0.00 -4.24 0.05 0.00 0.50 0.00 0.00 46.19 42.50 2dj4 s LEU 55 CO 0.00 -0.58 -0.11 0.54 -1.32 0.00 0.00 176.35 174.88 2dj4 s VAL 56 N -2.67 2.24 0.00 1.68 0.11 -1.26 -0.54 120.40 119.96 2dj4 s VAL 56 Ca 0.54 -1.49 0.04 0.00 -2.93 0.00 0.00 61.98 58.14 2dj4 s VAL 56 Cb -0.10 -2.25 -0.03 0.00 -1.53 0.00 0.00 36.38 32.46 2dj4 s VAL 56 CO 0.38 0.06 -0.11 -1.61 -3.33 0.00 0.00 175.10 170.49 2dj4 s GLU 57 N 1.15 2.43 1.00 1.54 0.41 -0.94 -5.04 118.70 119.25 2dj4 s GLU 57 Ca -0.06 -0.78 -0.12 0.00 -0.41 0.00 0.00 54.97 53.60 2dj4 s GLU 57 Cb -0.19 -2.40 0.19 0.00 -1.78 0.00 0.00 34.13 29.95 2dj4 s GLU 57 CO -0.06 0.59 1.09 -1.25 -0.49 0.00 0.00 175.26 175.15 2dj4 s PRO 58 N -1.27 0.42 0.05 0.39 0.04 -1.26 -3.89 135.00 129.47 2dj4 s PRO 58 Ca 0.15 0.52 -0.04 0.00 0.04 0.00 0.00 61.00 61.67 2dj4 s PRO 58 Cb -0.11 -1.74 -0.02 0.00 0.04 0.00 0.00 34.50 32.68 2dj4 s PRO 58 CO 0.05 -2.74 0.06 0.14 0.04 0.00 0.00 177.00 174.55 2dj4 s VAL 59 N -2.96 0.16 -0.01 -0.36 -7.23 -1.26 -4.84 120.40 103.89 2dj4 s VAL 59 Ca 0.65 -1.34 0.02 0.00 -1.81 0.00 0.00 61.98 59.50 2dj4 s VAL 59 Cb -0.19 -1.13 -0.03 0.00 0.56 0.00 0.00 36.38 35.59 2dj4 s VAL 59 CO 0.58 -0.74 -0.04 0.21 -0.31 0.00 0.00 175.10 174.79 2dj4 s ASN 60 N -2.47 4.82 -0.08 4.85 2.47 -1.11 -5.01 114.94 118.40 2dj4 s ASN 60 Ca -0.00 -0.07 -0.01 0.00 0.42 0.00 0.00 52.86 53.21 2dj4 s ASN 60 Cb 0.02 -1.20 0.03 0.00 -1.45 0.00 0.00 41.25 38.65 2dj4 s ASN 60 CO -0.07 0.30 -0.03 0.54 -3.72 0.00 0.00 177.10 174.12 2dj4 s VAL 61 N -0.99 0.64 -0.03 -5.21 0.11 -1.26 -3.74 120.40 109.92 2dj4 s VAL 61 Ca 0.17 -0.05 0.01 0.00 -2.93 0.00 0.00 61.98 59.17 2dj4 s VAL 61 Cb -0.11 -0.73 0.02 0.00 -1.53 0.00 0.00 36.38 34.02 2dj4 s VAL 61 CO 0.07 0.30 -0.03 -0.69 -3.33 0.00 0.00 175.10 171.42 2dj4 s VAL 62 N 1.78 0.37 -0.09 2.04 1.01 -0.35 -4.98 120.40 120.17 2dj4 s VAL 62 Ca 0.04 -0.06 -0.23 0.00 0.00 0.00 0.00 61.98 61.72 2dj4 s VAL 62 Cb -0.13 -0.40 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 2dj4 s VAL 62 CO -0.06 0.17 0.69 -0.62 0.00 0.00 0.00 175.10 175.28 2dj4 s ASP 63 N 0.71 6.93 0.09 3.32 2.15 -1.26 0.21 116.67 128.82 2dj4 s ASP 63 Ca -0.08 1.12 -0.15 0.00 0.43 0.00 0.00 52.55 53.87 2dj4 s ASP 63 Cb -0.11 -2.40 -0.12 0.00 -0.30 0.00 0.00 42.92 39.99 2dj4 s ASP 63 CO -0.01 -0.15 1.36 0.78 -0.17 0.00 0.00 175.17 176.98 2dj4 h ASN 64 N 6.88 0.78 0.00 -0.34 2.35 -1.66 -3.48 115.58 120.11 2dj4 h ASN 64 Ca -0.39 -0.54 0.00 0.00 -0.55 0.00 0.00 56.30 54.82 2dj4 h ASN 64 Cb 1.18 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 39.33 2dj4 h ASN 64 CO 0.76 1.18 0.00 0.61 -1.65 0.00 0.00 177.43 178.33 2dj4 n GLY 65 N 0.40 2.74 0.13 2.83 0.00 -1.26 -4.91 105.19 105.12 2dj4 n GLY 65 Ca -0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 2dj4 n GLY 65 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2dj4 n ASP 66 N 0.00 2.04 0.00 1.61 2.03 -1.26 -4.96 116.55 116.01 2dj4 n ASP 66 Ca 0.00 0.19 0.00 0.00 0.52 0.00 0.00 54.79 55.50 2dj4 n ASP 66 Cb 0.00 -0.80 0.00 0.00 -0.72 0.00 0.00 41.12 39.60 2dj4 n ASP 66 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dj4 n GLY 67 N 1.88 0.00 3.63 0.27 0.00 -1.26 -5.02 105.19 104.68 2dj4 n GLY 67 Ca -0.37 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.06 2.61 -4.23 -1.26 -3.41 115.64 109.28 2dj4 s THR 68 Ca 0.00 -1.34 -0.04 0.00 -1.18 0.00 0.00 61.69 59.13 2dj4 s THR 68 Cb 0.00 -2.59 0.03 0.00 1.34 0.00 0.00 72.50 71.28 2dj4 s THR 68 CO 0.00 0.00 0.15 -1.00 -0.54 0.00 0.00 174.62 173.23 2dj4 s HIS 69 N -3.07 -0.17 -0.13 3.99 3.76 0.02 -1.57 115.29 118.12 2dj4 s HIS 69 Ca 0.23 0.47 -0.13 0.00 -0.15 0.00 0.00 55.06 55.48 2dj4 s HIS 69 Cb -0.02 -0.02 -0.05 0.00 1.11 0.00 0.00 32.58 33.60 2dj4 s HIS 69 CO 0.15 -0.14 0.29 0.99 -0.85 0.00 0.00 174.74 175.18 2dj4 s THR 70 N 0.74 5.29 -0.25 1.30 2.01 0.13 -0.28 115.64 124.59 2dj4 s THR 70 Ca -0.06 0.54 0.01 0.00 0.31 0.00 0.00 61.69 62.49 2dj4 s THR 70 Cb -0.07 -3.61 0.07 0.00 0.01 0.00 0.00 72.50 68.90 2dj4 s THR 70 CO -0.04 0.45 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.63 2dj4 s VAL 71 N 0.03 1.47 -0.05 3.82 1.01 -1.16 -1.21 120.40 124.32 2dj4 s VAL 71 Ca 0.17 -1.29 -0.07 0.00 0.00 0.00 0.00 61.98 60.78 2dj4 s VAL 71 Cb -0.13 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 2dj4 s VAL 71 CO 0.05 -0.21 0.22 0.42 0.00 0.00 0.00 175.10 175.59 2dj4 s THR 72 N 1.40 5.37 0.27 3.92 -4.23 -1.24 -2.96 115.64 118.17 2dj4 s THR 72 Ca -0.03 0.24 -0.21 0.00 -1.18 0.00 0.00 61.69 60.51 2dj4 s THR 72 Cb -0.19 -3.51 0.02 0.00 1.34 0.00 0.00 72.50 70.16 2dj4 s THR 72 CO -0.08 0.49 0.70 -0.72 -0.54 0.00 0.00 174.62 174.47 2dj4 s TYR 73 N -1.16 -0.20 -0.17 3.99 -0.85 0.97 -2.77 117.35 117.17 2dj4 s TYR 73 Ca 0.22 -0.24 -0.04 0.00 -0.52 0.00 0.00 57.07 56.49 2dj4 s TYR 73 Cb -0.13 0.68 0.08 0.00 0.38 0.00 0.00 41.96 42.97 2dj4 s TYR 73 CO 0.11 -1.20 0.21 0.99 -1.52 0.00 0.00 175.55 174.14 2dj4 s THR 74 N -3.91 -0.32 -0.70 -3.49 2.01 -1.26 -0.26 115.64 107.70 2dj4 s THR 74 Ca 0.11 0.05 -0.26 0.00 0.31 0.00 0.00 61.69 61.89 2dj4 s THR 74 Cb -0.05 -0.56 -0.03 0.00 0.01 0.00 0.00 72.50 71.87 2dj4 s THR 74 CO 0.06 -0.08 1.89 -2.16 -0.69 0.00 0.00 174.62 173.64 2dj4 s PRO 75 N 2.33 2.60 0.23 4.92 0.04 -1.26 -4.85 135.00 139.01 2dj4 s PRO 75 Ca 0.05 0.35 -0.02 0.00 0.04 0.00 0.00 61.00 61.43 2dj4 s PRO 75 Cb -0.14 -4.58 0.49 0.00 0.04 0.00 0.00 34.50 30.30 2dj4 s PRO 75 CO -0.10 -2.92 1.20 -1.13 0.04 0.00 0.00 177.00 174.08 2dj4 n SER 76 N 13.13 -0.17 -2.77 6.66 3.41 -1.26 -0.34 113.62 132.28 2dj4 n SER 76 Ca 0.26 1.31 -0.14 0.00 -0.26 0.00 0.00 58.87 60.04 2dj4 n SER 76 Cb 0.51 -0.44 -0.04 0.00 -0.26 0.00 0.00 64.21 63.97 2dj4 n SER 76 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dj4 n GLN 77 N -5.15 0.65 -3.13 4.33 10.64 -1.26 -3.80 117.38 119.66 2dj4 n GLN 77 Ca 0.16 -1.99 -0.18 0.00 -1.83 0.00 0.00 57.00 53.16 2dj4 n GLN 77 Cb 0.51 1.17 0.00 0.00 -0.86 0.00 0.00 30.24 31.06 2dj4 n GLN 77 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.06 173.40 2dj4 s GLU 78 N -2.88 2.75 0.00 2.61 4.04 -1.26 -4.57 118.70 119.38 2dj4 s GLU 78 Ca 0.14 -1.32 0.00 0.00 0.04 0.00 0.00 54.97 53.83 2dj4 s GLU 78 Cb 0.01 -2.67 0.00 0.00 0.02 0.00 0.00 34.13 31.48 2dj4 s GLU 78 CO 0.10 -0.27 0.00 0.41 -1.84 0.00 0.00 175.26 173.66 2dj4 n GLY 79 N -1.80 1.58 3.56 -3.83 0.00 -0.93 -4.93 105.19 98.85 2dj4 n GLY 79 Ca 0.07 -2.07 -0.27 0.00 0.00 0.00 0.00 46.02 43.76 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 -1.32 2.55 0.78 1.61 0.04 -1.26 -0.01 135.00 137.39 2dj4 s PRO 80 Ca 0.00 -0.47 -0.08 0.00 0.04 0.00 0.00 61.00 60.49 2dj4 s PRO 80 Cb 0.00 -5.10 0.11 0.00 0.04 0.00 0.00 34.50 29.55 2dj4 s PRO 80 CO 0.00 -3.50 1.09 0.71 0.04 0.00 0.00 177.00 175.35 2dj4 s TYR 81 N 10.26 2.30 -0.15 0.56 1.51 -0.30 -3.42 117.35 128.11 2dj4 s TYR 81 Ca 0.70 0.27 -0.04 0.00 -1.01 0.00 0.00 57.07 56.98 2dj4 s TYR 81 Cb -0.05 -3.40 0.07 0.00 -0.11 0.00 0.00 41.96 38.47 2dj4 s TYR 81 CO 0.02 -1.80 0.26 1.41 -1.11 0.00 0.00 175.55 174.32 2dj4 s MET 82 N -5.40 0.16 -0.46 -0.62 1.75 -0.47 -2.48 119.30 111.78 2dj4 s MET 82 Ca 0.65 0.62 -0.08 0.00 -1.25 0.00 0.00 55.69 55.63 2dj4 s MET 82 Cb -0.08 -0.30 0.12 0.00 2.84 0.00 0.00 34.83 37.41 2dj4 s MET 82 CO 0.47 -0.38 0.33 0.08 -0.65 0.00 0.00 175.02 174.87 2dj4 s VAL 83 N 2.40 4.10 0.32 10.11 1.01 0.31 -0.28 120.40 138.38 2dj4 s VAL 83 Ca 0.03 -1.80 -0.18 0.00 0.00 0.00 0.00 61.98 60.03 2dj4 s VAL 83 Cb -0.13 -3.71 -0.09 0.00 0.00 0.00 0.00 36.38 32.45 2dj4 s VAL 83 CO -0.09 -0.75 0.78 -0.55 0.00 0.00 0.00 175.10 174.48 2dj4 s SER 84 N 2.55 6.90 -0.04 3.32 0.15 0.11 -0.97 113.70 125.73 2dj4 s SER 84 Ca 0.06 1.41 -0.03 0.00 0.70 0.00 0.00 55.95 58.09 2dj4 s SER 84 Cb -0.26 -2.42 0.01 0.00 -1.71 0.00 0.00 66.02 61.64 2dj4 s SER 84 CO -0.01 -0.17 0.10 -0.69 1.20 0.00 0.00 173.24 173.66 2dj4 s VAL 85 N -1.90 -0.01 0.33 4.45 1.01 -1.26 -0.70 120.40 122.33 2dj4 s VAL 85 Ca 0.53 0.02 0.05 0.00 0.00 0.00 0.00 61.98 62.58 2dj4 s VAL 85 Cb -0.12 -0.14 -0.07 0.00 0.00 0.00 0.00 36.38 36.05 2dj4 s VAL 85 CO 0.18 0.01 0.04 -0.75 0.00 0.00 0.00 175.10 174.57 2dj4 s LYS 86 N 0.18 1.68 -0.28 2.72 2.20 -0.18 -3.35 119.74 122.70 2dj4 s LYS 86 Ca -0.01 -1.93 0.01 0.00 -0.36 0.00 0.00 55.97 53.68 2dj4 s LYS 86 Cb -0.02 -1.03 0.17 0.00 -1.51 0.00 0.00 37.83 35.45 2dj4 s LYS 86 CO -0.00 -0.14 0.51 -0.47 -0.36 0.00 0.00 175.35 174.89 2dj4 s TYR 87 N -3.17 -1.39 -0.88 4.03 5.04 -0.96 -1.60 117.35 118.43 2dj4 s TYR 87 Ca 0.35 1.05 -0.05 0.00 -2.44 0.00 0.00 57.07 55.99 2dj4 s TYR 87 Cb 0.08 0.22 0.01 0.00 0.35 0.00 0.00 41.96 42.62 2dj4 s TYR 87 CO 0.15 -0.93 0.76 0.00 -1.34 0.00 0.00 175.55 174.19 2dj4 n ALA 88 N 5.40 -0.96 -2.63 3.97 0.00 -1.17 -2.67 120.51 122.45 2dj4 n ALA 88 Ca 0.00 0.21 -0.18 0.00 0.00 0.00 0.00 53.44 53.48 2dj4 n ALA 88 Cb 0.51 -3.41 0.01 0.00 0.00 0.00 0.00 19.45 16.57 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 -1.67 -5.13 -3.51 0.00 8.00 -1.26 -4.99 116.55 107.99 2dj4 n ASP 89 Ca -0.03 -0.14 -0.23 0.00 0.71 0.00 0.00 54.79 55.10 2dj4 n ASP 89 Cb 0.55 -4.09 -0.14 0.00 -0.02 0.00 0.00 41.12 37.43 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 -5.20 0.19 -0.31 -1.24 0.41 -1.09 -5.10 118.70 106.37 2dj4 s GLU 90 Ca 0.14 -0.14 -0.32 0.00 -0.41 0.00 0.00 54.97 54.24 2dj4 s GLU 90 Cb -0.06 -1.20 -0.09 0.00 -1.78 0.00 0.00 34.13 31.00 2dj4 s GLU 90 CO 0.17 -0.84 2.22 0.39 -0.49 0.00 0.00 175.26 176.71 2dj4 n GLU 91 N 5.29 1.39 -1.27 1.61 1.02 -1.26 -2.25 120.64 125.17 2dj4 n GLU 91 Ca -0.05 0.37 -0.37 0.00 -0.02 0.00 0.00 57.16 57.08 2dj4 n GLU 91 Cb 0.47 -2.78 0.05 0.00 -0.02 0.00 0.00 31.44 29.16 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 7.45 1.33 0.97 -3.67 -5.35 -1.21 -4.79 119.36 114.09 2dj4 n ILE 92 Ca 0.37 -0.44 0.05 0.00 -0.27 0.00 0.00 62.75 62.46 2dj4 n ILE 92 Cb 0.32 -0.51 0.28 0.00 -1.74 0.00 0.00 39.64 37.99 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 0.14 0.49 0.00 6.28 -0.04 -1.26 -1.71 135.00 138.90 2dj4 n PRO 93 Ca 0.09 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.58 2dj4 n PRO 93 Cb 0.49 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 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 -0.80 2.00 -4.23 0.54 5.12 -1.26 -5.01 116.66 113.02 2dj4 n ARG 94 Ca 0.07 -0.57 -0.27 0.00 -1.93 0.00 0.00 57.85 55.15 2dj4 n ARG 94 Cb 0.03 -1.02 -0.08 0.00 -1.16 0.00 0.00 32.46 30.23 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 -1.08 4.62 1.26 0.55 0.15 -0.69 -4.25 113.70 114.25 2dj4 s SER 95 Ca 0.07 -0.43 -0.21 0.00 0.70 0.00 0.00 55.95 56.07 2dj4 s SER 95 Cb 0.06 -0.93 0.31 0.00 -1.71 0.00 0.00 66.02 63.75 2dj4 s SER 95 CO 0.18 0.10 1.11 -0.81 1.20 0.00 0.00 173.24 175.02 2dj4 n PRO 96 N 0.00 -3.20 -4.10 5.44 -0.04 -1.26 -4.78 135.00 127.06 2dj4 n PRO 96 Ca -0.10 -1.78 -0.33 0.00 -0.04 0.00 0.00 63.50 61.26 2dj4 n PRO 96 Cb 0.55 -1.67 -0.16 0.00 -0.04 0.00 0.00 33.50 32.18 2dj4 n PRO 96 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2dj4 s PHE 97 N -3.01 2.75 -0.59 0.54 0.08 -0.14 -4.95 117.98 112.66 2dj4 s PHE 97 Ca 0.72 -1.67 -0.27 0.00 0.12 0.00 0.00 56.93 55.84 2dj4 s PHE 97 Cb -0.07 -1.88 0.03 0.00 -0.57 0.00 0.00 43.02 40.54 2dj4 s PHE 97 CO 0.55 -0.80 1.12 0.15 -0.10 0.00 0.00 175.22 176.15 2dj4 s LYS 98 N 1.30 3.41 -0.33 0.44 1.02 -1.26 -0.53 119.74 123.79 2dj4 s LYS 98 Ca 0.03 0.02 0.00 0.00 0.02 0.00 0.00 55.97 56.04 2dj4 s LYS 98 Cb -0.14 -4.05 0.08 0.00 -0.52 0.00 0.00 37.83 33.20 2dj4 s LYS 98 CO -0.12 -1.68 0.04 0.08 -0.92 0.00 0.00 175.35 172.75 2dj4 s VAL 99 N 4.73 2.77 -0.65 3.17 1.01 -1.04 -5.01 120.40 125.38 2dj4 s VAL 99 Ca 0.38 -1.81 -0.26 0.00 0.00 0.00 0.00 61.98 60.28 2dj4 s VAL 99 Cb -0.09 -2.78 0.04 0.00 0.00 0.00 0.00 36.38 33.55 2dj4 s VAL 99 CO 0.22 -0.35 1.15 -0.75 0.00 0.00 0.00 175.10 175.36 2dj4 s LYS 100 N 1.12 3.28 0.55 2.72 2.20 -1.26 -1.15 119.74 127.20 2dj4 s LYS 100 Ca 0.01 -0.22 -0.19 0.00 -0.36 0.00 0.00 55.97 55.21 2dj4 s LYS 100 Cb -0.20 -4.12 -0.05 0.00 -1.51 0.00 0.00 37.83 31.94 2dj4 s LYS 100 CO -0.04 -1.86 1.12 0.08 -0.36 0.00 0.00 175.35 174.29 2dj4 s VAL 101 N 4.94 3.23 0.18 4.02 1.01 0.99 -4.63 120.40 130.15 2dj4 s VAL 101 Ca 0.34 0.74 0.11 0.00 0.00 0.00 0.00 61.98 63.16 2dj4 s VAL 101 Cb -0.10 -3.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 2dj4 s VAL 101 CO 0.18 -0.19 -0.21 -0.76 0.00 0.00 0.00 175.10 174.12 2dj4 s LEU 102 N -3.92 2.56 -0.04 3.92 1.43 0.86 -2.18 118.68 121.31 2dj4 s LEU 102 Ca 0.71 -0.78 -0.30 0.00 -1.03 0.00 0.00 54.13 52.74 2dj4 s LEU 102 Cb -0.23 -1.30 -0.05 0.00 0.03 0.00 0.00 46.19 44.64 2dj4 s LEU 102 CO 0.28 0.12 1.47 -2.16 0.23 0.00 0.00 176.35 176.30 2dj4 s PRO 103 N -2.65 4.24 0.35 1.29 0.04 -1.26 0.16 135.00 137.16 2dj4 s PRO 103 Ca 0.21 2.01 0.28 0.00 0.04 0.00 0.00 61.00 63.54 2dj4 s PRO 103 Cb -0.08 -3.74 1.15 0.00 0.04 0.00 0.00 34.50 31.87 2dj4 s PRO 103 CO 0.11 -0.69 1.16 2.41 0.04 0.00 0.00 177.00 180.02 2dj4 n THR 104 N 5.04 -0.14 -3.49 1.26 -1.04 -1.26 -3.74 114.28 110.91 2dj4 n THR 104 Ca 0.15 1.28 -0.39 0.00 -2.04 0.00 0.00 64.05 63.05 2dj4 n THR 104 Cb 0.43 -2.10 -0.10 0.00 -1.82 0.00 0.00 70.33 66.74 2dj4 n THR 104 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2dj4 s TYR 105 N -4.71 3.23 -0.24 -1.42 1.51 -1.26 -5.00 117.35 109.47 2dj4 s TYR 105 Ca -0.05 0.26 -0.24 0.00 -1.01 0.00 0.00 57.07 56.04 2dj4 s TYR 105 Cb 0.22 -2.48 -0.01 0.00 -0.11 0.00 0.00 41.96 39.59 2dj4 s TYR 105 CO 0.62 -0.19 0.78 0.16 -1.11 0.00 0.00 175.55 175.81 2dj4 s ASP 106 N 1.70 6.79 -1.30 2.29 1.47 -1.25 -4.98 116.67 121.40 2dj4 s ASP 106 Ca 0.11 0.98 -0.17 0.00 1.18 0.00 0.00 52.55 54.65 2dj4 s ASP 106 Cb -0.16 -2.42 0.09 0.00 -0.34 0.00 0.00 42.92 40.09 2dj4 s ASP 106 CO 0.10 -0.47 1.74 0.00 0.68 0.00 0.00 175.17 177.23 2dj4 n ALA 107 N 5.85 3.83 1.95 2.11 0.00 -1.26 -5.20 120.51 127.80 2dj4 n ALA 107 Ca 0.04 -3.92 0.16 0.00 0.00 0.00 0.00 53.44 49.71 2dj4 n ALA 107 Cb 0.48 -3.50 0.93 0.00 0.00 0.00 0.00 19.45 17.35 2dj4 n ALA 107 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37