#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 0.27 -0.02 1.61 1.04 -1.26 -5.16 113.70 110.18 2dj4 s SER 2 Ca 0.00 -1.38 -0.04 0.00 0.48 0.00 0.00 55.95 55.01 2dj4 s SER 2 Cb 0.00 0.42 -0.04 0.00 0.10 0.00 0.00 66.02 66.50 2dj4 s SER 2 CO 0.00 -0.89 0.20 -0.44 0.98 0.00 0.00 173.24 173.08 2dj4 s SER 3 N -3.17 6.40 0.67 7.02 0.01 -1.26 -5.10 113.70 118.28 2dj4 s SER 3 Ca 0.38 0.41 -0.11 0.00 1.31 0.00 0.00 55.95 57.93 2dj4 s SER 3 Cb 0.06 -2.03 -0.01 0.00 0.21 0.00 0.00 66.02 64.25 2dj4 s SER 3 CO 0.13 0.28 1.06 -0.83 0.41 0.00 0.00 173.24 174.30 2dj4 s GLY 4 N -1.77 1.64 0.08 3.44 0.00 -1.26 -5.06 107.32 104.40 2dj4 s GLY 4 Ca 0.26 -0.20 -0.05 0.00 0.00 0.00 0.00 44.72 44.73 2dj4 s GLY 4 CO 0.16 0.13 0.33 -0.56 0.00 0.00 0.00 173.10 173.15 2dj4 s SER 5 N -4.22 6.50 -0.21 1.64 0.01 -1.26 -5.09 113.70 111.06 2dj4 s SER 5 Ca 0.57 0.57 0.01 0.00 1.31 0.00 0.00 55.95 58.41 2dj4 s SER 5 Cb -0.11 -2.09 0.05 0.00 0.21 0.00 0.00 66.02 64.08 2dj4 s SER 5 CO 0.53 0.14 -0.10 -0.55 0.41 0.00 0.00 173.24 173.68 2dj4 s SER 6 N -2.13 3.58 0.00 2.44 0.15 -1.26 -4.78 113.70 111.70 2dj4 s SER 6 Ca 0.35 -0.98 0.00 0.00 0.70 0.00 0.00 55.95 56.02 2dj4 s SER 6 Cb -0.13 -1.27 0.00 0.00 -1.71 0.00 0.00 66.02 62.91 2dj4 s SER 6 CO 0.22 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.11 2dj4 n GLY 7 N 4.65 2.00 3.77 9.45 0.00 -1.26 -5.13 105.19 118.67 2dj4 n GLY 7 Ca -0.14 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.33 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 4.56 -0.18 1.61 0.11 -1.26 -5.04 120.40 120.20 2dj4 s VAL 8 Ca 0.00 1.57 -0.07 0.00 -2.93 0.00 0.00 61.98 60.55 2dj4 s VAL 8 Cb 0.00 -4.08 -0.04 0.00 -1.53 0.00 0.00 36.38 30.73 2dj4 s VAL 8 CO 0.00 0.48 0.06 -0.69 -3.33 0.00 0.00 175.10 171.62 2dj4 s VAL 9 N -0.80 4.78 -0.36 2.04 1.01 -1.26 -4.76 120.40 121.05 2dj4 s VAL 9 Ca 0.35 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.30 2dj4 s VAL 9 Cb -0.22 -3.15 0.11 0.00 0.00 0.00 0.00 36.38 33.13 2dj4 s VAL 9 CO 0.24 0.47 0.13 -0.62 0.00 0.00 0.00 175.10 175.32 2dj4 s ASP 10 N 0.29 4.12 0.00 3.32 2.15 0.35 -4.96 116.67 121.94 2dj4 s ASP 10 Ca 0.03 -2.08 0.15 0.00 0.43 0.00 0.00 52.55 51.09 2dj4 s ASP 10 Cb -0.12 -1.12 0.91 0.00 -0.30 0.00 0.00 42.92 42.29 2dj4 s ASP 10 CO 0.00 -0.36 1.34 -0.81 -0.17 0.00 0.00 175.17 175.18 2dj4 n PRO 11 N 4.29 0.46 -0.39 4.34 -0.04 -1.26 -2.11 135.00 140.29 2dj4 n PRO 11 Ca 0.02 0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.61 2dj4 n PRO 11 Cb 0.40 -1.50 0.33 0.00 -0.04 0.00 0.00 33.50 32.68 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 -1.02 4.00 -0.03 3.54 3.41 -1.26 -4.04 113.62 118.22 2dj4 n SER 12 Ca 0.11 -2.04 0.03 0.00 -0.26 0.00 0.00 58.87 56.71 2dj4 n SER 12 Cb 0.06 -0.50 -0.02 0.00 -0.26 0.00 0.00 64.21 63.48 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 1.61 4.54 -2.86 4.33 4.76 -0.90 -4.93 118.16 124.71 2dj4 n LYS 13 Ca 0.25 -0.11 -0.42 0.00 -2.87 0.00 0.00 58.31 55.16 2dj4 n LYS 13 Cb 0.64 -0.80 -0.04 0.00 -1.84 0.00 0.00 35.03 32.99 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 -1.40 4.86 0.45 -0.18 0.11 -1.26 -4.31 120.40 118.68 2dj4 s VAL 14 Ca 0.03 1.68 0.05 0.00 -2.93 0.00 0.00 61.98 60.81 2dj4 s VAL 14 Cb 0.04 -4.16 -0.04 0.00 -1.53 0.00 0.00 36.38 30.70 2dj4 s VAL 14 CO 0.21 0.00 0.11 -0.54 -3.33 0.00 0.00 175.10 171.55 2dj4 s LYS 15 N 2.29 2.15 -0.10 1.54 1.02 -0.88 -4.91 119.74 120.85 2dj4 s LYS 15 Ca 0.39 -2.09 -0.09 0.00 0.02 0.00 0.00 55.97 54.20 2dj4 s LYS 15 Cb -0.16 -1.78 0.03 0.00 -0.52 0.00 0.00 37.83 35.39 2dj4 s LYS 15 CO 0.12 -0.23 0.26 0.96 -0.92 0.00 0.00 175.35 175.54 2dj4 s ILE 16 N -2.73 -0.00 -0.03 2.17 -4.36 -1.26 -0.59 121.20 114.40 2dj4 s ILE 16 Ca 0.29 0.02 -0.02 0.00 -0.26 0.00 0.00 60.65 60.67 2dj4 s ILE 16 Cb 0.04 -0.37 0.01 0.00 1.25 0.00 0.00 42.46 43.40 2dj4 s ILE 16 CO 0.16 0.01 0.07 0.00 0.24 0.00 0.00 174.94 175.42 2dj4 s ALA 17 N 0.27 -0.16 0.00 2.27 0.00 0.20 -4.97 121.76 119.37 2dj4 s ALA 17 Ca -0.01 0.25 0.00 0.00 0.00 0.00 0.00 51.96 52.20 2dj4 s ALA 17 Cb -0.03 -0.16 0.00 0.00 0.00 0.00 0.00 23.12 22.93 2dj4 s ALA 17 CO -0.01 -0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.11 2dj4 n GLY 18 N 3.26 2.14 0.22 0.00 0.00 -1.26 -0.62 105.19 108.93 2dj4 n GLY 18 Ca -0.15 -1.02 0.09 0.00 0.00 0.00 0.00 46.02 44.94 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 -0.01 1.61 0.13 -1.97 -2.96 132.00 128.80 2dj4 h PRO 19 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 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 0.24 0.01 0.78 -0.23 0.00 0.00 178.00 178.80 2dj4 h GLY 20 N 1.71 0.00 0.19 1.56 0.00 -1.88 -1.87 103.07 102.77 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 0.03 0.00 -1.79 1.04 0.00 0.00 0.00 176.54 175.82 2dj4 n LEU 21 N -4.26 0.18 -4.46 3.11 4.77 -1.13 -4.94 117.00 110.27 2dj4 n LEU 21 Ca -0.03 0.05 -0.30 0.00 -0.03 0.00 0.00 56.01 55.70 2dj4 n LEU 21 Cb 0.10 -0.01 0.21 0.00 -2.33 0.00 0.00 43.42 41.38 2dj4 n LEU 21 CO 0.31 -0.03 0.25 0.61 -1.33 0.00 0.00 177.39 177.20 2dj4 n GLY 22 N 1.25 -1.80 0.22 -0.72 0.00 -0.70 -4.85 105.19 98.59 2dj4 n GLY 22 Ca -0.03 -0.96 0.04 0.00 0.00 0.00 0.00 46.02 45.07 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 -3.72 0.63 -2.73 1.61 2.88 -1.26 -4.04 113.62 106.99 2dj4 n SER 23 Ca 0.05 -1.88 -0.33 0.00 -1.33 0.00 0.00 58.87 55.38 2dj4 n SER 23 Cb 0.55 -0.07 0.01 0.00 -0.75 0.00 0.00 64.21 63.96 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 0.75 5.80 3.83 0.46 0.00 -1.26 -4.94 105.19 109.82 2dj4 n GLY 24 Ca 0.07 -2.65 -0.35 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 -5.24 5.13 0.14 1.61 1.01 -1.26 -5.02 120.40 116.77 2dj4 s VAL 25 Ca 0.49 -0.04 0.11 0.00 0.00 0.00 0.00 61.98 62.54 2dj4 s VAL 25 Cb 0.40 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 2dj4 s VAL 25 CO -0.28 0.53 -0.24 -0.13 0.00 0.00 0.00 175.10 174.98 2dj4 s ARG 26 N -1.25 1.53 0.56 2.72 0.52 -1.26 0.22 118.95 121.99 2dj4 s ARG 26 Ca 0.18 -1.33 -0.19 0.00 -0.52 0.00 0.00 55.73 53.86 2dj4 s ARG 26 Cb -0.12 -1.95 -0.05 0.00 0.52 0.00 0.00 34.95 33.35 2dj4 s ARG 26 CO 0.07 0.45 1.15 0.00 0.02 0.00 0.00 175.30 176.99 2dj4 s ALA 27 N -1.19 2.65 -1.49 2.13 0.00 0.16 -3.26 121.76 120.77 2dj4 s ALA 27 Ca 0.16 0.86 -0.12 0.00 0.00 0.00 0.00 51.96 52.86 2dj4 s ALA 27 Cb -0.10 -3.38 0.07 0.00 0.00 0.00 0.00 23.12 19.71 2dj4 s ALA 27 CO 0.08 -0.87 1.03 0.54 0.00 0.00 0.00 175.76 176.54 2dj4 n ARG 28 N -1.40 -6.12 -4.19 0.00 1.74 0.65 -4.39 116.66 102.95 2dj4 n ARG 28 Ca 0.12 0.65 -0.19 0.00 -0.77 0.00 0.00 57.85 57.67 2dj4 n ARG 28 Cb 0.51 -5.58 -0.12 0.00 -1.02 0.00 0.00 32.46 26.25 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 -3.31 1.21 -0.39 1.55 1.01 -1.20 -5.00 120.40 114.26 2dj4 s VAL 29 Ca 0.63 -1.40 -0.29 0.00 0.00 0.00 0.00 61.98 60.93 2dj4 s VAL 29 Cb -0.31 -1.20 0.00 0.00 0.00 0.00 0.00 36.38 34.88 2dj4 s VAL 29 CO 0.81 -0.24 1.47 -0.22 0.00 0.00 0.00 175.10 176.91 2dj4 s LEU 30 N -1.87 3.59 -0.14 3.92 2.96 -1.26 -4.09 118.68 121.79 2dj4 s LEU 30 Ca 0.01 0.93 0.00 0.00 -0.22 0.00 0.00 54.13 54.84 2dj4 s LEU 30 Cb -0.09 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.05 2dj4 s LEU 30 CO 0.03 -1.45 -0.14 -1.10 -1.32 0.00 0.00 176.35 172.36 2dj4 s GLN 31 N 5.00 3.29 0.01 1.98 -1.52 0.84 -4.98 119.66 124.28 2dj4 s GLN 31 Ca 0.64 -0.72 -0.05 0.00 -1.95 0.00 0.00 55.36 53.27 2dj4 s GLN 31 Cb -0.15 -2.62 -0.00 0.00 -0.22 0.00 0.00 33.01 30.01 2dj4 s GLN 31 CO 0.32 0.11 0.09 0.45 -0.25 0.00 0.00 175.29 176.02 2dj4 s SER 32 N 0.59 0.07 0.29 5.90 0.15 -1.26 0.01 113.70 119.45 2dj4 s SER 32 Ca -0.08 -0.26 0.05 0.00 0.70 0.00 0.00 55.95 56.36 2dj4 s SER 32 Cb -0.16 0.18 -0.02 0.00 -1.71 0.00 0.00 66.02 64.31 2dj4 s SER 32 CO 0.03 -0.34 0.27 2.22 1.20 0.00 0.00 173.24 176.63 2dj4 n PHE 33 N 1.56 -0.79 -5.06 3.44 -1.74 -1.15 -3.10 117.46 110.63 2dj4 n PHE 33 Ca -0.23 -2.36 -0.28 0.00 -0.56 0.00 0.00 57.45 54.02 2dj4 n PHE 33 Cb 0.56 0.29 -0.16 0.00 1.52 0.00 0.00 39.48 41.68 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 -3.10 1.72 -0.30 1.97 2.01 0.21 -2.75 115.64 115.39 2dj4 s THR 34 Ca 0.33 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.43 2dj4 s THR 34 Cb 0.01 -1.45 0.07 0.00 0.01 0.00 0.00 72.50 71.14 2dj4 s THR 34 CO 0.23 0.49 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.94 2dj4 s VAL 35 N -0.29 2.56 -0.81 3.82 1.01 -0.03 -0.63 120.40 126.02 2dj4 s VAL 35 Ca 0.02 -1.73 -0.21 0.00 0.00 0.00 0.00 61.98 60.06 2dj4 s VAL 35 Cb -0.10 -2.59 0.09 0.00 0.00 0.00 0.00 36.38 33.78 2dj4 s VAL 35 CO 0.01 -0.22 1.10 -0.62 0.00 0.00 0.00 175.10 175.36 2dj4 s ASP 36 N 1.18 6.40 -0.22 3.32 2.15 0.24 -1.21 116.67 128.53 2dj4 s ASP 36 Ca -0.02 -1.46 0.15 0.00 0.43 0.00 0.00 52.55 51.64 2dj4 s ASP 36 Cb -0.20 -2.43 0.73 0.00 -0.30 0.00 0.00 42.92 40.72 2dj4 s ASP 36 CO -0.04 -1.31 1.65 -1.54 -0.17 0.00 0.00 175.17 173.76 2dj4 n SER 37 N 7.42 5.16 0.01 -0.34 3.41 -1.20 -2.06 113.62 126.02 2dj4 n SER 37 Ca 0.12 -2.97 -0.05 0.00 -0.26 0.00 0.00 58.87 55.71 2dj4 n SER 37 Cb 0.48 -0.64 0.16 0.00 -0.26 0.00 0.00 64.21 63.94 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 3.29 0.51 1.06 4.04 0.87 -1.81 -2.46 113.55 119.05 2dj4 h SER 38 Ca 0.00 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 2dj4 h SER 38 Cb 1.82 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 63.64 2dj4 h SER 38 CO 0.41 0.81 -0.17 0.29 -0.53 0.00 0.00 176.83 177.64 2dj4 n LYS 39 N -4.07 0.13 0.10 2.24 4.76 -1.26 -3.67 118.16 116.38 2dj4 n LYS 39 Ca -0.01 0.08 -0.23 0.00 -2.87 0.00 0.00 58.31 55.28 2dj4 n LYS 39 Cb 0.46 -1.62 -0.15 0.00 -1.84 0.00 0.00 35.03 31.87 2dj4 n LYS 39 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dj4 h ALA 40 N 2.78 0.04 0.00 7.82 0.00 -1.62 -3.44 119.26 124.84 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 0.61 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2dj4 h ALA 40 CO 0.00 0.91 0.00 0.41 0.00 0.00 0.00 179.25 180.57 2dj4 n GLY 41 N 1.80 0.55 1.00 0.00 0.00 -0.99 -0.49 105.19 107.06 2dj4 n GLY 41 Ca -0.21 -1.61 0.08 0.00 0.00 0.00 0.00 46.02 44.27 2dj4 n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dj4 n LEU 42 N 0.00 3.80 -4.80 0.99 7.99 -1.26 -4.65 117.00 119.06 2dj4 n LEU 42 Ca 0.00 -2.50 -0.34 0.00 -0.01 0.00 0.00 56.01 53.17 2dj4 n LEU 42 Cb 0.00 -0.44 -0.03 0.00 -0.11 0.00 0.00 43.42 42.84 2dj4 n LEU 42 CO 0.00 0.73 0.71 0.00 -1.51 0.00 0.00 177.39 177.32 2dj4 s ALA 43 N -1.91 2.87 1.00 -1.18 0.00 -1.26 -5.04 121.76 116.24 2dj4 s ALA 43 Ca 0.38 0.52 -0.12 0.00 0.00 0.00 0.00 51.96 52.73 2dj4 s ALA 43 Cb 0.26 -3.23 0.19 0.00 0.00 0.00 0.00 23.12 20.34 2dj4 s ALA 43 CO 0.16 -0.38 1.09 -1.25 0.00 0.00 0.00 175.76 175.38 2dj4 s PRO 44 N -3.47 0.42 -0.02 0.00 0.04 -1.26 -4.83 135.00 125.88 2dj4 s PRO 44 Ca 0.65 0.52 0.06 0.00 0.04 0.00 0.00 61.00 62.28 2dj4 s PRO 44 Cb -0.15 -1.74 -0.01 0.00 0.04 0.00 0.00 34.50 32.64 2dj4 s PRO 44 CO 0.24 -2.74 -0.20 -1.17 0.04 0.00 0.00 177.00 173.17 2dj4 s LEU 45 N -6.46 2.03 -0.00 -3.56 2.96 -1.26 -3.05 118.68 109.33 2dj4 s LEU 45 Ca 0.65 -0.36 0.04 0.00 -0.22 0.00 0.00 54.13 54.25 2dj4 s LEU 45 Cb -0.19 -1.02 -0.03 0.00 0.50 0.00 0.00 46.19 45.45 2dj4 s LEU 45 CO 0.58 0.23 -0.11 -0.70 -1.32 0.00 0.00 176.35 175.03 2dj4 s GLU 46 N -0.41 2.42 -0.03 1.98 2.12 -0.25 -4.94 118.70 119.58 2dj4 s GLU 46 Ca 0.06 -0.78 0.01 0.00 0.36 0.00 0.00 54.97 54.62 2dj4 s GLU 46 Cb -0.08 -2.40 0.02 0.00 0.26 0.00 0.00 34.13 31.93 2dj4 s GLU 46 CO -0.00 0.59 -0.03 0.08 -0.54 0.00 0.00 175.26 175.36 2dj4 s VAL 47 N -0.91 0.40 -0.01 3.70 1.01 -1.26 -1.50 120.40 121.83 2dj4 s VAL 47 Ca 0.15 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.05 2dj4 s VAL 47 Cb -0.11 -0.44 -0.00 0.00 0.00 0.00 0.00 36.38 35.83 2dj4 s VAL 47 CO 0.05 0.18 0.03 -0.60 0.00 0.00 0.00 175.10 174.77 2dj4 s ARG 48 N 0.81 0.14 -0.06 2.72 3.52 0.90 -4.90 118.95 122.06 2dj4 s ARG 48 Ca -0.10 -0.13 0.04 0.00 -0.13 0.00 0.00 55.73 55.41 2dj4 s ARG 48 Cb -0.13 0.06 0.00 0.00 -1.56 0.00 0.00 34.95 33.32 2dj4 s ARG 48 CO -0.00 -0.02 -0.17 0.08 -0.81 0.00 0.00 175.30 174.37 2dj4 s VAL 49 N -0.42 1.51 0.10 7.11 1.01 -1.26 0.69 120.40 129.14 2dj4 s VAL 49 Ca -0.05 -0.73 0.10 0.00 0.00 0.00 0.00 61.98 61.31 2dj4 s VAL 49 Cb -0.03 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 2dj4 s VAL 49 CO -0.00 0.44 -0.26 -0.76 0.00 0.00 0.00 175.10 174.51 2dj4 s LEU 50 N 0.30 2.28 0.64 3.92 1.02 0.67 -3.62 118.68 123.89 2dj4 s LEU 50 Ca -0.11 -0.70 -0.01 0.00 0.02 0.00 0.00 54.13 53.33 2dj4 s LEU 50 Cb -0.14 -1.20 0.07 0.00 0.02 0.00 0.00 46.19 44.94 2dj4 s LEU 50 CO 0.04 0.19 0.90 -0.83 0.02 0.00 0.00 176.35 176.67 2dj4 s GLY 51 N -1.82 1.78 0.31 -3.19 0.00 0.16 -2.18 107.32 102.38 2dj4 s GLY 51 Ca 0.13 -1.38 0.10 0.00 0.00 0.00 0.00 44.72 43.56 2dj4 s GLY 51 CO 0.05 -0.97 1.70 -0.56 0.00 0.00 0.00 173.10 173.32 2dj4 h PRO 52 N -0.29 0.07 -0.13 2.90 0.13 -1.91 -3.12 132.00 129.65 2dj4 h PRO 52 Ca -0.41 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2dj4 h PRO 52 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2dj4 h PRO 52 CO 0.49 0.54 0.00 2.89 -0.23 0.00 0.00 178.00 181.70 2dj4 n ARG 53 N -3.96 1.49 0.00 0.86 -4.01 -1.26 -4.99 116.66 104.79 2dj4 n ARG 53 Ca -0.02 -1.45 0.00 0.00 -1.04 0.00 0.00 57.85 55.35 2dj4 n ARG 53 Cb 0.51 -1.18 0.00 0.00 -3.04 0.00 0.00 32.46 28.75 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 0.39 0.76 3.34 2.89 0.00 -1.18 -5.13 105.19 106.26 2dj4 n GLY 54 Ca 0.07 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 45.01 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 2.25 -0.35 0.99 2.96 -1.26 -4.81 118.68 118.46 2dj4 s LEU 55 Ca 0.00 -0.41 -0.07 0.00 -0.22 0.00 0.00 54.13 53.43 2dj4 s LEU 55 Cb 0.00 -1.41 0.05 0.00 0.50 0.00 0.00 46.19 45.33 2dj4 s LEU 55 CO 0.00 0.30 0.13 -0.69 -1.32 0.00 0.00 176.35 174.78 2dj4 s VAL 56 N -0.51 3.87 -0.01 1.68 1.01 -1.26 -0.66 120.40 124.51 2dj4 s VAL 56 Ca 0.07 -1.18 0.03 0.00 0.00 0.00 0.00 61.98 60.89 2dj4 s VAL 56 Cb -0.11 -3.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.01 2dj4 s VAL 56 CO 0.01 -0.24 -0.07 -1.61 0.00 0.00 0.00 175.10 173.18 2dj4 s GLU 57 N 1.40 2.59 0.97 2.72 0.41 -1.24 -5.08 118.70 120.48 2dj4 s GLU 57 Ca -0.01 -0.68 -0.12 0.00 -0.41 0.00 0.00 54.97 53.75 2dj4 s GLU 57 Cb -0.20 -2.52 0.17 0.00 -1.78 0.00 0.00 34.13 29.80 2dj4 s GLU 57 CO 0.03 0.62 1.09 -1.25 -0.49 0.00 0.00 175.26 175.26 2dj4 s PRO 58 N -1.26 0.69 0.11 0.39 0.04 -1.26 -4.31 135.00 129.40 2dj4 s PRO 58 Ca 0.16 0.61 -0.03 0.00 0.04 0.00 0.00 61.00 61.78 2dj4 s PRO 58 Cb -0.11 -1.76 -0.03 0.00 0.04 0.00 0.00 34.50 32.64 2dj4 s PRO 58 CO 0.06 -2.58 0.08 0.14 0.04 0.00 0.00 177.00 174.74 2dj4 s VAL 59 N -2.96 0.14 -0.02 -0.36 -7.23 -1.26 -4.84 120.40 103.87 2dj4 s VAL 59 Ca 0.65 -1.73 0.05 0.00 -1.81 0.00 0.00 61.98 59.14 2dj4 s VAL 59 Cb -0.18 -1.78 -0.03 0.00 0.56 0.00 0.00 36.38 34.95 2dj4 s VAL 59 CO 0.57 -0.62 -0.17 0.21 -0.31 0.00 0.00 175.10 174.78 2dj4 s ASN 60 N -2.98 3.83 -0.13 4.85 2.47 -1.09 -5.01 114.94 116.89 2dj4 s ASN 60 Ca 0.16 -0.29 -0.01 0.00 0.42 0.00 0.00 52.86 53.13 2dj4 s ASN 60 Cb 0.07 -0.72 0.04 0.00 -1.45 0.00 0.00 41.25 39.19 2dj4 s ASN 60 CO -0.03 0.32 -0.01 -0.69 -3.72 0.00 0.00 177.10 172.96 2dj4 s VAL 61 N -0.76 0.68 -0.04 -5.21 1.01 -1.26 -3.75 120.40 111.07 2dj4 s VAL 61 Ca 0.12 -0.29 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 2dj4 s VAL 61 Cb -0.10 -0.92 0.03 0.00 0.00 0.00 0.00 36.38 35.39 2dj4 s VAL 61 CO 0.02 0.12 0.02 -0.69 0.00 0.00 0.00 175.10 174.57 2dj4 s VAL 62 N 1.82 0.10 0.06 2.92 1.01 -0.87 -5.00 120.40 120.44 2dj4 s VAL 62 Ca 0.02 0.22 -0.30 0.00 0.00 0.00 0.00 61.98 61.92 2dj4 s VAL 62 Cb -0.14 -0.27 -0.05 0.00 0.00 0.00 0.00 36.38 35.92 2dj4 s VAL 62 CO -0.07 0.17 0.95 -0.62 0.00 0.00 0.00 175.10 175.53 2dj4 s ASP 63 N 1.58 7.42 0.10 3.32 2.15 -1.26 -0.55 116.67 129.42 2dj4 s ASP 63 Ca -0.02 1.71 -0.13 0.00 0.43 0.00 0.00 52.55 54.53 2dj4 s ASP 63 Cb -0.13 -2.57 -0.14 0.00 -0.30 0.00 0.00 42.92 39.78 2dj4 s ASP 63 CO -0.03 -0.14 1.32 0.78 -0.17 0.00 0.00 175.17 176.93 2dj4 h ASN 64 N 6.07 0.90 0.00 -0.34 2.35 -1.74 -3.48 115.58 119.34 2dj4 h ASN 64 Ca -0.42 -0.60 0.00 0.00 -0.55 0.00 0.00 56.30 54.72 2dj4 h ASN 64 Cb 1.21 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.32 2dj4 h ASN 64 CO 0.73 1.35 0.00 0.61 -1.65 0.00 0.00 177.43 178.47 2dj4 n GLY 65 N 0.61 1.51 0.10 2.83 0.00 -1.26 -4.92 105.19 104.06 2dj4 n GLY 65 Ca -0.07 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.77 2dj4 n GLY 65 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2dj4 h ASP 66 N 1.06 0.20 0.00 1.61 2.03 -2.03 -3.47 116.42 115.82 2dj4 h ASP 66 Ca 0.00 -0.86 0.00 0.00 -0.73 0.00 0.00 57.03 55.44 2dj4 h ASP 66 Cb 0.00 -0.06 0.00 0.00 -0.83 0.00 0.00 39.33 38.44 2dj4 h ASP 66 CO 0.00 1.33 0.00 0.61 -1.03 0.00 0.00 179.24 180.15 2dj4 n GLY 67 N 1.62 0.00 3.40 7.15 0.00 -1.26 -5.04 105.19 111.06 2dj4 n GLY 67 Ca -0.19 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.10 115.64 109.56 2dj4 s THR 68 Ca 0.00 -1.76 -0.06 0.00 -1.18 0.00 0.00 61.69 58.69 2dj4 s THR 68 Cb 0.00 -2.57 0.04 0.00 1.34 0.00 0.00 72.50 71.32 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 -3.31 -0.32 0.04 3.99 0.09 -0.35 -1.84 115.29 113.59 2dj4 s HIS 69 Ca 0.34 0.77 -0.13 0.00 -0.00 0.00 0.00 55.06 56.04 2dj4 s HIS 69 Cb 0.01 0.06 -0.06 0.00 -0.00 0.00 0.00 32.58 32.59 2dj4 s HIS 69 CO 0.22 -0.21 0.42 0.99 -0.00 0.00 0.00 174.74 176.16 2dj4 s THR 70 N 1.02 5.02 -0.26 1.30 2.01 0.28 -0.85 115.64 124.17 2dj4 s THR 70 Ca -0.07 0.74 -0.02 0.00 0.31 0.00 0.00 61.69 62.65 2dj4 s THR 70 Cb -0.08 -3.70 0.08 0.00 0.01 0.00 0.00 72.50 68.81 2dj4 s THR 70 CO -0.07 0.47 0.06 -0.69 -0.69 0.00 0.00 174.62 173.70 2dj4 s VAL 71 N -1.20 0.75 -0.03 3.82 1.01 -1.11 -2.04 120.40 121.59 2dj4 s VAL 71 Ca 0.28 -1.02 -0.13 0.00 0.00 0.00 0.00 61.98 61.10 2dj4 s VAL 71 Cb -0.16 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 34.77 2dj4 s VAL 71 CO 0.15 -0.45 0.35 0.42 0.00 0.00 0.00 175.10 175.58 2dj4 s THR 72 N 1.72 5.13 0.30 3.92 -4.23 -1.25 -2.95 115.64 118.28 2dj4 s THR 72 Ca 0.04 0.70 -0.19 0.00 -1.18 0.00 0.00 61.69 61.06 2dj4 s THR 72 Cb -0.17 -3.64 0.02 0.00 1.34 0.00 0.00 72.50 70.05 2dj4 s THR 72 CO -0.18 0.59 0.71 -0.72 -0.54 0.00 0.00 174.62 174.49 2dj4 s TYR 73 N -1.07 -0.09 -0.17 3.99 -0.85 0.10 -2.68 117.35 116.58 2dj4 s TYR 73 Ca 0.22 -0.40 -0.04 0.00 -0.52 0.00 0.00 57.07 56.33 2dj4 s TYR 73 Cb -0.16 0.69 0.09 0.00 0.38 0.00 0.00 41.96 42.96 2dj4 s TYR 73 CO 0.11 -1.28 0.27 0.99 -1.52 0.00 0.00 175.55 174.12 2dj4 s THR 74 N -3.65 -0.42 -0.86 -3.49 2.01 -1.26 -0.11 115.64 107.86 2dj4 s THR 74 Ca 0.13 0.09 -0.25 0.00 0.31 0.00 0.00 61.69 61.96 2dj4 s THR 74 Cb -0.05 -0.59 -0.04 0.00 0.01 0.00 0.00 72.50 71.82 2dj4 s THR 74 CO 0.08 -0.03 1.94 -2.16 -0.69 0.00 0.00 174.62 173.75 2dj4 s PRO 75 N 2.41 2.56 0.12 4.92 0.04 -1.26 -4.84 135.00 138.96 2dj4 s PRO 75 Ca 0.05 -0.16 -0.21 0.00 0.04 0.00 0.00 61.00 60.71 2dj4 s PRO 75 Cb -0.14 -4.97 -0.04 0.00 0.04 0.00 0.00 34.50 29.40 2dj4 s PRO 75 CO -0.11 -3.29 1.08 0.45 0.04 0.00 0.00 177.00 175.17 2dj4 n SER 76 N 13.82 -0.73 -4.43 6.66 2.88 -1.26 -0.25 113.62 130.31 2dj4 n SER 76 Ca 0.37 1.25 -0.23 0.00 -1.33 0.00 0.00 58.87 58.93 2dj4 n SER 76 Cb 0.48 -0.17 -0.10 0.00 -0.75 0.00 0.00 64.21 63.66 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 1.55 0.94 -1.46 -2.07 -1.26 -3.37 119.66 108.62 2dj4 s GLN 77 Ca -0.09 -1.65 -0.14 0.00 -1.82 0.00 0.00 55.36 51.66 2dj4 s GLN 77 Cb 0.08 -1.64 0.16 0.00 -1.09 0.00 0.00 33.01 30.53 2dj4 s GLN 77 CO 0.44 0.31 1.21 -1.83 -1.32 0.00 0.00 175.29 174.10 2dj4 s GLU 78 N -3.29 0.87 0.00 9.60 1.03 -1.26 -4.84 118.70 120.81 2dj4 s GLU 78 Ca 0.25 -0.03 0.00 0.00 0.03 0.00 0.00 54.97 55.22 2dj4 s GLU 78 Cb -0.05 -1.84 0.00 0.00 -0.80 0.00 0.00 34.13 31.44 2dj4 s GLU 78 CO 0.12 -2.32 0.00 0.41 -1.33 0.00 0.00 175.26 172.14 2dj4 n GLY 79 N -2.84 1.51 3.57 -3.83 0.00 -0.70 -4.93 105.19 97.98 2dj4 n GLY 79 Ca 0.11 -2.14 -0.27 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 -1.31 2.53 0.82 1.61 0.04 -1.26 -0.20 135.00 137.23 2dj4 s PRO 80 Ca 0.00 -0.63 -0.10 0.00 0.04 0.00 0.00 61.00 60.31 2dj4 s PRO 80 Cb 0.00 -5.13 0.12 0.00 0.04 0.00 0.00 34.50 29.53 2dj4 s PRO 80 CO 0.00 -3.62 1.16 0.71 0.04 0.00 0.00 177.00 175.29 2dj4 s TYR 81 N 10.48 2.33 -0.16 0.56 1.51 -0.11 -3.88 117.35 128.07 2dj4 s TYR 81 Ca 0.69 0.39 -0.06 0.00 -1.01 0.00 0.00 57.07 57.09 2dj4 s TYR 81 Cb -0.04 -3.56 0.07 0.00 -0.11 0.00 0.00 41.96 38.32 2dj4 s TYR 81 CO 0.05 -1.96 0.33 1.41 -1.11 0.00 0.00 175.55 174.27 2dj4 s MET 82 N -5.53 0.23 -0.44 -0.62 -2.45 -0.93 -2.38 119.30 107.17 2dj4 s MET 82 Ca 0.66 0.86 -0.07 0.00 -1.25 0.00 0.00 55.69 55.89 2dj4 s MET 82 Cb -0.08 0.11 0.11 0.00 1.25 0.00 0.00 34.83 36.23 2dj4 s MET 82 CO 0.49 -0.26 0.28 0.08 1.05 0.00 0.00 175.02 176.66 2dj4 s VAL 83 N 2.41 3.83 0.29 10.11 1.01 0.05 -0.24 120.40 137.86 2dj4 s VAL 83 Ca -0.01 -1.89 -0.22 0.00 0.00 0.00 0.00 61.98 59.87 2dj4 s VAL 83 Cb -0.12 -3.56 -0.09 0.00 0.00 0.00 0.00 36.38 32.62 2dj4 s VAL 83 CO -0.10 -0.73 0.83 -0.55 0.00 0.00 0.00 175.10 174.54 2dj4 s SER 84 N 2.31 7.13 -0.01 3.32 0.15 0.22 -1.10 113.70 125.72 2dj4 s SER 84 Ca 0.07 1.59 -0.01 0.00 0.70 0.00 0.00 55.95 58.30 2dj4 s SER 84 Cb -0.25 -2.49 0.01 0.00 -1.71 0.00 0.00 66.02 61.58 2dj4 s SER 84 CO -0.02 -0.06 0.02 -0.69 1.20 0.00 0.00 173.24 173.69 2dj4 s VAL 85 N -1.66 -0.01 0.38 4.45 1.01 -1.26 -0.07 120.40 123.24 2dj4 s VAL 85 Ca 0.48 0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.54 2dj4 s VAL 85 Cb -0.16 -0.05 -0.05 0.00 0.00 0.00 0.00 36.38 36.12 2dj4 s VAL 85 CO 0.21 0.01 0.07 -0.75 0.00 0.00 0.00 175.10 174.64 2dj4 s LYS 86 N 0.18 1.82 -0.30 2.72 2.20 -0.56 -3.31 119.74 122.49 2dj4 s LYS 86 Ca -0.01 -2.06 -0.01 0.00 -0.36 0.00 0.00 55.97 53.53 2dj4 s LYS 86 Cb -0.02 -0.96 0.19 0.00 -1.51 0.00 0.00 37.83 35.53 2dj4 s LYS 86 CO -0.01 -0.27 0.61 -0.47 -0.36 0.00 0.00 175.35 174.85 2dj4 s TYR 87 N -3.16 -1.61 -1.24 4.03 5.04 -0.97 -1.09 117.35 118.35 2dj4 s TYR 87 Ca 0.30 1.67 -0.06 0.00 -2.44 0.00 0.00 57.07 56.54 2dj4 s TYR 87 Cb 0.07 0.55 0.01 0.00 0.35 0.00 0.00 41.96 42.93 2dj4 s TYR 87 CO 0.14 -0.88 0.79 0.00 -1.34 0.00 0.00 175.55 174.26 2dj4 n ALA 88 N 5.43 -0.99 -2.63 3.97 0.00 -1.17 -2.18 120.51 122.95 2dj4 n ALA 88 Ca -0.01 0.30 -0.13 0.00 0.00 0.00 0.00 53.44 53.60 2dj4 n ALA 88 Cb 0.51 -4.18 0.02 0.00 0.00 0.00 0.00 19.45 15.80 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 -2.14 -4.27 -3.48 0.00 9.92 -1.26 -5.00 116.55 110.31 2dj4 n ASP 89 Ca -0.04 -0.14 -0.21 0.00 -0.53 0.00 0.00 54.79 53.87 2dj4 n ASP 89 Cb 0.57 -3.21 -0.13 0.00 -0.64 0.00 0.00 41.12 37.72 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 -5.12 0.22 -0.26 -1.24 2.02 -0.93 -5.10 118.70 108.29 2dj4 s GLU 90 Ca 0.15 -0.07 -0.33 0.00 0.02 0.00 0.00 54.97 54.75 2dj4 s GLU 90 Cb -0.07 -1.08 -0.09 0.00 0.10 0.00 0.00 34.13 32.99 2dj4 s GLU 90 CO 0.18 -0.84 2.15 0.39 0.02 0.00 0.00 175.26 177.16 2dj4 n GLU 91 N 5.30 1.54 -1.28 1.61 1.02 -1.26 -2.30 120.64 125.27 2dj4 n GLU 91 Ca -0.05 0.45 -0.37 0.00 -0.02 0.00 0.00 57.16 57.18 2dj4 n GLU 91 Cb 0.47 -2.75 0.06 0.00 -0.02 0.00 0.00 31.44 29.20 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 7.05 1.64 0.97 -3.67 -5.35 -1.21 -4.80 119.36 113.99 2dj4 n ILE 92 Ca 0.34 -0.43 0.05 0.00 -0.27 0.00 0.00 62.75 62.44 2dj4 n ILE 92 Cb 0.31 -0.63 0.28 0.00 -1.74 0.00 0.00 39.64 37.86 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 -0.28 0.49 0.00 6.28 -0.04 -1.26 -1.70 135.00 138.48 2dj4 n PRO 93 Ca 0.10 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.59 2dj4 n PRO 93 Cb 0.49 -1.31 0.02 0.00 -0.04 0.00 0.00 33.50 32.66 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 -0.81 0.99 -4.26 0.54 5.12 -1.26 -5.01 116.66 111.96 2dj4 n ARG 94 Ca 0.07 -0.74 -0.27 0.00 -1.93 0.00 0.00 57.85 54.98 2dj4 n ARG 94 Cb 0.03 -1.07 -0.09 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 -0.79 4.35 1.15 0.55 0.15 -0.69 -4.18 113.70 114.23 2dj4 s SER 95 Ca 0.07 -0.51 -0.18 0.00 0.70 0.00 0.00 55.95 56.04 2dj4 s SER 95 Cb 0.06 -0.78 0.26 0.00 -1.71 0.00 0.00 66.02 63.85 2dj4 s SER 95 CO 0.12 0.12 1.11 -2.16 1.20 0.00 0.00 173.24 173.63 2dj4 s PRO 96 N -2.68 -0.84 -0.22 5.44 0.04 -1.26 -4.78 135.00 130.70 2dj4 s PRO 96 Ca 0.24 0.07 -0.01 0.00 0.04 0.00 0.00 61.00 61.34 2dj4 s PRO 96 Cb -0.09 -1.63 0.02 0.00 0.04 0.00 0.00 34.50 32.83 2dj4 s PRO 96 CO 0.15 -3.49 -0.11 -0.06 0.04 0.00 0.00 177.00 173.54 2dj4 s PHE 97 N -3.00 2.94 -0.54 0.56 0.08 -0.26 -4.96 117.98 112.82 2dj4 s PHE 97 Ca 0.70 -1.44 -0.28 0.00 0.12 0.00 0.00 56.93 56.02 2dj4 s PHE 97 Cb -0.12 -2.02 0.02 0.00 -0.57 0.00 0.00 43.02 40.34 2dj4 s PHE 97 CO 0.56 -0.71 1.25 0.15 -0.10 0.00 0.00 175.22 176.37 2dj4 s LYS 98 N 1.35 3.53 -0.32 0.44 1.02 -1.26 -0.77 119.74 123.72 2dj4 s LYS 98 Ca 0.03 0.44 0.03 0.00 0.02 0.00 0.00 55.97 56.49 2dj4 s LYS 98 Cb -0.15 -4.01 0.09 0.00 -0.52 0.00 0.00 37.83 33.24 2dj4 s LYS 98 CO -0.07 -1.65 0.02 0.08 -0.92 0.00 0.00 175.35 172.80 2dj4 s VAL 99 N 5.12 2.36 -0.69 3.17 1.01 -1.00 -5.00 120.40 125.36 2dj4 s VAL 99 Ca 0.48 -2.11 -0.25 0.00 0.00 0.00 0.00 61.98 60.10 2dj4 s VAL 99 Cb -0.09 -2.63 0.05 0.00 0.00 0.00 0.00 36.38 33.71 2dj4 s VAL 99 CO 0.28 -0.44 1.13 -0.75 0.00 0.00 0.00 175.10 175.32 2dj4 s LYS 100 N 0.98 3.17 0.44 2.72 2.20 -1.26 -0.94 119.74 127.05 2dj4 s LYS 100 Ca 0.05 -0.47 -0.24 0.00 -0.36 0.00 0.00 55.97 54.95 2dj4 s LYS 100 Cb -0.20 -4.19 -0.08 0.00 -1.51 0.00 0.00 37.83 31.86 2dj4 s LYS 100 CO -0.07 -1.97 1.20 0.08 -0.36 0.00 0.00 175.35 174.23 2dj4 s VAL 101 N 4.96 2.98 0.18 4.02 1.01 0.72 -4.62 120.40 129.65 2dj4 s VAL 101 Ca 0.30 0.79 0.08 0.00 0.00 0.00 0.00 61.98 63.14 2dj4 s VAL 101 Cb -0.12 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 2dj4 s VAL 101 CO 0.13 0.04 -0.02 -0.76 0.00 0.00 0.00 175.10 174.49 2dj4 s LEU 102 N -2.80 3.23 -0.02 3.92 1.43 0.13 -1.72 118.68 122.86 2dj4 s LEU 102 Ca 0.61 -0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 52.97 2dj4 s LEU 102 Cb -0.31 -1.89 -0.05 0.00 0.03 0.00 0.00 46.19 43.96 2dj4 s LEU 102 CO 0.39 0.09 1.47 -2.16 0.23 0.00 0.00 176.35 176.37 2dj4 s PRO 103 N -2.93 4.24 0.44 1.29 0.04 -1.26 0.38 135.00 137.20 2dj4 s PRO 103 Ca 0.27 2.02 0.39 0.00 0.04 0.00 0.00 61.00 63.72 2dj4 s PRO 103 Cb -0.09 -3.70 1.38 0.00 0.04 0.00 0.00 34.50 32.14 2dj4 s PRO 103 CO 0.18 -0.67 1.27 2.41 0.04 0.00 0.00 177.00 180.22 2dj4 n THR 104 N 4.95 -0.03 -2.93 1.26 -1.04 -1.26 -4.20 114.28 111.03 2dj4 n THR 104 Ca 0.14 1.24 -0.39 0.00 -2.04 0.00 0.00 64.05 63.00 2dj4 n THR 104 Cb 0.43 -2.07 -0.06 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 -4.56 3.92 -0.71 -1.42 2.02 -1.26 -5.01 117.35 110.33 2dj4 s TYR 105 Ca -0.04 1.70 -0.18 0.00 -0.37 0.00 0.00 57.07 58.17 2dj4 s TYR 105 Cb 0.22 -2.81 0.12 0.00 -0.40 0.00 0.00 41.96 39.09 2dj4 s TYR 105 CO 0.72 0.50 0.84 0.16 -1.57 0.00 0.00 175.55 176.19 2dj4 s ASP 106 N -1.16 6.37 -0.07 2.29 -4.77 -1.26 -4.91 116.67 113.15 2dj4 s ASP 106 Ca 0.37 -1.72 -0.02 0.00 -3.30 0.00 0.00 52.55 47.88 2dj4 s ASP 106 Cb -0.24 -2.32 -0.06 0.00 -1.09 0.00 0.00 42.92 39.21 2dj4 s ASP 106 CO 0.27 -1.06 2.60 0.00 0.70 0.00 0.00 175.17 177.69 2dj4 n ALA 107 N 6.17 5.10 -0.28 2.11 0.00 -1.26 -5.22 120.51 127.13 2dj4 n ALA 107 Ca 0.02 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.44 2dj4 n ALA 107 Cb 0.45 -1.56 0.00 0.00 0.00 0.00 0.00 19.45 18.33 2dj4 n ALA 107 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37