#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dj5 s MET 1 N 0.00 3.30 -0.16 1.61 0.00 -1.26 -5.07 119.30 117.73 2dj5 s MET 1 Ca 0.00 -0.55 -0.29 0.00 0.00 0.00 0.00 55.69 54.84 2dj5 s MET 1 Cb 0.00 -2.94 -0.02 0.00 0.00 0.00 0.00 34.83 31.87 2dj5 s MET 1 CO 0.00 0.57 1.41 1.03 0.00 0.00 0.00 175.02 178.04 2dj5 s ARG 2 N -2.71 4.12 -0.22 3.16 1.81 -1.26 -4.94 118.95 118.91 2dj5 s ARG 2 Ca 0.34 1.75 -0.05 0.00 -1.72 0.00 0.00 55.73 56.05 2dj5 s ARG 2 Cb -0.12 -3.87 -0.01 0.00 -0.45 0.00 0.00 34.95 30.49 2dj5 s ARG 2 CO 0.27 -0.87 -0.02 1.03 -0.68 0.00 0.00 175.30 175.03 2dj5 s ARG 3 N 3.88 3.45 0.39 3.54 0.52 -1.26 -1.24 118.95 128.23 2dj5 s ARG 3 Ca 0.62 -0.59 0.08 0.00 -0.52 0.00 0.00 55.73 55.32 2dj5 s ARG 3 Cb -0.24 -3.07 -0.04 0.00 0.52 0.00 0.00 34.95 32.11 2dj5 s ARG 3 CO 0.21 -0.17 0.22 0.20 0.02 0.00 0.00 175.30 175.78 2dj5 s GLY 4 N 1.45 2.14 -0.12 -3.53 0.00 0.16 -0.58 107.32 106.84 2dj5 s GLY 4 Ca 0.05 -1.94 -0.06 0.00 0.00 0.00 0.00 44.72 42.77 2dj5 s GLY 4 CO -0.01 -1.79 0.27 -2.27 0.00 0.00 0.00 173.10 169.30 2dj5 s LEU 5 N -3.95 0.36 -0.16 0.66 2.96 -0.92 -1.72 118.68 115.91 2dj5 s LEU 5 Ca 0.42 0.59 0.01 0.00 -0.22 0.00 0.00 54.13 54.93 2dj5 s LEU 5 Cb -0.00 0.85 0.01 0.00 0.50 0.00 0.00 46.19 47.55 2dj5 s LEU 5 CO 0.24 -0.17 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.23 2dj5 s VAL 6 N 1.21 2.25 -0.49 1.68 1.01 0.06 -1.82 120.40 124.30 2dj5 s VAL 6 Ca -0.09 -0.90 -0.22 0.00 0.00 0.00 0.00 61.98 60.77 2dj5 s VAL 6 Cb -0.09 -1.93 0.04 0.00 0.00 0.00 0.00 36.38 34.39 2dj5 s VAL 6 CO -0.09 0.53 0.79 -0.63 0.00 0.00 0.00 175.10 175.71 2dj5 s ILE 7 N 1.05 4.62 -0.18 2.22 1.01 0.23 -0.57 121.20 129.57 2dj5 s ILE 7 Ca -0.01 0.19 -0.15 0.00 0.00 0.00 0.00 60.65 60.67 2dj5 s ILE 7 Cb -0.14 -4.37 -0.04 0.00 0.01 0.00 0.00 42.46 37.91 2dj5 s ILE 7 CO -0.06 -0.85 0.36 -0.69 0.00 0.00 0.00 174.94 173.71 2dj5 s VAL 8 N 3.33 5.24 0.36 2.92 1.01 0.59 -1.86 120.40 131.99 2dj5 s VAL 8 Ca 0.27 0.66 0.01 0.00 0.00 0.00 0.00 61.98 62.92 2dj5 s VAL 8 Cb -0.14 -3.70 -0.00 0.00 0.00 0.00 0.00 36.38 32.54 2dj5 s VAL 8 CO 0.19 0.31 0.04 0.61 0.00 0.00 0.00 175.10 176.26 2dj5 n GLY 9 N 3.69 3.61 3.49 4.51 0.00 -0.93 0.63 105.19 120.19 2dj5 n GLY 9 Ca -0.10 -2.23 0.00 0.00 0.00 0.00 0.00 46.02 43.70 2dj5 n GLY 9 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2dj5 s HIS 10 N -2.53 -0.78 0.00 1.61 2.46 -1.26 -2.25 115.29 112.54 2dj5 s HIS 10 Ca 0.06 1.39 0.08 0.00 0.47 0.00 0.00 55.06 57.07 2dj5 s HIS 10 Cb 0.00 0.47 0.13 0.00 -0.13 0.00 0.00 32.58 33.06 2dj5 s HIS 10 CO 0.04 -0.39 0.98 0.41 -2.47 0.00 0.00 174.74 173.32 2dj5 n GLY 11 N 4.80 0.73 7.00 1.59 0.00 -1.26 -5.10 105.19 112.95 2dj5 n GLY 11 Ca -0.12 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2dj5 n GLY 11 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dj5 n SER 12 N 0.16 -1.41 -3.46 1.61 7.64 -1.26 -3.97 113.62 112.93 2dj5 n SER 12 Ca -0.01 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.51 2dj5 n SER 12 Cb 0.81 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.98 2dj5 n SER 12 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dj5 n GLN 13 N 0.00 2.44 -4.92 1.43 1.13 -1.26 -4.86 117.38 111.34 2dj5 n GLN 13 Ca 0.00 -1.99 -0.32 0.00 -1.94 0.00 0.00 57.00 52.75 2dj5 n GLN 13 Cb 0.00 -2.85 -0.17 0.00 0.11 0.00 0.00 30.24 27.33 2dj5 n GLN 13 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2dj5 s LEU 14 N 0.92 2.05 0.11 1.08 1.43 -1.25 -5.02 118.68 118.00 2dj5 s LEU 14 Ca 0.52 -0.56 -0.21 0.00 -1.03 0.00 0.00 54.13 52.86 2dj5 s LEU 14 Cb 0.14 -1.38 -0.08 0.00 0.03 0.00 0.00 46.19 44.90 2dj5 s LEU 14 CO -0.01 0.11 1.74 0.78 0.23 0.00 0.00 176.35 179.20 2dj5 h ASN 15 N 7.02 0.02 -0.29 2.29 2.35 -1.95 -3.18 115.58 121.83 2dj5 h ASN 15 Ca -0.26 0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.47 2dj5 h ASN 15 Cb 1.21 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.59 2dj5 h ASN 15 CO 0.51 0.03 0.04 -0.74 -1.65 0.00 0.00 177.43 175.62 2dj5 h HIS 16 N 0.09 0.52 -0.41 1.19 2.76 -1.98 -1.87 115.15 115.44 2dj5 h HIS 16 Ca 0.06 -0.07 0.08 0.00 -2.20 0.00 0.00 60.37 58.24 2dj5 h HIS 16 Cb 0.05 -0.14 -0.08 0.00 1.55 0.00 0.00 27.41 28.78 2dj5 h HIS 16 CO -0.12 0.59 -0.12 -0.92 -1.30 0.00 0.00 177.93 176.06 2dj5 h TYR 17 N 0.30 -0.27 -0.26 5.26 3.20 -1.92 0.51 116.97 123.80 2dj5 h TYR 17 Ca 0.09 0.04 0.02 0.00 3.14 0.00 0.00 58.73 62.02 2dj5 h TYR 17 Cb 0.35 0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 2dj5 h TYR 17 CO 0.02 -0.20 0.12 -0.09 -1.64 0.00 0.00 178.16 176.37 2dj5 h ARG 18 N -0.02 0.24 -0.98 1.82 2.43 -1.53 -1.43 114.38 114.91 2dj5 h ARG 18 Ca 0.20 -0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.50 2dj5 h ARG 18 Cb 0.33 -0.06 -0.09 0.00 -0.42 0.00 0.00 29.97 29.74 2dj5 h ARG 18 CO -0.44 0.16 0.62 0.93 -1.51 0.00 0.00 179.97 179.73 2dj5 h GLU 19 N 0.25 0.85 -0.02 0.20 5.08 0.02 0.26 114.58 121.23 2dj5 h GLU 19 Ca 0.11 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2dj5 h GLU 19 Cb 0.05 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 2dj5 h GLU 19 CO -0.09 0.57 -0.00 0.28 -1.00 0.00 0.00 179.01 178.77 2dj5 h VAL 20 N 0.88 1.26 -0.78 3.13 2.07 0.14 -0.90 116.25 122.05 2dj5 h VAL 20 Ca 0.50 -0.76 0.13 0.00 0.82 0.00 0.00 66.70 67.39 2dj5 h VAL 20 Cb 0.63 1.74 -0.09 0.00 -1.52 0.00 0.00 31.29 32.05 2dj5 h VAL 20 CO -0.27 0.20 0.37 0.24 0.02 0.00 0.00 177.57 178.13 2dj5 h MET 21 N -0.28 0.54 -0.04 1.57 2.86 -0.30 -1.31 114.93 117.97 2dj5 h MET 21 Ca 0.00 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2dj5 h MET 21 Cb 0.33 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 31.86 2dj5 h MET 21 CO 0.00 0.36 0.01 1.49 1.06 0.00 0.00 176.91 179.83 2dj5 h GLU 22 N 0.56 0.02 -0.88 1.72 4.57 -0.44 -2.26 114.58 117.87 2dj5 h GLU 22 Ca 0.42 -0.00 0.14 0.00 -1.18 0.00 0.00 59.36 58.73 2dj5 h GLU 22 Cb 0.56 -0.00 -0.09 0.00 -0.16 0.00 0.00 28.75 29.06 2dj5 h GLU 22 CO -0.35 0.01 0.49 1.25 -1.18 0.00 0.00 179.01 179.24 2dj5 h LEU 23 N 0.02 0.65 -0.73 1.64 5.85 -0.10 0.37 115.31 123.02 2dj5 h LEU 23 Ca 0.02 0.08 -0.13 0.00 0.84 0.00 0.00 57.88 58.69 2dj5 h LEU 23 Cb 0.01 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2dj5 h LEU 23 CO -0.02 0.30 -0.60 0.45 -0.34 0.00 0.00 178.44 178.22 2dj5 h HIS 24 N 0.73 0.00 -0.07 1.25 3.86 -1.06 -0.82 115.15 119.04 2dj5 h HIS 24 Ca 0.47 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.58 2dj5 h HIS 24 Cb 0.60 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.07 2dj5 h HIS 24 CO -0.06 0.60 -0.33 -0.09 0.86 0.00 0.00 177.93 178.91 2dj5 h ARG 25 N 0.00 0.34 0.03 2.45 2.43 -0.30 -2.59 114.38 116.75 2dj5 h ARG 25 Ca -0.01 -0.28 0.03 0.00 -0.81 0.00 0.00 59.98 58.91 2dj5 h ARG 25 Cb 1.11 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.68 2dj5 h ARG 25 CO 0.08 0.92 -0.23 -0.22 -1.51 0.00 0.00 179.97 179.00 2dj5 h LYS 26 N -0.15 -0.37 -0.87 0.20 1.63 -0.32 0.29 116.57 116.97 2dj5 h LYS 26 Ca -0.02 0.03 0.05 0.00 -0.85 0.00 0.00 60.65 59.86 2dj5 h LYS 26 Cb 0.98 0.08 -0.05 0.00 -0.60 0.00 0.00 32.23 32.64 2dj5 h LYS 26 CO 0.07 -0.25 0.57 0.00 -3.45 0.00 0.00 179.45 176.39 2dj5 h ARG 27 N -0.38 1.00 0.23 1.90 3.08 -1.17 0.20 114.38 119.23 2dj5 h ARG 27 Ca 0.05 -0.06 -0.33 0.00 0.07 0.00 0.00 59.98 59.72 2dj5 h ARG 27 Cb 0.45 -0.22 0.03 0.00 0.08 0.00 0.00 29.97 30.30 2dj5 h ARG 27 CO -0.19 0.66 -1.49 0.82 -1.07 0.00 0.00 179.97 178.70 2dj5 h ILE 28 N 1.03 1.21 -0.15 2.04 2.04 -1.08 -2.05 117.51 120.54 2dj5 h ILE 28 Ca 0.36 -2.63 0.04 0.00 1.00 0.00 0.00 64.86 63.64 2dj5 h ILE 28 Cb 0.14 2.98 -0.05 0.00 -0.74 0.00 0.00 36.82 39.15 2dj5 h ILE 28 CO -0.13 0.81 -0.13 -0.08 0.00 0.00 0.00 178.15 178.63 2dj5 h GLU 29 N 0.08 -0.14 0.00 2.37 4.81 0.11 -1.04 114.58 120.77 2dj5 h GLU 29 Ca -0.27 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.96 2dj5 h GLU 29 Cb 2.10 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 31.51 2dj5 h GLU 29 CO 0.24 -0.09 -0.05 0.93 -0.73 0.00 0.00 179.01 179.31 2dj5 h GLU 30 N -0.15 0.00 -0.00 1.92 5.08 -0.62 -2.18 114.58 118.64 2dj5 h GLU 30 Ca 0.10 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.31 2dj5 h GLU 30 Cb 0.29 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2dj5 h GLU 30 CO -0.24 0.05 -0.70 0.66 -1.00 0.00 0.00 179.01 177.78 2dj5 h SER 31 N 0.00 0.03 -0.76 1.42 4.64 -0.45 -3.47 113.55 114.96 2dj5 h SER 31 Ca -0.00 -0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 61.14 2dj5 h SER 31 Cb 0.23 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 62.28 2dj5 h SER 31 CO 0.01 0.72 -0.17 0.61 -0.87 0.00 0.00 176.83 177.13 2dj5 n GLY 32 N 0.48 0.47 0.24 -0.77 0.00 -0.82 -4.89 105.19 99.89 2dj5 n GLY 32 Ca -0.01 -0.63 0.12 0.00 0.00 0.00 0.00 46.02 45.50 2dj5 n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dj5 h ALA 33 N 0.20 1.00 -2.71 4.61 0.00 -1.84 -3.45 119.26 117.07 2dj5 h ALA 33 Ca -0.17 -0.14 -0.34 0.00 0.00 0.00 0.00 54.91 54.27 2dj5 h ALA 33 Cb 0.85 -0.02 -0.18 0.00 0.00 0.00 0.00 17.79 18.44 2dj5 h ALA 33 CO 0.22 0.19 -0.73 -0.06 0.00 0.00 0.00 179.25 178.86 2dj5 s PHE 34 N -3.59 1.14 0.26 0.00 0.08 -1.26 -5.04 117.98 109.56 2dj5 s PHE 34 Ca 0.01 -0.65 0.08 0.00 0.12 0.00 0.00 56.93 56.50 2dj5 s PHE 34 Cb 0.09 -0.61 0.31 0.00 -0.57 0.00 0.00 43.02 42.24 2dj5 s PHE 34 CO 0.62 0.03 1.59 -0.44 -0.10 0.00 0.00 175.22 176.92 2dj5 h ASP 35 N 3.47 0.10 -4.74 1.36 3.45 -1.16 -3.46 116.42 115.44 2dj5 h ASP 35 Ca -0.38 -0.06 -0.10 0.00 0.43 0.00 0.00 57.03 56.93 2dj5 h ASP 35 Cb 1.19 -0.03 -0.21 0.00 -0.56 0.00 0.00 39.33 39.73 2dj5 h ASP 35 CO 0.54 0.70 -0.12 -0.70 -1.57 0.00 0.00 179.24 178.08 2dj5 s GLU 36 N -3.65 0.75 -0.07 3.56 2.12 -1.22 -5.04 118.70 115.16 2dj5 s GLU 36 Ca -0.02 0.13 0.02 0.00 0.36 0.00 0.00 54.97 55.46 2dj5 s GLU 36 Cb 0.12 0.35 0.02 0.00 0.26 0.00 0.00 34.13 34.88 2dj5 s GLU 36 CO 0.78 -0.20 -0.10 0.08 -0.54 0.00 0.00 175.26 175.28 2dj5 s VAL 37 N -0.92 0.97 0.07 3.70 1.01 -1.26 -2.18 120.40 121.79 2dj5 s VAL 37 Ca -0.10 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 61.56 2dj5 s VAL 37 Cb -0.03 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 2dj5 s VAL 37 CO 0.05 0.32 -0.12 -0.54 0.00 0.00 0.00 175.10 174.82 2dj5 s LYS 38 N 0.86 0.73 0.05 2.72 1.02 -0.76 -5.01 119.74 119.35 2dj5 s LYS 38 Ca -0.11 -0.91 0.02 0.00 0.02 0.00 0.00 55.97 54.98 2dj5 s LYS 38 Cb -0.15 -0.63 -0.04 0.00 -0.52 0.00 0.00 37.83 36.49 2dj5 s LYS 38 CO 0.01 0.13 0.06 0.96 -0.92 0.00 0.00 175.35 175.60 2dj5 s ILE 39 N -1.42 4.50 0.23 2.17 -4.36 -1.26 -0.60 121.20 120.45 2dj5 s ILE 39 Ca -0.04 -0.67 0.01 0.00 -0.26 0.00 0.00 60.65 59.69 2dj5 s ILE 39 Cb -0.09 -3.12 -0.00 0.00 1.25 0.00 0.00 42.46 40.50 2dj5 s ILE 39 CO 0.01 0.21 0.29 0.00 0.24 0.00 0.00 174.94 175.70 2dj5 n ALA 40 N 0.77 -0.02 -3.13 2.27 0.00 -0.78 -4.68 120.51 114.94 2dj5 n ALA 40 Ca -0.11 -1.15 -0.14 0.00 0.00 0.00 0.00 53.44 52.04 2dj5 n ALA 40 Cb 0.52 0.93 -0.15 0.00 0.00 0.00 0.00 19.45 20.75 2dj5 n ALA 40 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2dj5 s PHE 41 N -3.40 0.18 0.00 0.00 0.08 -0.58 -2.19 117.98 112.07 2dj5 s PHE 41 Ca 0.22 -0.00 0.00 0.00 0.12 0.00 0.00 56.93 57.26 2dj5 s PHE 41 Cb -0.00 -0.18 0.00 0.00 -0.57 0.00 0.00 43.02 42.27 2dj5 s PHE 41 CO 0.15 -0.04 0.00 0.00 -0.10 0.00 0.00 175.22 175.23 2dj5 n ALA 42 N 3.40 0.00 0.00 5.36 0.00 -0.95 -4.04 120.51 124.28 2dj5 n ALA 42 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2dj5 n ALA 42 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 2dj5 n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dj5 n ALA 43 N -3.00 0.00 -0.46 0.00 0.00 -1.26 -4.57 120.51 111.22 2dj5 n ALA 43 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 2dj5 n ALA 43 Cb 0.00 0.00 0.26 0.00 0.00 0.00 0.00 19.45 19.71 2dj5 n ALA 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2dj5 n ARG 44 N 0.00 -2.85 -3.47 0.00 5.12 -1.26 -4.95 116.66 109.25 2dj5 n ARG 44 Ca 0.00 -0.81 -0.42 0.00 -1.93 0.00 0.00 57.85 54.68 2dj5 n ARG 44 Cb 0.00 -2.03 -0.10 0.00 -1.16 0.00 0.00 32.46 29.17 2dj5 n ARG 44 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2dj5 s LYS 45 N -4.30 3.07 0.21 5.56 2.36 -1.26 -5.00 119.74 120.38 2dj5 s LYS 45 Ca 0.66 -0.94 -0.11 0.00 -2.55 0.00 0.00 55.97 53.02 2dj5 s LYS 45 Cb -0.21 -3.95 -0.00 0.00 -1.05 0.00 0.00 37.83 32.62 2dj5 s LYS 45 CO 0.64 -0.69 0.40 1.03 1.55 0.00 0.00 175.35 178.27 2dj5 s ARG 46 N 1.70 1.38 0.05 4.03 0.52 -1.26 -5.15 118.95 120.23 2dj5 s ARG 46 Ca 0.05 -1.21 0.08 0.00 -0.52 0.00 0.00 55.73 54.14 2dj5 s ARG 46 Cb -0.19 0.43 -0.03 0.00 0.52 0.00 0.00 34.95 35.69 2dj5 s ARG 46 CO 0.10 -0.55 -0.23 1.03 0.02 0.00 0.00 175.30 175.67 2dj5 s ARG 47 N -4.00 1.52 0.08 3.54 1.81 -1.26 -3.31 118.95 117.34 2dj5 s ARG 47 Ca 0.20 -1.04 -0.30 0.00 -1.72 0.00 0.00 55.73 52.87 2dj5 s ARG 47 Cb 0.01 -1.69 -0.05 0.00 -0.45 0.00 0.00 34.95 32.77 2dj5 s ARG 47 CO 0.05 0.43 0.97 -1.25 -0.68 0.00 0.00 175.30 174.82 2dj5 s PRO 48 N -1.30 4.66 0.88 3.54 0.05 -1.26 -4.91 135.00 136.65 2dj5 s PRO 48 Ca 0.09 1.44 -0.11 0.00 0.05 0.00 0.00 61.00 62.47 2dj5 s PRO 48 Cb -0.09 -3.40 0.12 0.00 0.05 0.00 0.00 34.50 31.18 2dj5 s PRO 48 CO 0.02 0.15 1.09 -1.64 0.05 0.00 0.00 177.00 176.67 2dj5 s MET 49 N 0.25 1.40 0.49 4.56 -1.94 -1.21 -1.52 119.30 121.33 2dj5 s MET 49 Ca 0.48 0.98 0.26 0.00 -1.71 0.00 0.00 55.69 55.70 2dj5 s MET 49 Cb -0.23 -1.81 1.22 0.00 2.01 0.00 0.00 34.83 36.02 2dj5 s MET 49 CO 0.29 -2.19 1.97 -1.35 -0.01 0.00 0.00 175.02 173.73 2dj5 h PRO 50 N -1.52 0.00 -0.49 2.03 0.11 -1.89 -2.63 132.00 127.60 2dj5 h PRO 50 Ca -0.48 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.53 2dj5 h PRO 50 Cb 1.27 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 2dj5 h PRO 50 CO 0.52 0.17 -0.09 0.38 -0.21 0.00 0.00 178.00 178.77 2dj5 h ASP 51 N 0.00 0.89 0.08 -2.05 2.03 -1.93 -2.11 116.42 113.34 2dj5 h ASP 51 Ca -0.00 -0.27 -0.00 0.00 -0.73 0.00 0.00 57.03 56.02 2dj5 h ASP 51 Cb 0.51 -0.24 0.00 0.00 -0.83 0.00 0.00 39.33 38.77 2dj5 h ASP 51 CO 0.02 1.01 -0.04 -0.33 -1.03 0.00 0.00 179.24 178.87 2dj5 h GLU 52 N 0.81 -0.10 -0.64 4.15 5.08 -1.85 -2.36 114.58 119.67 2dj5 h GLU 52 Ca 0.13 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2dj5 h GLU 52 Cb 0.61 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.86 2dj5 h GLU 52 CO 0.04 0.00 0.42 0.00 -1.00 0.00 0.00 179.01 178.47 2dj5 h ALA 53 N 0.74 0.81 0.07 3.43 0.00 -1.35 -2.31 119.26 120.63 2dj5 h ALA 53 Ca -0.01 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2dj5 h ALA 53 Cb 0.15 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2dj5 h ALA 53 CO 0.02 0.24 -0.03 0.82 0.00 0.00 0.00 179.25 180.29 2dj5 h ILE 54 N 0.86 0.93 -0.68 0.00 2.04 -1.44 -3.13 117.51 116.09 2dj5 h ILE 54 Ca 0.23 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.24 2dj5 h ILE 54 Cb -0.10 0.93 -0.11 0.00 -0.74 0.00 0.00 36.82 36.80 2dj5 h ILE 54 CO -0.05 0.00 0.08 -0.09 0.00 0.00 0.00 178.15 178.09 2dj5 h ARG 55 N -0.09 0.17 0.00 2.37 2.43 -0.89 -0.96 114.38 117.41 2dj5 h ARG 55 Ca -0.01 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2dj5 h ARG 55 Cb 0.07 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 2dj5 h ARG 55 CO 0.01 0.12 0.00 0.39 -1.51 0.00 0.00 179.97 178.98 2dj5 n GLU 56 N -5.23 0.30 -3.60 0.20 1.02 -0.96 -4.77 120.64 107.59 2dj5 n GLU 56 Ca 0.12 0.09 -0.37 0.00 -0.02 0.00 0.00 57.16 56.97 2dj5 n GLU 56 Cb 0.41 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.27 2dj5 n GLU 56 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2dj5 s MET 57 N -2.57 4.01 -0.55 3.49 -1.94 -0.37 -5.01 119.30 116.36 2dj5 s MET 57 Ca 0.20 0.12 0.01 0.00 -1.71 0.00 0.00 55.69 54.31 2dj5 s MET 57 Cb 0.14 -3.33 0.52 0.00 2.01 0.00 0.00 34.83 34.17 2dj5 s MET 57 CO 0.32 0.46 1.89 0.09 -0.01 0.00 0.00 175.02 177.78 2dj5 n ASN 58 N 2.83 5.95 -4.91 3.03 4.13 -1.26 -5.00 115.26 120.03 2dj5 n ASN 58 Ca -0.14 -3.74 -0.28 0.00 1.68 0.00 0.00 54.58 52.11 2dj5 n ASN 58 Cb 0.53 -0.86 -0.02 0.00 -1.54 0.00 0.00 39.78 37.88 2dj5 n ASN 58 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2dj5 h ASP 60 N 1.31 -0.35 -4.35 0.00 3.32 -1.54 -3.46 116.42 111.36 2dj5 h ASP 60 Ca -0.48 -0.18 -0.70 0.00 0.02 0.00 0.00 57.03 55.69 2dj5 h ASP 60 Cb 1.20 0.09 -0.27 0.00 0.22 0.00 0.00 39.33 40.57 2dj5 h ASP 60 CO 0.65 0.09 -0.84 -0.51 -1.72 0.00 0.00 179.24 176.90 2dj5 s ILE 61 N -4.01 2.49 -0.12 0.35 2.07 -0.45 -3.06 121.20 118.48 2dj5 s ILE 61 Ca -0.13 -0.96 0.00 0.00 -1.41 0.00 0.00 60.65 58.15 2dj5 s ILE 61 Cb 0.01 -1.92 0.02 0.00 0.13 0.00 0.00 42.46 40.70 2dj5 s ILE 61 CO 0.46 0.57 -0.10 -0.63 -1.91 0.00 0.00 174.94 173.33 2dj5 s ILE 62 N -0.68 1.19 -0.22 2.00 1.01 -0.71 -0.66 121.20 123.13 2dj5 s ILE 62 Ca 0.11 -0.41 -0.19 0.00 0.00 0.00 0.00 60.65 60.17 2dj5 s ILE 62 Cb -0.10 -1.16 -0.03 0.00 0.01 0.00 0.00 42.46 41.18 2dj5 s ILE 62 CO -0.00 0.39 0.54 -0.31 0.00 0.00 0.00 174.94 175.56 2dj5 s TYR 63 N 1.52 3.34 -0.29 3.97 2.02 -0.70 -0.77 117.35 126.44 2dj5 s TYR 63 Ca 0.02 0.76 -0.10 0.00 -0.37 0.00 0.00 57.07 57.39 2dj5 s TYR 63 Cb -0.13 -2.71 -0.02 0.00 -0.40 0.00 0.00 41.96 38.70 2dj5 s TYR 63 CO -0.07 -0.16 0.14 0.08 -1.57 0.00 0.00 175.55 173.97 2dj5 s VAL 64 N 1.87 4.72 -0.29 0.71 1.01 0.18 -0.76 120.40 127.83 2dj5 s VAL 64 Ca 0.24 -0.22 -0.05 0.00 0.00 0.00 0.00 61.98 61.95 2dj5 s VAL 64 Cb -0.15 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 32.92 2dj5 s VAL 64 CO 0.09 0.17 0.04 -0.69 0.00 0.00 0.00 175.10 174.71 2dj5 s VAL 65 N 1.65 3.56 -0.44 2.92 1.01 0.26 -0.44 120.40 128.92 2dj5 s VAL 65 Ca 0.06 -0.93 -0.29 0.00 0.00 0.00 0.00 61.98 60.82 2dj5 s VAL 65 Cb -0.16 -2.88 0.01 0.00 0.00 0.00 0.00 36.38 33.35 2dj5 s VAL 65 CO 0.07 0.04 1.40 -2.84 0.00 0.00 0.00 175.10 173.77 2dj5 s PRO 66 N 1.41 3.54 -0.89 2.72 0.02 -1.26 -0.30 135.00 140.24 2dj5 s PRO 66 Ca 0.00 0.84 -0.21 0.00 0.02 0.00 0.00 61.00 61.66 2dj5 s PRO 66 Cb -0.18 -4.03 -0.12 0.00 0.02 0.00 0.00 34.50 30.19 2dj5 s PRO 66 CO 0.00 -1.61 1.97 -0.11 -0.33 0.00 0.00 177.00 176.92 2dj5 n LEU 67 N 8.89 4.50 -4.04 -5.54 7.94 0.20 -3.18 117.00 125.77 2dj5 n LEU 67 Ca 0.16 -3.10 -0.11 0.00 -1.11 0.00 0.00 56.01 51.85 2dj5 n LEU 67 Cb 0.48 -1.22 -0.11 0.00 0.53 0.00 0.00 43.42 43.10 2dj5 n LEU 67 CO 0.71 -0.17 -0.38 -0.36 -1.11 0.00 0.00 177.39 176.07 2dj5 s PHE 68 N 4.88 0.51 -0.01 1.96 0.08 -1.26 -4.71 117.98 119.43 2dj5 s PHE 68 Ca 0.56 -0.57 -0.12 0.00 0.12 0.00 0.00 56.93 56.92 2dj5 s PHE 68 Cb 0.14 -0.32 -0.33 0.00 -0.57 0.00 0.00 43.02 41.94 2dj5 s PHE 68 CO 0.09 -0.15 0.83 0.82 -0.10 0.00 0.00 175.22 176.71 2dj5 h ILE 69 N 4.40 1.11 -2.35 0.64 1.08 -1.95 -1.90 117.51 118.55 2dj5 h ILE 69 Ca -0.34 -2.63 -0.59 0.00 -0.39 0.00 0.00 64.86 60.91 2dj5 h ILE 69 Cb 1.20 2.88 -0.14 0.00 -3.07 0.00 0.00 36.82 37.69 2dj5 h ILE 69 CO 0.43 0.84 -0.76 -0.94 -0.69 0.00 0.00 178.15 177.03 2dj5 s SER 70 N -7.39 3.44 -1.12 1.72 1.04 -1.26 -3.86 113.70 106.27 2dj5 s SER 70 Ca -0.12 -1.02 -0.12 0.00 0.48 0.00 0.00 55.95 55.16 2dj5 s SER 70 Cb 0.05 -0.27 -0.07 0.00 0.10 0.00 0.00 66.02 65.82 2dj5 s SER 70 CO 0.89 0.01 2.26 -1.22 0.98 0.00 0.00 173.24 176.16 2dj5 n TYR 71 N -0.55 2.11 -2.43 5.02 4.01 -1.26 -4.82 117.16 119.25 2dj5 n TYR 71 Ca -0.06 -2.34 -0.28 0.00 -0.16 0.00 0.00 57.90 55.06 2dj5 n TYR 71 Cb 0.60 -2.01 0.00 0.00 -0.31 0.00 0.00 39.34 37.62 2dj5 n TYR 71 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2dj5 s GLY 72 N 3.54 1.54 0.40 2.72 0.00 -1.26 -4.74 107.32 109.53 2dj5 s GLY 72 Ca 0.52 -0.42 0.30 0.00 0.00 0.00 0.00 44.72 45.12 2dj5 s GLY 72 CO -0.01 -0.22 1.40 1.04 0.00 0.00 0.00 173.10 175.32 2dj5 n LEU 73 N -2.41 0.18 -0.28 0.66 4.77 -1.26 0.15 117.00 118.80 2dj5 n LEU 73 Ca 0.02 1.22 0.07 0.00 -0.03 0.00 0.00 56.01 57.29 2dj5 n LEU 73 Cb 0.55 -0.60 0.22 0.00 -2.33 0.00 0.00 43.42 41.26 2dj5 n LEU 73 CO 0.54 -1.32 1.07 0.45 -1.33 0.00 0.00 177.39 176.80 2dj5 h HIS 74 N 0.00 0.68 0.13 -1.77 3.86 -1.94 0.70 115.15 116.80 2dj5 h HIS 74 Ca 0.79 0.04 -0.36 0.00 -1.16 0.00 0.00 60.37 59.68 2dj5 h HIS 74 Cb 2.61 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 30.88 2dj5 h HIS 74 CO -0.01 0.13 -1.98 0.28 0.86 0.00 0.00 177.93 177.22 2dj5 n VAL 75 N -4.92 1.79 0.66 2.45 0.31 0.39 -1.08 118.33 117.92 2dj5 n VAL 75 Ca 0.16 -0.66 0.12 0.00 -0.01 0.00 0.00 64.34 63.95 2dj5 n VAL 75 Cb 0.44 -1.73 0.20 0.00 -0.91 0.00 0.00 33.84 31.84 2dj5 n VAL 75 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2dj5 n THR 76 N -3.48 0.28 0.00 2.52 -2.24 -1.02 -4.43 114.28 105.91 2dj5 n THR 76 Ca -0.31 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 2dj5 n THR 76 Cb 1.05 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.22 2dj5 n THR 76 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2dj5 n GLU 77 N -1.98 0.00 -0.26 -0.78 2.13 0.23 -1.48 120.64 118.51 2dj5 n GLU 77 Ca 0.04 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.75 2dj5 n GLU 77 Cb 0.42 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 32.05 2dj5 n GLU 77 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 2dj5 h ASP 78 N 0.00 -1.88 0.39 4.31 3.32 -1.33 -0.95 116.42 120.29 2dj5 h ASP 78 Ca 0.00 0.28 -0.01 0.00 0.02 0.00 0.00 57.03 57.31 2dj5 h ASP 78 Cb 0.00 0.81 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 2dj5 h ASP 78 CO 0.00 -0.33 -0.25 0.25 -1.72 0.00 0.00 179.24 177.20 2dj5 h LEU 79 N -0.22 -0.62 -1.90 1.55 5.85 -1.34 -0.33 115.31 118.31 2dj5 h LEU 79 Ca 0.14 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.92 2dj5 h LEU 79 Cb 0.53 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 2dj5 h LEU 79 CO -0.75 -0.39 0.12 1.55 -0.34 0.00 0.00 178.44 178.63 2dj5 h PRO 80 N -0.61 0.13 -0.34 5.25 0.13 -1.75 -2.51 132.00 132.30 2dj5 h PRO 80 Ca -0.04 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2dj5 h PRO 80 Cb 0.51 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.59 2dj5 h PRO 80 CO 0.04 0.09 0.22 -0.44 -0.23 0.00 0.00 178.00 177.67 2dj5 h ASP 81 N 0.13 0.40 0.00 1.44 3.32 -0.38 0.80 116.42 122.13 2dj5 h ASP 81 Ca 0.07 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2dj5 h ASP 81 Cb 0.13 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2dj5 h ASP 81 CO -0.01 0.31 0.00 0.18 -1.72 0.00 0.00 179.24 178.00 2dj5 n LEU 82 N -4.83 0.00 0.00 1.55 4.32 -0.21 -2.03 117.00 115.80 2dj5 n LEU 82 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.98 2dj5 n LEU 82 Cb 0.04 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.84 2dj5 n LEU 82 CO 0.35 0.00 0.01 0.18 -1.22 0.00 0.00 177.39 176.70 2dj5 n LEU 83 N -0.85 0.01 -2.12 2.23 4.77 -1.02 -4.35 117.00 115.67 2dj5 n LEU 83 Ca 0.05 -0.01 -0.13 0.00 -0.03 0.00 0.00 56.01 55.89 2dj5 n LEU 83 Cb 0.02 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.15 2dj5 n LEU 83 CO 0.04 0.00 0.09 0.61 -1.33 0.00 0.00 177.39 176.80 2dj5 n GLY 84 N -0.00 0.05 3.84 -0.72 0.00 0.06 -4.92 105.19 103.49 2dj5 n GLY 84 Ca 0.00 -0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 2dj5 n GLY 84 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dj5 s PHE 85 N -3.08 3.32 0.45 1.61 0.40 0.26 -5.01 117.98 115.94 2dj5 s PHE 85 Ca 0.28 0.14 -0.24 0.00 -0.60 0.00 0.00 56.93 56.51 2dj5 s PHE 85 Cb -0.12 -1.67 -0.09 0.00 0.51 0.00 0.00 43.02 41.65 2dj5 s PHE 85 CO 0.34 0.55 1.25 -0.35 0.70 0.00 0.00 175.22 177.71 2dj5 n PRO 86 N 0.36 1.80 -1.70 0.24 -0.04 -1.26 -4.18 135.00 130.22 2dj5 n PRO 86 Ca -0.07 0.65 -0.30 0.00 -0.04 0.00 0.00 63.50 63.73 2dj5 n PRO 86 Cb 0.51 -2.39 0.07 0.00 -0.04 0.00 0.00 33.50 31.66 2dj5 n PRO 86 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dj5 s ARG 87 N -2.34 2.41 0.00 0.54 0.52 -1.26 -4.81 118.95 114.01 2dj5 s ARG 87 Ca 0.64 0.56 0.00 0.00 -0.52 0.00 0.00 55.73 56.40 2dj5 s ARG 87 Cb -0.49 -1.96 0.00 0.00 0.52 0.00 0.00 34.95 33.02 2dj5 s ARG 87 CO 0.56 -1.37 0.00 0.41 0.02 0.00 0.00 175.30 174.92 2dj5 n GLY 88 N -2.50 0.15 3.86 -3.53 0.00 -0.55 -5.05 105.19 97.58 2dj5 n GLY 88 Ca 0.07 -2.30 -0.31 0.00 0.00 0.00 0.00 46.02 43.48 2dj5 n GLY 88 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dj5 s ARG 89 N -0.12 3.86 0.00 1.61 1.81 -1.26 -4.44 118.95 120.40 2dj5 s ARG 89 Ca 0.00 0.56 0.00 0.00 -1.72 0.00 0.00 55.73 54.57 2dj5 s ARG 89 Cb 0.00 -2.39 0.00 0.00 -0.45 0.00 0.00 34.95 32.11 2dj5 s ARG 89 CO 0.00 0.01 0.00 0.41 -0.68 0.00 0.00 175.30 175.04 2dj5 n GLY 90 N -1.03 1.77 3.76 -3.53 0.00 -1.26 -4.97 105.19 99.92 2dj5 n GLY 90 Ca 0.03 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.62 2dj5 n GLY 90 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dj5 s ILE 91 N -2.19 2.16 -0.13 -0.61 1.01 -1.26 -4.71 121.20 115.47 2dj5 s ILE 91 Ca 0.00 0.14 -0.02 0.00 0.00 0.00 0.00 60.65 60.78 2dj5 s ILE 91 Cb 0.00 -3.09 0.04 0.00 0.01 0.00 0.00 42.46 39.42 2dj5 s ILE 91 CO 0.00 0.03 -0.00 -0.54 0.00 0.00 0.00 174.94 174.43 2dj5 s LYS 92 N -0.89 0.80 -0.05 2.79 1.02 -0.52 -5.01 119.74 117.88 2dj5 s LYS 92 Ca 0.60 -0.17 0.06 0.00 0.02 0.00 0.00 55.97 56.48 2dj5 s LYS 92 Cb -0.46 -1.52 -0.02 0.00 -0.52 0.00 0.00 37.83 35.31 2dj5 s LYS 92 CO 0.51 -0.43 -0.23 -1.83 -0.92 0.00 0.00 175.35 172.46 2dj5 s GLU 93 N 1.87 2.51 0.00 1.68 -1.05 -1.26 0.79 118.70 123.24 2dj5 s GLU 93 Ca 0.03 -0.86 0.00 0.00 -0.15 0.00 0.00 54.97 53.98 2dj5 s GLU 93 Cb -0.14 -2.20 0.00 0.00 -0.44 0.00 0.00 34.13 31.34 2dj5 s GLU 93 CO -0.07 0.45 0.00 0.41 0.95 0.00 0.00 175.26 177.00 2dj5 n GLY 94 N 2.78 3.26 3.04 -3.83 0.00 -0.57 -5.02 105.19 104.85 2dj5 n GLY 94 Ca -0.17 -0.41 -0.18 0.00 0.00 0.00 0.00 46.02 45.27 2dj5 n GLY 94 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dj5 s GLU 95 N 2.39 0.69 -0.15 1.61 2.02 -1.26 -1.19 118.70 122.81 2dj5 s GLU 95 Ca 0.00 -0.43 -0.00 0.00 0.02 0.00 0.00 54.97 54.56 2dj5 s GLU 95 Cb 0.00 -0.65 0.03 0.00 0.10 0.00 0.00 34.13 33.62 2dj5 s GLU 95 CO 0.00 0.17 -0.09 0.12 0.02 0.00 0.00 175.26 175.47 2dj5 s PHE 96 N -0.46 1.89 -1.34 1.61 5.36 -0.06 -4.80 117.98 120.17 2dj5 s PHE 96 Ca 0.01 -1.10 -0.12 0.00 -0.96 0.00 0.00 56.93 54.77 2dj5 s PHE 96 Cb -0.05 -1.43 0.01 0.00 -0.34 0.00 0.00 43.02 41.21 2dj5 s PHE 96 CO 0.00 -0.62 0.46 0.39 -1.46 0.00 0.00 175.22 173.99 2dj5 n GLU 97 N 4.83 -1.71 -1.19 10.12 1.02 -1.26 -1.07 120.64 131.38 2dj5 n GLU 97 Ca -0.14 0.28 -0.07 0.00 -0.02 0.00 0.00 57.16 57.21 2dj5 n GLU 97 Cb 0.49 -3.82 -0.03 0.00 -0.02 0.00 0.00 31.44 28.06 2dj5 n GLU 97 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dj5 n GLY 98 N -2.08 0.72 3.69 0.62 0.00 -1.26 -5.00 105.19 101.88 2dj5 n GLY 98 Ca -0.23 -0.10 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 2dj5 n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dj5 s LYS 99 N -2.28 2.54 -0.06 1.61 1.02 -0.23 -5.11 119.74 117.24 2dj5 s LYS 99 Ca 0.00 -0.88 -0.27 0.00 0.02 0.00 0.00 55.97 54.85 2dj5 s LYS 99 Cb 0.00 -2.52 -0.03 0.00 -0.52 0.00 0.00 37.83 34.76 2dj5 s LYS 99 CO 0.00 0.53 0.85 0.21 -0.92 0.00 0.00 175.35 176.02 2dj5 s LYS 100 N -2.43 4.47 0.00 1.68 2.20 -1.17 -0.88 119.74 123.60 2dj5 s LYS 100 Ca 0.26 1.16 0.07 0.00 -0.36 0.00 0.00 55.97 57.10 2dj5 s LYS 100 Cb -0.11 -3.48 -0.02 0.00 -1.51 0.00 0.00 37.83 32.71 2dj5 s LYS 100 CO 0.19 -0.07 -0.22 0.08 -0.36 0.00 0.00 175.35 174.97 2dj5 s VAL 101 N 1.17 1.77 -0.16 4.02 1.01 -0.33 -1.75 120.40 126.13 2dj5 s VAL 101 Ca 0.44 -1.05 0.00 0.00 0.00 0.00 0.00 61.98 61.37 2dj5 s VAL 101 Cb -0.19 -1.49 0.03 0.00 0.00 0.00 0.00 36.38 34.73 2dj5 s VAL 101 CO 0.21 0.41 -0.13 -0.69 0.00 0.00 0.00 175.10 174.91 2dj5 s VAL 102 N -0.62 1.55 -0.36 2.92 1.01 0.05 -1.51 120.40 123.45 2dj5 s VAL 102 Ca 0.09 -0.72 -0.24 0.00 0.00 0.00 0.00 61.98 61.11 2dj5 s VAL 102 Cb -0.09 -1.51 0.01 0.00 0.00 0.00 0.00 36.38 34.79 2dj5 s VAL 102 CO 0.00 0.37 0.80 -0.63 0.00 0.00 0.00 175.10 175.64 2dj5 s ILE 103 N 1.48 4.72 0.82 2.22 1.01 0.24 0.50 121.20 132.19 2dj5 s ILE 103 Ca 0.03 0.97 -0.11 0.00 0.00 0.00 0.00 60.65 61.55 2dj5 s ILE 103 Cb -0.14 -4.22 0.12 0.00 0.01 0.00 0.00 42.46 38.23 2dj5 s ILE 103 CO -0.10 -0.42 1.16 0.00 0.00 0.00 0.00 174.94 175.58 2dj5 s GLU 105 N -5.54 3.67 0.74 0.00 2.02 -1.26 -4.57 118.70 113.76 2dj5 s GLU 105 Ca 0.66 1.07 -0.14 0.00 0.02 0.00 0.00 54.97 56.57 2dj5 s GLU 105 Cb -0.08 -2.09 0.05 0.00 0.10 0.00 0.00 34.13 32.11 2dj5 s GLU 105 CO 0.49 -0.51 1.17 -1.25 0.02 0.00 0.00 175.26 175.18 2dj5 s PRO 106 N -4.08 2.12 0.42 0.39 0.04 -1.26 -4.47 135.00 128.16 2dj5 s PRO 106 Ca 0.61 1.62 0.18 0.00 0.04 0.00 0.00 61.00 63.45 2dj5 s PRO 106 Cb -0.13 -1.85 0.92 0.00 0.04 0.00 0.00 34.50 33.49 2dj5 s PRO 106 CO 0.34 -1.82 1.89 -0.84 0.04 0.00 0.00 177.00 176.61 2dj5 h ILE 107 N -0.50 1.01 -0.64 0.56 3.07 -1.46 -3.40 117.51 116.15 2dj5 h ILE 107 Ca -0.47 -1.07 0.11 0.00 1.55 0.00 0.00 64.86 64.98 2dj5 h ILE 107 Cb 1.28 1.61 -0.11 0.00 -0.27 0.00 0.00 36.82 39.33 2dj5 h ILE 107 CO 0.50 0.29 -0.23 0.61 -1.05 0.00 0.00 178.15 178.26 2dj5 n GLY 108 N -0.44 -1.25 0.00 0.16 0.00 -0.73 -0.83 105.19 102.08 2dj5 n GLY 108 Ca -0.02 0.71 0.13 0.00 0.00 0.00 0.00 46.02 46.84 2dj5 n GLY 108 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dj5 n GLU 109 N -4.97 0.82 -2.68 1.61 1.02 -1.26 -4.78 120.64 110.41 2dj5 n GLU 109 Ca 0.07 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.84 2dj5 n GLU 109 Cb 0.27 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.14 2dj5 n GLU 109 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2dj5 s ASP 110 N -2.00 7.19 0.37 1.62 2.15 -0.01 -4.92 116.67 121.06 2dj5 s ASP 110 Ca 0.39 1.94 0.11 0.00 0.43 0.00 0.00 52.55 55.43 2dj5 s ASP 110 Cb 0.18 -2.59 0.88 0.00 -0.30 0.00 0.00 42.92 41.10 2dj5 s ASP 110 CO 0.31 -0.18 1.86 1.88 -0.17 0.00 0.00 175.17 178.86 2dj5 h TYR 111 N 3.10 0.77 -0.83 -5.34 0.05 -1.90 -0.27 116.97 112.56 2dj5 h TYR 111 Ca -0.47 0.02 0.08 0.00 0.05 0.00 0.00 58.73 58.41 2dj5 h TYR 111 Cb 1.20 -0.24 -0.05 0.00 1.01 0.00 0.00 36.73 38.65 2dj5 h TYR 111 CO 0.60 0.25 0.54 0.74 -1.05 0.00 0.00 178.16 179.24 2dj5 h PHE 112 N 0.62 0.89 -0.25 4.88 0.04 -1.93 0.13 116.94 121.32 2dj5 h PHE 112 Ca 0.46 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 61.25 2dj5 h PHE 112 Cb 0.85 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 38.70 2dj5 h PHE 112 CO -0.00 0.45 0.14 0.28 -0.60 0.00 0.00 178.31 178.58 2dj5 h VAL 113 N 0.86 1.11 -0.33 -0.55 2.07 -1.34 0.22 116.25 118.29 2dj5 h VAL 113 Ca 0.37 -0.28 0.07 0.00 0.82 0.00 0.00 66.70 67.68 2dj5 h VAL 113 Cb 0.30 0.85 -0.08 0.00 -1.52 0.00 0.00 31.29 30.84 2dj5 h VAL 113 CO -0.14 0.11 -0.29 0.74 0.02 0.00 0.00 177.57 178.01 2dj5 h THR 114 N 0.29 0.29 -0.07 2.57 2.02 -1.05 -1.33 112.91 115.63 2dj5 h THR 114 Ca 0.09 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.24 2dj5 h THR 114 Cb 0.05 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 66.74 2dj5 h THR 114 CO -0.01 0.00 -0.10 1.88 0.37 0.00 0.00 175.52 177.66 2dj5 h TYR 115 N -0.26 0.10 -0.74 3.16 0.05 -0.48 -2.20 116.97 116.60 2dj5 h TYR 115 Ca 0.16 -0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.95 2dj5 h TYR 115 Cb 0.51 -0.03 -0.04 0.00 1.01 0.00 0.00 36.73 38.18 2dj5 h TYR 115 CO -0.48 0.21 0.48 0.00 -1.05 0.00 0.00 178.16 177.32 2dj5 h ALA 116 N 1.80 0.96 0.68 3.88 0.00 0.51 0.33 119.26 127.41 2dj5 h ALA 116 Ca 0.02 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2dj5 h ALA 116 Cb 0.25 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2dj5 h ALA 116 CO 0.01 0.32 -0.40 0.82 0.00 0.00 0.00 179.25 180.01 2dj5 h ILE 117 N 0.97 0.00 -0.74 0.00 2.04 -0.76 -1.66 117.51 117.36 2dj5 h ILE 117 Ca 0.28 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.30 2dj5 h ILE 117 Cb -0.06 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 35.91 2dj5 h ILE 117 CO -0.08 0.00 0.18 -0.07 0.00 0.00 0.00 178.15 178.18 2dj5 h LEU 118 N -1.00 0.01 -1.77 1.44 3.38 -1.29 0.14 115.31 116.23 2dj5 h LEU 118 Ca -0.09 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2dj5 h LEU 118 Cb 0.79 0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.74 2dj5 h LEU 118 CO 0.11 -0.04 0.00 -1.13 0.09 0.00 0.00 178.44 177.47 2dj5 h ASN 119 N 0.27 0.00 -0.58 -0.43 -1.24 -0.23 0.14 115.58 113.51 2dj5 h ASN 119 Ca 0.42 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 57.37 2dj5 h ASN 119 Cb 0.71 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.74 2dj5 h ASN 119 CO -0.51 0.00 0.14 -1.28 -1.29 0.00 0.00 177.43 174.49 2dj5 h SER 120 N 0.00 0.92 0.32 1.15 0.87 0.03 1.78 113.55 118.62 2dj5 h SER 120 Ca 0.00 -0.18 -0.02 0.00 -1.23 0.00 0.00 61.79 60.36 2dj5 h SER 120 Cb 0.38 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.10 2dj5 h SER 120 CO 0.00 0.89 -0.16 0.58 -0.53 0.00 0.00 176.83 177.62 2dj5 h VAL 121 N 0.93 0.18 -0.27 2.23 2.07 -1.23 -3.39 116.25 116.78 2dj5 h VAL 121 Ca 0.20 -0.74 -0.09 0.00 0.82 0.00 0.00 66.70 66.88 2dj5 h VAL 121 Cb 0.35 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2dj5 h VAL 121 CO 0.00 0.05 -0.21 -0.26 0.02 0.00 0.00 177.57 177.17 2dj5 h PHE 122 N -1.07 0.55 -5.80 1.57 0.04 -0.66 -3.47 116.94 108.09 2dj5 h PHE 122 Ca -0.04 -0.11 -0.44 0.00 2.80 0.00 0.00 57.97 60.18 2dj5 h PHE 122 Cb 0.41 -0.14 -0.06 0.00 2.20 0.00 0.00 35.95 38.36 2dj5 h PHE 122 CO 0.02 0.68 -0.67 0.54 -0.60 0.00 0.00 178.31 178.28 2dj5 n ARG 123 N -4.14 -4.38 -1.70 1.51 1.74 0.61 -4.92 116.66 105.37 2dj5 n ARG 123 Ca -0.00 0.56 -0.43 0.00 -0.77 0.00 0.00 57.85 57.21 2dj5 n ARG 123 Cb 0.38 -5.36 -0.03 0.00 -1.02 0.00 0.00 32.46 26.43 2dj5 n ARG 123 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2dj5 n ILE 124 N -4.34 0.27 -0.59 0.55 2.08 -1.26 -5.08 119.36 110.99 2dj5 n ILE 124 Ca 0.01 -0.07 0.00 0.00 0.56 0.00 0.00 62.75 63.25 2dj5 n ILE 124 Cb 0.54 -1.80 0.00 0.00 -0.75 0.00 0.00 39.64 37.62 2dj5 n ILE 124 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72