#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 4.01 0.09 1.61 0.01 -1.26 -5.16 113.70 113.01 2dj4 s SER 2 Ca 0.00 -1.16 0.06 0.00 1.31 0.00 0.00 55.95 56.16 2dj4 s SER 2 Cb 0.00 -0.44 -0.03 0.00 0.21 0.00 0.00 66.02 65.76 2dj4 s SER 2 CO 0.00 -0.32 -0.15 -0.44 0.41 0.00 0.00 173.24 172.74 2dj4 s SER 3 N -3.71 1.91 0.00 2.44 0.01 -1.26 -5.06 113.70 108.04 2dj4 s SER 3 Ca 0.35 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.92 2dj4 s SER 3 Cb 0.04 -0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.20 2dj4 s SER 3 CO 0.19 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.37 2dj4 n GLY 4 N 1.02 3.54 4.46 3.44 0.00 -1.26 -4.95 105.19 111.44 2dj4 n GLY 4 Ca -0.19 -1.51 -0.40 0.00 0.00 0.00 0.00 46.02 43.93 2dj4 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dj4 n SER 5 N 0.00 -1.45 -3.63 1.61 2.88 -1.26 -4.90 113.62 106.87 2dj4 n SER 5 Ca 0.00 -1.23 -0.23 0.00 -1.33 0.00 0.00 58.87 56.08 2dj4 n SER 5 Cb 0.00 -1.75 -0.17 0.00 -0.75 0.00 0.00 64.21 61.54 2dj4 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dj4 s SER 6 N -3.48 1.80 0.00 -3.46 0.15 -1.26 -5.01 113.70 102.44 2dj4 s SER 6 Ca 0.66 -0.31 0.00 0.00 0.70 0.00 0.00 55.95 57.00 2dj4 s SER 6 Cb -0.38 -0.16 0.00 0.00 -1.71 0.00 0.00 66.02 63.77 2dj4 s SER 6 CO 1.01 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 175.75 2dj4 n GLY 7 N 5.29 -1.80 3.78 9.45 0.00 -1.26 -5.11 105.19 115.53 2dj4 n GLY 7 Ca -0.05 0.71 -0.32 0.00 0.00 0.00 0.00 46.02 46.35 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 0.00 3.48 -0.23 1.61 0.11 -1.26 -4.93 120.40 119.18 2dj4 s VAL 8 Ca 0.00 0.62 -0.13 0.00 -2.93 0.00 0.00 61.98 59.54 2dj4 s VAL 8 Cb 0.00 -3.16 -0.04 0.00 -1.53 0.00 0.00 36.38 31.65 2dj4 s VAL 8 CO 0.00 -0.49 0.27 -0.69 -3.33 0.00 0.00 175.10 170.86 2dj4 s VAL 9 N -2.57 5.28 -0.37 2.04 1.01 -1.26 -4.72 120.40 119.81 2dj4 s VAL 9 Ca 0.64 0.42 0.04 0.00 0.00 0.00 0.00 61.98 63.07 2dj4 s VAL 9 Cb -0.18 -3.61 0.11 0.00 0.00 0.00 0.00 36.38 32.70 2dj4 s VAL 9 CO 0.45 0.29 0.09 -1.81 0.00 0.00 0.00 175.10 174.13 2dj4 s ASP 10 N 1.10 4.62 0.00 3.32 1.11 0.71 -4.95 116.67 122.58 2dj4 s ASP 10 Ca 0.13 -2.26 0.12 0.00 0.18 0.00 0.00 52.55 50.71 2dj4 s ASP 10 Cb -0.14 -1.56 0.71 0.00 1.07 0.00 0.00 42.92 43.00 2dj4 s ASP 10 CO 0.06 -0.36 1.14 -0.81 1.18 0.00 0.00 175.17 176.38 2dj4 n PRO 11 N 4.10 0.49 0.00 8.23 -0.04 -1.26 -1.95 135.00 144.56 2dj4 n PRO 11 Ca 0.04 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.61 2dj4 n PRO 11 Cb 0.40 -1.38 0.05 0.00 -0.04 0.00 0.00 33.50 32.53 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 -0.88 1.44 -0.23 3.54 7.64 -1.26 -4.00 113.62 119.87 2dj4 n SER 12 Ca 0.09 -1.15 0.11 0.00 1.01 0.00 0.00 58.87 58.93 2dj4 n SER 12 Cb 0.04 0.54 0.08 0.00 -1.01 0.00 0.00 64.21 63.86 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 -0.67 0.61 -3.13 1.43 4.76 -0.82 -4.88 118.16 115.45 2dj4 n LYS 13 Ca 0.08 -0.46 -0.40 0.00 -2.87 0.00 0.00 58.31 54.66 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 -2.71 5.04 0.32 -0.18 0.11 -1.26 -4.32 120.40 117.40 2dj4 s VAL 14 Ca 0.16 1.17 0.04 0.00 -2.93 0.00 0.00 61.98 60.42 2dj4 s VAL 14 Cb 0.18 -3.94 -0.06 0.00 -1.53 0.00 0.00 36.38 31.03 2dj4 s VAL 14 CO 0.67 0.13 0.04 -0.54 -3.33 0.00 0.00 175.10 172.06 2dj4 s LYS 15 N 1.78 1.65 -0.04 1.54 1.02 0.38 -4.90 119.74 121.17 2dj4 s LYS 15 Ca 0.29 -1.90 -0.02 0.00 0.02 0.00 0.00 55.97 54.36 2dj4 s LYS 15 Cb -0.16 -0.95 0.02 0.00 -0.52 0.00 0.00 37.83 36.22 2dj4 s LYS 15 CO 0.11 -0.14 0.08 0.96 -0.92 0.00 0.00 175.35 175.43 2dj4 s ILE 16 N -3.22 -0.04 -0.03 2.17 -4.36 -1.26 0.16 121.20 114.62 2dj4 s ILE 16 Ca 0.35 0.13 -0.01 0.00 -0.26 0.00 0.00 60.65 60.87 2dj4 s ILE 16 Cb 0.08 -0.14 0.03 0.00 1.25 0.00 0.00 42.46 43.69 2dj4 s ILE 16 CO 0.15 0.06 0.06 0.00 0.24 0.00 0.00 174.94 175.44 2dj4 s ALA 17 N 0.76 0.02 0.00 2.27 0.00 -0.39 -4.97 121.76 119.44 2dj4 s ALA 17 Ca -0.06 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.28 2dj4 s ALA 17 Cb -0.08 -0.33 0.00 0.00 0.00 0.00 0.00 23.12 22.71 2dj4 s ALA 17 CO -0.03 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 175.98 2dj4 n GLY 18 N 4.30 -0.23 0.21 0.00 0.00 -1.26 -2.03 105.19 106.17 2dj4 n GLY 18 Ca -0.25 -1.01 -0.05 0.00 0.00 0.00 0.00 46.02 44.70 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 0.41 -0.39 1.61 0.13 -1.97 -2.75 132.00 129.04 2dj4 h PRO 19 Ca 0.00 -0.22 0.05 0.00 -0.87 0.00 0.00 66.00 64.96 2dj4 h PRO 19 Cb 0.00 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.12 2dj4 h PRO 19 CO 0.00 0.78 0.26 0.78 -0.23 0.00 0.00 178.00 179.59 2dj4 h GLY 20 N 1.17 0.37 0.84 1.56 0.00 -1.74 -0.79 103.07 104.48 2dj4 h GLY 20 Ca 0.02 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2dj4 h GLY 20 CO 0.08 0.10 -0.85 1.04 0.00 0.00 0.00 176.54 176.91 2dj4 n LEU 21 N -4.48 0.64 0.00 3.11 4.77 -1.16 -4.92 117.00 114.96 2dj4 n LEU 21 Ca 0.05 0.08 -0.16 0.00 -0.03 0.00 0.00 56.01 55.95 2dj4 n LEU 21 Cb 0.23 -0.14 0.14 0.00 -2.33 0.00 0.00 43.42 41.33 2dj4 n LEU 21 CO 0.35 0.01 0.24 0.61 -1.33 0.00 0.00 177.39 177.27 2dj4 n GLY 22 N 1.36 -3.27 0.03 -0.72 0.00 -0.30 -4.84 105.19 97.45 2dj4 n GLY 22 Ca 0.03 -1.36 0.11 0.00 0.00 0.00 0.00 46.02 44.80 2dj4 n GLY 22 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dj4 n SER 23 N -4.25 0.55 -2.17 1.61 2.88 -1.26 -4.39 113.62 106.60 2dj4 n SER 23 Ca 0.08 -0.21 -0.19 0.00 -1.33 0.00 0.00 58.87 57.21 2dj4 n SER 23 Cb 0.31 1.03 -0.06 0.00 -0.75 0.00 0.00 64.21 64.74 2dj4 n SER 23 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dj4 n GLY 24 N 1.35 3.83 3.87 0.46 0.00 -1.26 -4.81 105.19 108.63 2dj4 n GLY 24 Ca 0.01 -1.42 -0.36 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.30 5.28 0.14 1.61 1.01 -1.26 -5.02 120.40 120.86 2dj4 s VAL 25 Ca 0.51 0.35 0.11 0.00 0.00 0.00 0.00 61.98 62.94 2dj4 s VAL 25 Cb 0.31 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 2dj4 s VAL 25 CO -0.11 0.48 -0.25 -0.13 0.00 0.00 0.00 175.10 175.09 2dj4 s ARG 26 N -1.42 1.48 0.58 2.72 0.52 -1.26 0.09 118.95 121.66 2dj4 s ARG 26 Ca 0.24 -1.36 -0.17 0.00 -0.52 0.00 0.00 55.73 53.92 2dj4 s ARG 26 Cb -0.14 -1.92 -0.04 0.00 0.52 0.00 0.00 34.95 33.37 2dj4 s ARG 26 CO 0.12 0.45 1.10 0.00 0.02 0.00 0.00 175.30 176.98 2dj4 s ALA 27 N -1.19 2.66 -1.51 2.13 0.00 0.22 -3.48 121.76 120.59 2dj4 s ALA 27 Ca 0.16 0.62 -0.12 0.00 0.00 0.00 0.00 51.96 52.61 2dj4 s ALA 27 Cb -0.10 -3.30 0.08 0.00 0.00 0.00 0.00 23.12 19.80 2dj4 s ALA 27 CO 0.07 -0.87 0.92 0.54 0.00 0.00 0.00 175.76 176.42 2dj4 n ARG 28 N -1.76 -5.25 -4.09 0.00 1.74 0.10 -4.33 116.66 103.06 2dj4 n ARG 28 Ca 0.10 0.58 -0.14 0.00 -0.77 0.00 0.00 57.85 57.62 2dj4 n ARG 28 Cb 0.52 -5.40 -0.12 0.00 -1.02 0.00 0.00 32.46 26.44 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 -3.37 0.62 -0.26 1.55 1.01 -1.23 -5.02 120.40 113.70 2dj4 s VAL 29 Ca 0.57 -1.05 -0.29 0.00 0.00 0.00 0.00 61.98 61.21 2dj4 s VAL 29 Cb -0.29 -0.66 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 2dj4 s VAL 29 CO 0.84 -0.32 1.66 -0.22 0.00 0.00 0.00 175.10 177.06 2dj4 s LEU 30 N -1.49 3.76 -0.13 3.92 2.96 -1.26 -4.22 118.68 122.21 2dj4 s LEU 30 Ca -0.08 1.48 0.02 0.00 -0.22 0.00 0.00 54.13 55.34 2dj4 s LEU 30 Cb -0.09 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.07 2dj4 s LEU 30 CO 0.01 -1.40 -0.21 -1.10 -1.32 0.00 0.00 176.35 172.33 2dj4 s GLN 31 N 4.99 3.09 0.09 1.98 -1.52 0.87 -4.99 119.66 124.16 2dj4 s GLN 31 Ca 0.73 -0.83 -0.03 0.00 -1.95 0.00 0.00 55.36 53.28 2dj4 s GLN 31 Cb -0.24 -2.45 -0.03 0.00 -0.22 0.00 0.00 33.01 30.08 2dj4 s GLN 31 CO 0.31 0.06 0.07 0.45 -0.25 0.00 0.00 175.29 175.93 2dj4 s SER 32 N 0.66 0.32 0.23 5.90 0.15 -1.26 0.09 113.70 119.80 2dj4 s SER 32 Ca -0.10 -0.97 -0.03 0.00 0.70 0.00 0.00 55.95 55.55 2dj4 s SER 32 Cb -0.16 0.28 0.01 0.00 -1.71 0.00 0.00 66.02 64.44 2dj4 s SER 32 CO 0.02 -0.69 0.36 2.22 1.20 0.00 0.00 173.24 176.35 2dj4 n PHE 33 N -0.01 -1.29 -5.14 3.44 -1.74 -1.16 -2.04 117.46 109.53 2dj4 n PHE 33 Ca -0.11 -1.42 -0.32 0.00 -0.56 0.00 0.00 57.45 55.04 2dj4 n PHE 33 Cb 0.62 0.41 -0.16 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 -2.61 2.35 -0.35 1.97 2.01 -0.86 -3.00 115.64 115.15 2dj4 s THR 34 Ca 0.16 -0.95 -0.02 0.00 0.31 0.00 0.00 61.69 61.19 2dj4 s THR 34 Cb -0.01 -1.89 0.07 0.00 0.01 0.00 0.00 72.50 70.68 2dj4 s THR 34 CO 0.12 0.57 0.09 -0.69 -0.69 0.00 0.00 174.62 174.01 2dj4 s VAL 35 N -0.13 3.14 -0.45 3.82 1.01 0.27 -1.26 120.40 126.81 2dj4 s VAL 35 Ca -0.04 -1.65 -0.22 0.00 0.00 0.00 0.00 61.98 60.08 2dj4 s VAL 35 Cb -0.14 -2.95 0.03 0.00 0.00 0.00 0.00 36.38 33.31 2dj4 s VAL 35 CO 0.04 -0.35 0.70 -0.62 0.00 0.00 0.00 175.10 174.87 2dj4 s ASP 36 N 1.46 6.35 -0.13 3.32 2.15 0.12 -0.19 116.67 129.75 2dj4 s ASP 36 Ca 0.01 -0.28 0.15 0.00 0.43 0.00 0.00 52.55 52.86 2dj4 s ASP 36 Cb -0.21 -2.34 0.37 0.00 -0.30 0.00 0.00 42.92 40.44 2dj4 s ASP 36 CO -0.02 -0.84 1.18 -1.54 -0.17 0.00 0.00 175.17 173.78 2dj4 n SER 37 N 6.44 1.51 -0.01 -0.34 3.41 -1.24 -0.47 113.62 122.91 2dj4 n SER 37 Ca -0.00 -3.17 -0.09 0.00 -0.26 0.00 0.00 58.87 55.35 2dj4 n SER 37 Cb 0.48 -0.43 0.07 0.00 -0.26 0.00 0.00 64.21 64.07 2dj4 n SER 37 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2dj4 h SER 38 N 0.78 0.64 0.60 4.04 0.02 -1.85 -2.74 113.55 115.03 2dj4 h SER 38 Ca -0.06 -0.31 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 2dj4 h SER 38 Cb 1.25 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.61 2dj4 h SER 38 CO 0.03 1.00 -0.17 0.29 -1.14 0.00 0.00 176.83 176.84 2dj4 n LYS 39 N -4.01 0.30 0.08 3.45 5.02 -1.26 -3.62 118.16 118.12 2dj4 n LYS 39 Ca -0.02 -0.10 -0.15 0.00 -2.02 0.00 0.00 58.31 56.02 2dj4 n LYS 39 Cb 0.55 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 33.92 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 3.27 0.20 0.00 7.82 0.00 -1.64 -3.43 119.26 125.47 2dj4 h ALA 40 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 53.92 2dj4 h ALA 40 Cb 0.44 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2dj4 h ALA 40 CO 0.00 1.07 0.00 0.41 0.00 0.00 0.00 179.25 180.73 2dj4 n GLY 41 N 1.57 0.20 0.46 0.00 0.00 -1.17 -0.21 105.19 106.04 2dj4 n GLY 41 Ca -0.11 -1.60 0.09 0.00 0.00 0.00 0.00 46.02 44.40 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 3.07 -4.81 0.99 -0.00 -1.26 -4.74 117.00 110.24 2dj4 n LEU 42 Ca 0.00 -3.04 -0.33 0.00 -0.00 0.00 0.00 56.01 52.64 2dj4 n LEU 42 Cb 0.00 -0.48 -0.05 0.00 -0.00 0.00 0.00 43.42 42.89 2dj4 n LEU 42 CO 0.00 0.69 0.68 0.00 -0.00 0.00 0.00 177.39 178.76 2dj4 s ALA 43 N -2.83 2.96 0.98 1.47 0.00 -1.26 -5.05 121.76 118.03 2dj4 s ALA 43 Ca 0.36 0.48 -0.12 0.00 0.00 0.00 0.00 51.96 52.69 2dj4 s ALA 43 Cb 0.31 -3.19 0.18 0.00 0.00 0.00 0.00 23.12 20.41 2dj4 s ALA 43 CO 0.06 -0.09 1.09 -1.25 0.00 0.00 0.00 175.76 175.57 2dj4 s PRO 44 N -3.24 0.58 -0.08 0.00 0.04 -1.26 -4.84 135.00 126.20 2dj4 s PRO 44 Ca 0.64 0.58 0.02 0.00 0.04 0.00 0.00 61.00 62.28 2dj4 s PRO 44 Cb -0.12 -1.75 0.01 0.00 0.04 0.00 0.00 34.50 32.68 2dj4 s PRO 44 CO 0.17 -2.65 -0.13 -1.17 0.04 0.00 0.00 177.00 173.26 2dj4 s LEU 45 N -6.42 1.67 0.17 -3.56 2.96 -1.26 -3.19 118.68 109.05 2dj4 s LEU 45 Ca 0.65 -0.34 0.06 0.00 -0.22 0.00 0.00 54.13 54.28 2dj4 s LEU 45 Cb -0.18 -0.91 -0.04 0.00 0.50 0.00 0.00 46.19 45.55 2dj4 s LEU 45 CO 0.57 0.03 0.06 -1.61 -1.32 0.00 0.00 176.35 174.09 2dj4 s GLU 46 N 0.75 2.61 -0.03 1.98 0.41 -0.66 -4.98 118.70 118.78 2dj4 s GLU 46 Ca -0.13 -1.02 -0.02 0.00 -0.41 0.00 0.00 54.97 53.39 2dj4 s GLU 46 Cb -0.16 -2.47 0.02 0.00 -1.78 0.00 0.00 34.13 29.74 2dj4 s GLU 46 CO 0.03 0.46 0.07 0.08 -0.49 0.00 0.00 175.26 175.41 2dj4 s VAL 47 N -1.77 -0.02 -0.02 2.63 1.01 -1.26 -2.47 120.40 118.50 2dj4 s VAL 47 Ca 0.29 0.08 -0.03 0.00 0.00 0.00 0.00 61.98 62.32 2dj4 s VAL 47 Cb -0.09 -0.11 0.00 0.00 0.00 0.00 0.00 36.38 36.18 2dj4 s VAL 47 CO 0.21 0.03 0.08 -0.60 0.00 0.00 0.00 175.10 174.82 2dj4 s ARG 48 N 0.47 0.16 -0.07 2.72 3.52 0.90 -4.91 118.95 121.74 2dj4 s ARG 48 Ca -0.04 -0.01 0.04 0.00 -0.13 0.00 0.00 55.73 55.59 2dj4 s ARG 48 Cb -0.05 0.07 0.00 0.00 -1.56 0.00 0.00 34.95 33.41 2dj4 s ARG 48 CO -0.02 -0.03 -0.18 0.08 -0.81 0.00 0.00 175.30 174.34 2dj4 s VAL 49 N -0.26 1.60 0.58 7.11 1.01 -1.26 0.45 120.40 129.62 2dj4 s VAL 49 Ca -0.03 -0.76 0.09 0.00 0.00 0.00 0.00 61.98 61.27 2dj4 s VAL 49 Cb -0.02 -1.40 0.08 0.00 0.00 0.00 0.00 36.38 35.04 2dj4 s VAL 49 CO 0.00 0.46 0.71 -0.76 0.00 0.00 0.00 175.10 175.51 2dj4 s LEU 50 N 0.38 2.96 0.12 3.92 2.01 -0.04 -3.93 118.68 124.09 2dj4 s LEU 50 Ca -0.14 -0.98 0.07 0.00 0.01 0.00 0.00 54.13 53.09 2dj4 s LEU 50 Cb -0.16 -1.45 -0.04 0.00 0.01 0.00 0.00 46.19 44.56 2dj4 s LEU 50 CO 0.05 -1.33 -0.16 -0.83 1.01 0.00 0.00 176.35 175.10 2dj4 s GLY 51 N -4.59 1.14 0.42 -3.19 0.00 -0.05 -4.19 107.32 96.85 2dj4 s GLY 51 Ca 0.55 -1.29 0.21 0.00 0.00 0.00 0.00 44.72 44.18 2dj4 s GLY 51 CO 0.35 -1.34 1.83 -0.56 0.00 0.00 0.00 173.10 173.38 2dj4 h PRO 52 N 3.63 0.00 0.00 2.90 0.13 -1.85 -3.11 132.00 133.70 2dj4 h PRO 52 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2dj4 h PRO 52 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2dj4 h PRO 52 CO 0.48 0.30 -0.01 2.89 -0.23 0.00 0.00 178.00 181.43 2dj4 n ARG 53 N -3.61 2.38 -0.09 0.86 -4.01 -1.26 -4.95 116.66 105.97 2dj4 n ARG 53 Ca -0.01 -1.70 0.00 0.00 -1.04 0.00 0.00 57.85 55.10 2dj4 n ARG 53 Cb 0.42 -1.09 0.00 0.00 -3.04 0.00 0.00 32.46 28.76 2dj4 n ARG 53 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2dj4 n GLY 54 N -0.69 1.72 3.87 2.89 0.00 -1.17 -5.10 105.19 106.70 2dj4 n GLY 54 Ca 0.04 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 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 4.34 -0.03 0.99 2.96 -1.26 -4.85 118.68 120.83 2dj4 s LEU 55 Ca 0.00 0.77 0.05 0.00 -0.22 0.00 0.00 54.13 54.73 2dj4 s LEU 55 Cb 0.00 -2.99 -0.03 0.00 0.50 0.00 0.00 46.19 43.68 2dj4 s LEU 55 CO 0.00 0.17 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.34 2dj4 s VAL 56 N -1.41 2.84 0.03 1.68 1.01 -1.26 -0.87 120.40 122.43 2dj4 s VAL 56 Ca 0.33 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.50 2dj4 s VAL 56 Cb -0.14 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 2dj4 s VAL 56 CO 0.18 0.55 -0.13 -1.61 0.00 0.00 0.00 175.10 174.10 2dj4 s GLU 57 N -0.81 0.84 1.08 2.72 0.41 -1.25 -5.05 118.70 116.63 2dj4 s GLU 57 Ca 0.12 -0.70 -0.15 0.00 -0.41 0.00 0.00 54.97 53.83 2dj4 s GLU 57 Cb -0.10 -0.82 0.23 0.00 -1.78 0.00 0.00 34.13 31.65 2dj4 s GLU 57 CO 0.01 0.20 1.10 -1.25 -0.49 0.00 0.00 175.26 174.83 2dj4 s PRO 58 N -1.09 -0.21 0.07 0.39 0.04 -1.26 -4.37 135.00 128.57 2dj4 s PRO 58 Ca 0.00 0.29 -0.06 0.00 0.04 0.00 0.00 61.00 61.28 2dj4 s PRO 58 Cb -0.08 -1.68 -0.02 0.00 0.04 0.00 0.00 34.50 32.77 2dj4 s PRO 58 CO 0.01 -3.11 0.10 0.14 0.04 0.00 0.00 177.00 174.18 2dj4 s VAL 59 N -2.98 0.17 -0.00 -0.36 -7.23 -1.26 -4.78 120.40 103.95 2dj4 s VAL 59 Ca 0.67 -1.41 0.07 0.00 -1.81 0.00 0.00 61.98 59.51 2dj4 s VAL 59 Cb -0.16 -1.38 -0.02 0.00 0.56 0.00 0.00 36.38 35.39 2dj4 s VAL 59 CO 0.57 -0.78 -0.22 0.21 -0.31 0.00 0.00 175.10 174.57 2dj4 s ASN 60 N -2.83 2.61 -0.12 4.85 2.47 -1.04 -5.00 114.94 115.88 2dj4 s ASN 60 Ca 0.05 -0.43 -0.01 0.00 0.42 0.00 0.00 52.86 52.89 2dj4 s ASN 60 Cb 0.06 -0.28 0.04 0.00 -1.45 0.00 0.00 41.25 39.62 2dj4 s ASN 60 CO -0.10 0.26 -0.01 0.54 -3.72 0.00 0.00 177.10 174.06 2dj4 s VAL 61 N -0.58 0.62 -0.02 -5.21 0.11 -1.26 -3.60 120.40 110.47 2dj4 s VAL 61 Ca 0.09 -0.21 0.00 0.00 -2.93 0.00 0.00 61.98 58.93 2dj4 s VAL 61 Cb -0.09 -0.84 0.02 0.00 -1.53 0.00 0.00 36.38 33.95 2dj4 s VAL 61 CO -0.00 0.15 0.02 -0.69 -3.33 0.00 0.00 175.10 171.25 2dj4 s VAL 62 N 1.85 0.01 0.15 2.04 1.01 -0.56 -5.00 120.40 119.89 2dj4 s VAL 62 Ca 0.03 0.14 -0.30 0.00 0.00 0.00 0.00 61.98 61.86 2dj4 s VAL 62 Cb -0.14 -0.11 -0.07 0.00 0.00 0.00 0.00 36.38 36.06 2dj4 s VAL 62 CO -0.07 0.08 0.95 -0.62 0.00 0.00 0.00 175.10 175.44 2dj4 s ASP 63 N 0.84 7.53 0.05 3.32 2.15 -1.26 0.48 116.67 129.78 2dj4 s ASP 63 Ca -0.07 1.83 -0.17 0.00 0.43 0.00 0.00 52.55 54.56 2dj4 s ASP 63 Cb -0.11 -2.59 -0.21 0.00 -0.30 0.00 0.00 42.92 39.71 2dj4 s ASP 63 CO -0.02 0.00 1.18 0.78 -0.17 0.00 0.00 175.17 176.94 2dj4 h ASN 64 N 5.16 0.72 0.00 -0.34 2.35 -1.53 -3.46 115.58 118.47 2dj4 h ASN 64 Ca -0.44 -0.71 0.00 0.00 -0.55 0.00 0.00 56.30 54.60 2dj4 h ASN 64 Cb 1.21 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 39.36 2dj4 h ASN 64 CO 0.71 1.33 0.00 0.61 -1.65 0.00 0.00 177.43 178.42 2dj4 n GLY 65 N 0.95 2.27 0.13 2.83 0.00 -1.26 -4.92 105.19 105.19 2dj4 n GLY 65 Ca -0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 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 2.04 0.00 1.61 8.00 -1.26 -4.95 116.55 122.00 2dj4 n ASP 66 Ca 0.00 0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.77 2dj4 n ASP 66 Cb 0.00 -0.89 0.00 0.00 -0.02 0.00 0.00 41.12 40.21 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 1.81 0.00 3.59 0.44 0.00 -1.26 -5.08 105.19 104.69 2dj4 n GLY 67 Ca -0.33 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.05 2.61 -4.23 -1.26 -3.65 115.64 109.06 2dj4 s THR 68 Ca 0.00 -1.41 -0.02 0.00 -1.18 0.00 0.00 61.69 59.08 2dj4 s THR 68 Cb 0.00 -2.66 0.04 0.00 1.34 0.00 0.00 72.50 71.21 2dj4 s THR 68 CO 0.00 0.00 0.09 -1.00 -0.54 0.00 0.00 174.62 173.17 2dj4 s HIS 69 N -2.94 -0.06 0.12 3.99 0.09 0.73 -1.22 115.29 115.99 2dj4 s HIS 69 Ca 0.26 0.34 -0.22 0.00 -0.00 0.00 0.00 55.06 55.44 2dj4 s HIS 69 Cb -0.02 -0.22 -0.07 0.00 -0.00 0.00 0.00 32.58 32.27 2dj4 s HIS 69 CO 0.17 -0.16 0.67 0.99 -0.00 0.00 0.00 174.74 176.41 2dj4 s THR 70 N 1.45 4.56 -0.23 1.30 2.01 0.18 -0.56 115.64 124.35 2dj4 s THR 70 Ca -0.05 1.45 -0.01 0.00 0.31 0.00 0.00 61.69 63.39 2dj4 s THR 70 Cb -0.12 -4.01 0.07 0.00 0.01 0.00 0.00 72.50 68.44 2dj4 s THR 70 CO -0.04 0.54 0.03 -0.69 -0.69 0.00 0.00 174.62 173.76 2dj4 s VAL 71 N -1.11 0.89 -0.01 3.82 1.01 -1.16 -1.50 120.40 122.34 2dj4 s VAL 71 Ca 0.32 -0.94 -0.11 0.00 0.00 0.00 0.00 61.98 61.25 2dj4 s VAL 71 Cb -0.21 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 34.72 2dj4 s VAL 71 CO 0.22 -0.29 0.33 0.42 0.00 0.00 0.00 175.10 175.79 2dj4 s THR 72 N 1.67 5.18 0.25 3.92 -4.23 -1.24 -2.99 115.64 118.20 2dj4 s THR 72 Ca 0.00 0.55 -0.21 0.00 -1.18 0.00 0.00 61.69 60.85 2dj4 s THR 72 Cb -0.18 -3.61 0.03 0.00 1.34 0.00 0.00 72.50 70.08 2dj4 s THR 72 CO -0.11 0.51 0.67 -0.72 -0.54 0.00 0.00 174.62 174.43 2dj4 s TYR 73 N -1.15 -0.24 -0.17 3.99 -0.85 0.11 -2.49 117.35 116.55 2dj4 s TYR 73 Ca 0.24 -0.15 -0.04 0.00 -0.52 0.00 0.00 57.07 56.60 2dj4 s TYR 73 Cb -0.15 0.64 0.08 0.00 0.38 0.00 0.00 41.96 42.91 2dj4 s TYR 73 CO 0.12 -1.12 0.22 0.99 -1.52 0.00 0.00 175.55 174.24 2dj4 s THR 74 N -3.88 -0.34 -0.77 -3.49 2.01 -1.26 -0.09 115.64 107.82 2dj4 s THR 74 Ca 0.09 0.04 -0.25 0.00 0.31 0.00 0.00 61.69 61.88 2dj4 s THR 74 Cb -0.04 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.86 2dj4 s THR 74 CO 0.02 -0.08 1.91 -2.16 -0.69 0.00 0.00 174.62 173.62 2dj4 s PRO 75 N 2.34 2.58 0.15 4.92 0.04 -1.26 -4.86 135.00 138.92 2dj4 s PRO 75 Ca 0.05 0.13 -0.14 0.00 0.04 0.00 0.00 61.00 61.08 2dj4 s PRO 75 Cb -0.14 -4.75 0.12 0.00 0.04 0.00 0.00 34.50 29.77 2dj4 s PRO 75 CO -0.10 -3.09 1.10 0.43 0.04 0.00 0.00 177.00 175.38 2dj4 n SER 76 N 13.45 -0.52 -4.26 6.66 7.64 -1.26 -0.72 113.62 134.60 2dj4 n SER 76 Ca 0.31 1.24 -0.16 0.00 1.01 0.00 0.00 58.87 61.28 2dj4 n SER 76 Cb 0.49 -0.26 -0.10 0.00 -1.01 0.00 0.00 64.21 63.33 2dj4 n SER 76 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dj4 s GLN 77 N -5.60 1.10 1.03 1.43 -2.07 -1.26 -3.61 119.66 110.67 2dj4 s GLN 77 Ca -0.09 -1.43 -0.15 0.00 -1.82 0.00 0.00 55.36 51.87 2dj4 s GLN 77 Cb 0.13 -0.76 0.20 0.00 -1.09 0.00 0.00 33.01 31.49 2dj4 s GLN 77 CO 0.49 0.11 1.13 -1.83 -1.32 0.00 0.00 175.29 173.88 2dj4 s GLU 78 N -3.52 0.16 0.00 9.60 1.03 -1.26 -4.86 118.70 119.85 2dj4 s GLU 78 Ca 0.16 0.18 0.00 0.00 0.03 0.00 0.00 54.97 55.34 2dj4 s GLU 78 Cb 0.00 -1.74 0.00 0.00 -0.80 0.00 0.00 34.13 31.60 2dj4 s GLU 78 CO 0.02 -2.84 0.00 0.41 -1.33 0.00 0.00 175.26 171.52 2dj4 n GLY 79 N -1.65 1.65 3.57 -3.83 0.00 -0.82 -4.93 105.19 99.18 2dj4 n GLY 79 Ca 0.09 -2.11 -0.28 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.38 2.51 0.83 1.61 0.04 -1.26 -0.89 135.00 136.46 2dj4 s PRO 80 Ca 0.00 -0.82 -0.11 0.00 0.04 0.00 0.00 61.00 60.11 2dj4 s PRO 80 Cb 0.00 -5.17 0.13 0.00 0.04 0.00 0.00 34.50 29.49 2dj4 s PRO 80 CO 0.00 -3.75 1.17 0.71 0.04 0.00 0.00 177.00 175.17 2dj4 s TYR 81 N 10.67 2.28 -0.16 0.56 1.51 -0.48 -4.25 117.35 127.48 2dj4 s TYR 81 Ca 0.69 0.40 -0.09 0.00 -1.01 0.00 0.00 57.07 57.06 2dj4 s TYR 81 Cb -0.03 -3.60 0.06 0.00 -0.11 0.00 0.00 41.96 38.28 2dj4 s TYR 81 CO 0.08 -2.01 0.39 1.41 -1.11 0.00 0.00 175.55 174.31 2dj4 s MET 82 N -5.56 0.36 -0.42 -0.62 -2.45 -1.26 -2.42 119.30 106.92 2dj4 s MET 82 Ca 0.66 0.75 -0.00 0.00 -1.25 0.00 0.00 55.69 55.86 2dj4 s MET 82 Cb -0.08 -0.03 0.11 0.00 1.25 0.00 0.00 34.83 36.08 2dj4 s MET 82 CO 0.49 -0.16 0.19 0.08 1.05 0.00 0.00 175.02 176.67 2dj4 s VAL 83 N 1.40 2.95 0.06 10.11 1.01 -0.08 -0.87 120.40 134.99 2dj4 s VAL 83 Ca -0.09 -2.37 -0.29 0.00 0.00 0.00 0.00 61.98 59.22 2dj4 s VAL 83 Cb -0.09 -3.05 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 2dj4 s VAL 83 CO -0.12 -0.69 0.94 -0.55 0.00 0.00 0.00 175.10 174.67 2dj4 s SER 84 N 1.20 7.40 -0.04 3.32 0.15 0.17 -1.38 113.70 124.53 2dj4 s SER 84 Ca 0.11 1.69 0.03 0.00 0.70 0.00 0.00 55.95 58.48 2dj4 s SER 84 Cb -0.22 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.53 2dj4 s SER 84 CO -0.05 -0.13 -0.14 -0.69 1.20 0.00 0.00 173.24 173.43 2dj4 s VAL 85 N 0.40 1.19 0.33 4.45 1.01 -1.26 -0.07 120.40 126.45 2dj4 s VAL 85 Ca 0.48 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.95 2dj4 s VAL 85 Cb -0.22 -1.04 -0.07 0.00 0.00 0.00 0.00 36.38 35.05 2dj4 s VAL 85 CO 0.28 0.35 -0.02 -0.75 0.00 0.00 0.00 175.10 174.96 2dj4 s LYS 86 N 0.19 1.71 -0.27 2.72 2.20 -1.03 -3.30 119.74 121.95 2dj4 s LYS 86 Ca -0.05 -1.91 0.00 0.00 -0.36 0.00 0.00 55.97 53.64 2dj4 s LYS 86 Cb -0.11 -1.28 0.16 0.00 -1.51 0.00 0.00 37.83 35.09 2dj4 s LYS 86 CO 0.02 -0.02 0.45 -0.47 -0.36 0.00 0.00 175.35 174.97 2dj4 s TYR 87 N -2.95 -1.13 -0.89 4.03 5.04 -0.96 -1.65 117.35 118.85 2dj4 s TYR 87 Ca 0.33 0.84 -0.04 0.00 -2.44 0.00 0.00 57.07 55.75 2dj4 s TYR 87 Cb 0.06 0.09 0.00 0.00 0.35 0.00 0.00 41.96 42.46 2dj4 s TYR 87 CO 0.15 -0.88 0.77 0.00 -1.34 0.00 0.00 175.55 174.25 2dj4 n ALA 88 N 5.38 -1.01 -2.73 3.97 0.00 -1.19 -2.66 120.51 122.27 2dj4 n ALA 88 Ca -0.01 0.19 -0.19 0.00 0.00 0.00 0.00 53.44 53.44 2dj4 n ALA 88 Cb 0.50 -3.35 0.02 0.00 0.00 0.00 0.00 19.45 16.62 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 -1.79 -5.40 -3.51 0.00 9.92 -1.26 -4.98 116.55 109.52 2dj4 n ASP 89 Ca -0.05 -0.17 -0.22 0.00 -0.53 0.00 0.00 54.79 53.82 2dj4 n ASP 89 Cb 0.56 -4.32 -0.14 0.00 -0.64 0.00 0.00 41.12 36.59 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 -5.33 0.19 -0.24 -1.24 0.41 -1.09 -5.10 118.70 106.30 2dj4 s GLU 90 Ca 0.18 -0.10 -0.33 0.00 -0.41 0.00 0.00 54.97 54.31 2dj4 s GLU 90 Cb -0.08 -1.23 -0.09 0.00 -1.78 0.00 0.00 34.13 30.95 2dj4 s GLU 90 CO 0.22 -0.82 2.12 0.39 -0.49 0.00 0.00 175.26 176.69 2dj4 n GLU 91 N 5.29 1.66 -1.30 1.61 1.02 -1.26 -2.25 120.64 125.41 2dj4 n GLU 91 Ca -0.05 0.50 -0.37 0.00 -0.02 0.00 0.00 57.16 57.22 2dj4 n GLU 91 Cb 0.47 -2.77 0.06 0.00 -0.02 0.00 0.00 31.44 29.18 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 6.87 1.83 0.97 -3.67 -5.35 -1.21 -4.80 119.36 114.01 2dj4 n ILE 92 Ca 0.33 -0.42 0.01 0.00 -0.27 0.00 0.00 62.75 62.40 2dj4 n ILE 92 Cb 0.32 -0.70 0.08 0.00 -1.74 0.00 0.00 39.64 37.59 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 -0.50 0.49 0.00 6.28 -0.04 -1.26 -1.67 135.00 138.30 2dj4 n PRO 93 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2dj4 n PRO 93 Cb 0.49 -1.08 0.00 0.00 -0.04 0.00 0.00 33.50 32.87 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 -0.58 0.94 -4.21 0.54 3.00 -1.26 -5.04 116.66 110.05 2dj4 n ARG 94 Ca 0.02 -0.36 -0.28 0.00 -0.01 0.00 0.00 57.85 57.22 2dj4 n ARG 94 Cb 0.01 -0.86 -0.09 0.00 0.00 0.00 0.00 32.46 31.52 2dj4 n ARG 94 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2dj4 s SER 95 N -0.24 4.64 1.14 0.55 0.15 -0.67 -4.15 113.70 115.12 2dj4 s SER 95 Ca 0.00 -0.38 -0.17 0.00 0.70 0.00 0.00 55.95 56.10 2dj4 s SER 95 Cb 0.00 -0.96 0.26 0.00 -1.71 0.00 0.00 66.02 63.61 2dj4 s SER 95 CO 0.00 0.13 1.10 -2.16 1.20 0.00 0.00 173.24 173.51 2dj4 s PRO 96 N -2.62 -0.72 -0.22 5.44 0.04 -1.26 -4.77 135.00 130.88 2dj4 s PRO 96 Ca 0.25 0.12 -0.02 0.00 0.04 0.00 0.00 61.00 61.39 2dj4 s PRO 96 Cb -0.10 -1.64 0.01 0.00 0.04 0.00 0.00 34.50 32.81 2dj4 s PRO 96 CO 0.17 -3.41 -0.09 -0.06 0.04 0.00 0.00 177.00 173.65 2dj4 s PHE 97 N -2.99 2.97 -0.31 0.56 0.08 -0.48 -4.95 117.98 112.85 2dj4 s PHE 97 Ca 0.69 -1.41 -0.29 0.00 0.12 0.00 0.00 56.93 56.05 2dj4 s PHE 97 Cb -0.13 -2.04 0.01 0.00 -0.57 0.00 0.00 43.02 40.30 2dj4 s PHE 97 CO 0.57 -0.70 1.19 0.15 -0.10 0.00 0.00 175.22 176.33 2dj4 s LYS 98 N 1.36 3.99 -0.28 0.44 1.02 -1.26 -0.90 119.74 124.10 2dj4 s LYS 98 Ca 0.03 1.14 0.00 0.00 0.02 0.00 0.00 55.97 57.17 2dj4 s LYS 98 Cb -0.15 -3.81 0.08 0.00 -0.52 0.00 0.00 37.83 33.43 2dj4 s LYS 98 CO -0.06 -1.02 0.04 0.08 -0.92 0.00 0.00 175.35 173.47 2dj4 s VAL 99 N 4.01 1.31 -0.73 3.17 1.01 -1.02 -5.00 120.40 123.16 2dj4 s VAL 99 Ca 0.51 -1.45 -0.25 0.00 0.00 0.00 0.00 61.98 60.78 2dj4 s VAL 99 Cb -0.14 -1.85 0.05 0.00 0.00 0.00 0.00 36.38 34.44 2dj4 s VAL 99 CO 0.20 -0.45 1.16 -0.75 0.00 0.00 0.00 175.10 175.26 2dj4 s LYS 100 N 1.43 3.19 0.45 2.72 2.20 -1.26 -1.38 119.74 127.09 2dj4 s LYS 100 Ca 0.04 -0.55 -0.23 0.00 -0.36 0.00 0.00 55.97 54.87 2dj4 s LYS 100 Cb -0.18 -4.27 -0.07 0.00 -1.51 0.00 0.00 37.83 31.79 2dj4 s LYS 100 CO -0.15 -2.02 1.20 0.08 -0.36 0.00 0.00 175.35 174.11 2dj4 s VAL 101 N 4.99 2.96 0.19 4.02 1.01 -0.07 -4.64 120.40 128.86 2dj4 s VAL 101 Ca 0.31 0.74 0.08 0.00 0.00 0.00 0.00 61.98 63.11 2dj4 s VAL 101 Cb -0.11 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 2dj4 s VAL 101 CO 0.11 0.01 -0.03 -0.76 0.00 0.00 0.00 175.10 174.44 2dj4 s LEU 102 N -2.94 3.21 -0.06 3.92 1.43 0.11 -1.95 118.68 122.40 2dj4 s LEU 102 Ca 0.63 -0.48 -0.30 0.00 -1.03 0.00 0.00 54.13 52.95 2dj4 s LEU 102 Cb -0.31 -1.85 -0.05 0.00 0.03 0.00 0.00 46.19 44.01 2dj4 s LEU 102 CO 0.38 0.08 1.49 -2.16 0.23 0.00 0.00 176.35 176.37 2dj4 s PRO 103 N -3.01 4.22 0.31 1.29 0.04 -1.26 0.69 135.00 137.27 2dj4 s PRO 103 Ca 0.27 2.01 0.23 0.00 0.04 0.00 0.00 61.00 63.55 2dj4 s PRO 103 Cb -0.09 -3.80 1.04 0.00 0.04 0.00 0.00 34.50 31.70 2dj4 s PRO 103 CO 0.18 -0.73 1.09 2.41 0.04 0.00 0.00 177.00 179.99 2dj4 n THR 104 N 5.19 -0.18 -2.88 1.26 -1.04 -1.26 -3.59 114.28 111.77 2dj4 n THR 104 Ca 0.15 1.27 -0.43 0.00 -2.04 0.00 0.00 64.05 63.00 2dj4 n THR 104 Cb 0.43 -2.08 -0.05 0.00 -1.82 0.00 0.00 70.33 66.82 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 -4.76 2.89 -0.64 -1.42 1.51 -1.26 -4.98 117.35 108.68 2dj4 s TYR 105 Ca -0.05 0.11 0.00 0.00 -1.01 0.00 0.00 57.07 56.12 2dj4 s TYR 105 Cb 0.22 -3.92 0.16 0.00 -0.11 0.00 0.00 41.96 38.31 2dj4 s TYR 105 CO 0.57 -1.18 0.44 -0.51 -1.11 0.00 0.00 175.55 173.77 2dj4 s ASP 106 N 2.51 5.01 -0.29 2.29 1.01 -1.24 -4.94 116.67 121.03 2dj4 s ASP 106 Ca 0.31 -3.16 -0.01 0.00 0.71 0.00 0.00 52.55 50.40 2dj4 s ASP 106 Cb -0.12 -1.77 0.15 0.00 1.01 0.00 0.00 42.92 42.19 2dj4 s ASP 106 CO 0.22 -0.27 2.17 0.00 0.21 0.00 0.00 175.17 177.50 2dj4 n ALA 107 N 3.01 5.20 0.40 5.23 0.00 -1.26 -5.21 120.51 127.88 2dj4 n ALA 107 Ca 0.10 -1.64 0.03 0.00 0.00 0.00 0.00 53.44 51.94 2dj4 n ALA 107 Cb 0.36 -1.46 0.19 0.00 0.00 0.00 0.00 19.45 18.54 2dj4 n ALA 107 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93