#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dk5 s HIS 6 N 0.00 3.23 1.13 -1.40 -0.00 -1.26 -4.92 115.29 112.07 1dk5 s HIS 6 Ca 0.00 -2.07 -0.17 0.00 -0.00 0.00 0.00 55.06 52.82 1dk5 s HIS 6 Cb 0.00 -2.00 0.25 0.00 -0.00 0.00 0.00 32.58 30.83 1dk5 s HIS 6 CO 0.00 -0.84 1.11 -1.58 -0.00 0.00 0.00 174.74 173.43 1dk5 s HIS 7 N 1.18 1.06 0.55 0.38 5.65 -1.26 -4.88 115.29 117.97 1dk5 s HIS 7 Ca -0.06 0.64 0.24 0.00 0.25 0.00 0.00 55.06 56.14 1dk5 s HIS 7 Cb -0.19 -3.41 1.46 0.00 -1.18 0.00 0.00 32.58 29.26 1dk5 s HIS 7 CO -0.04 -3.52 2.07 1.25 -0.65 0.00 0.00 174.74 173.85 1dk5 h HIS 8 N -2.33 0.00 0.02 3.88 -0.00 -2.00 -2.78 115.15 111.94 1dk5 h HIS 8 Ca -0.48 0.00 -0.38 0.00 -0.00 0.00 0.00 60.37 59.51 1dk5 h HIS 8 Cb 1.31 0.00 -0.06 0.00 -0.00 0.00 0.00 27.41 28.65 1dk5 h HIS 8 CO -1.29 0.00 -2.34 -1.33 -0.00 0.00 0.00 177.93 172.97 1dk5 n MET 9 N -4.20 0.67 -0.64 5.26 2.00 -1.26 -4.90 117.12 114.05 1dk5 n MET 9 Ca 0.04 0.14 -0.31 0.00 0.00 0.00 0.00 57.70 57.57 1dk5 n MET 9 Cb 0.38 -1.56 0.18 0.00 0.00 0.00 0.00 33.22 32.21 1dk5 n MET 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1dk5 n ALA 10 N -3.05 -1.29 -0.05 3.04 0.00 -1.05 -1.63 120.51 116.48 1dk5 n ALA 10 Ca -0.39 -0.67 -0.06 0.00 0.00 0.00 0.00 53.44 52.32 1dk5 n ALA 10 Cb 1.04 -2.14 -0.08 0.00 0.00 0.00 0.00 19.45 18.28 1dk5 n ALA 10 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1dk5 n SER 11 N -4.22 2.56 -4.42 0.00 3.41 -0.03 -4.35 113.62 106.58 1dk5 n SER 11 Ca 0.10 -0.01 -0.49 0.00 -0.26 0.00 0.00 58.87 58.21 1dk5 n SER 11 Cb 0.52 0.61 -0.04 0.00 -0.26 0.00 0.00 64.21 65.04 1dk5 n SER 11 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1dk5 n LEU 12 N -2.45 -1.02 -4.04 1.04 7.94 -1.08 -3.75 117.00 113.63 1dk5 n LEU 12 Ca -0.18 1.13 -0.23 0.00 -1.11 0.00 0.00 56.01 55.62 1dk5 n LEU 12 Cb 0.82 -0.95 -0.16 0.00 0.53 0.00 0.00 43.42 43.65 1dk5 n LEU 12 CO 0.20 -2.82 -0.47 0.42 -1.11 0.00 0.00 177.39 173.62 1dk5 s THR 13 N -0.88 1.08 0.27 1.96 -4.23 -1.26 -4.70 115.64 107.88 1dk5 s THR 13 Ca 0.67 -0.50 0.12 0.00 -1.18 0.00 0.00 61.69 60.80 1dk5 s THR 13 Cb -0.97 -0.96 -0.05 0.00 1.34 0.00 0.00 72.50 71.86 1dk5 s THR 13 CO 0.56 0.33 -0.20 0.68 -0.54 0.00 0.00 174.62 175.45 1dk5 s VAL 14 N 0.32 2.44 0.86 2.29 -7.23 -1.26 -4.39 120.40 113.43 1dk5 s VAL 14 Ca -0.07 -2.36 -0.14 0.00 -1.81 0.00 0.00 61.98 57.60 1dk5 s VAL 14 Cb -0.12 -2.27 0.03 0.00 0.56 0.00 0.00 36.38 34.58 1dk5 s VAL 14 CO 0.02 -0.37 0.63 -2.65 -0.31 0.00 0.00 175.10 172.42 1dk5 n PRO 15 N -0.52 -0.04 0.08 4.82 -0.02 -1.26 -4.89 135.00 133.17 1dk5 n PRO 15 Ca -0.06 0.04 -0.11 0.00 -2.02 0.00 0.00 63.50 61.36 1dk5 n PRO 15 Cb 0.60 -1.99 -0.02 0.00 -0.02 0.00 0.00 33.50 32.07 1dk5 n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dk5 h ALA 16 N -1.11 0.47 -3.35 3.55 0.00 -2.00 -3.37 119.26 113.45 1dk5 h ALA 16 Ca -0.45 -0.70 -0.66 0.00 0.00 0.00 0.00 54.91 53.10 1dk5 h ALA 16 Cb 1.30 -0.05 -0.39 0.00 0.00 0.00 0.00 17.79 18.65 1dk5 h ALA 16 CO 0.39 0.86 -0.56 -1.01 0.00 0.00 0.00 179.25 178.93 1dk5 s HIS 17 N -3.27 3.33 0.14 0.00 3.76 -1.26 -5.10 115.29 112.89 1dk5 s HIS 17 Ca -0.04 -3.00 -0.28 0.00 -0.15 0.00 0.00 55.06 51.59 1dk5 s HIS 17 Cb 0.10 -2.96 -0.07 0.00 1.11 0.00 0.00 32.58 30.76 1dk5 s HIS 17 CO 0.84 -0.80 0.89 0.14 -0.85 0.00 0.00 174.74 174.96 1dk5 s VAL 18 N -0.02 4.41 0.90 -0.90 -7.23 -1.26 -5.03 120.40 111.28 1dk5 s VAL 18 Ca 0.16 1.93 -0.11 0.00 -1.81 0.00 0.00 61.98 62.15 1dk5 s VAL 18 Cb -0.23 -4.26 0.11 0.00 0.56 0.00 0.00 36.38 32.56 1dk5 s VAL 18 CO -0.02 0.41 0.97 -2.65 -0.31 0.00 0.00 175.10 173.49 1dk5 n PRO 19 N 2.27 -0.31 -1.77 4.82 -0.02 -1.26 -4.98 135.00 133.75 1dk5 n PRO 19 Ca -0.01 -0.03 -0.29 0.00 -2.02 0.00 0.00 63.50 61.15 1dk5 n PRO 19 Cb 0.49 -2.25 0.11 0.00 -0.02 0.00 0.00 33.50 31.82 1dk5 n PRO 19 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1dk5 s SER 20 N -2.38 4.13 0.11 2.55 1.04 -1.26 -4.81 113.70 113.07 1dk5 s SER 20 Ca 0.66 0.83 -0.24 0.00 0.48 0.00 0.00 55.95 57.68 1dk5 s SER 20 Cb -0.24 -1.35 -0.09 0.00 0.10 0.00 0.00 66.02 64.45 1dk5 s SER 20 CO 0.59 -2.15 1.69 0.00 0.98 0.00 0.00 173.24 174.35 1dk5 h ALA 21 N -1.22 -0.15 -0.46 5.32 0.00 -1.93 -1.09 119.26 119.73 1dk5 h ALA 21 Ca -0.48 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.48 1dk5 h ALA 21 Cb 1.33 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 19.29 1dk5 h ALA 21 CO 0.64 -0.62 0.31 0.00 0.00 0.00 0.00 179.25 179.58 1dk5 h ALA 22 N 0.73 1.87 -0.06 0.00 0.00 -1.93 -2.34 119.26 117.52 1dk5 h ALA 22 Ca 0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1dk5 h ALA 22 Cb 0.25 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1dk5 h ALA 22 CO -0.10 0.07 0.02 0.93 0.00 0.00 0.00 179.25 180.17 1dk5 h GLU 23 N 0.45 0.10 -0.78 0.00 5.08 -1.62 -1.23 114.58 116.58 1dk5 h GLU 23 Ca 0.19 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 1dk5 h GLU 23 Cb 0.20 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 1dk5 h GLU 23 CO -0.05 0.23 0.40 -0.44 -1.00 0.00 0.00 179.01 178.15 1dk5 h ASP 24 N -0.06 0.99 0.45 1.42 3.45 -0.95 -2.82 116.42 118.89 1dk5 h ASP 24 Ca 0.02 -0.10 -0.02 0.00 0.43 0.00 0.00 57.03 57.36 1dk5 h ASP 24 Cb 0.17 -0.25 0.00 0.00 -0.56 0.00 0.00 39.33 38.70 1dk5 h ASP 24 CO -0.00 0.81 -0.22 0.00 -1.57 0.00 0.00 179.24 178.27 1dk5 h GLU 26 N -0.80 -0.07 -0.59 0.00 4.81 -1.21 0.80 114.58 117.52 1dk5 h GLU 26 Ca -0.06 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 1dk5 h GLU 26 Cb 0.55 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 1dk5 h GLU 26 CO 0.10 -0.05 0.28 1.96 -0.73 0.00 0.00 179.01 180.57 1dk5 h GLN 27 N -0.07 0.86 -0.47 1.92 1.08 -1.42 0.11 115.11 117.11 1dk5 h GLN 27 Ca 0.18 -0.13 -0.12 0.00 -1.45 0.00 0.00 58.65 57.12 1dk5 h GLN 27 Cb 0.35 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.61 1dk5 h GLN 27 CO -0.41 0.70 -0.19 1.25 -0.95 0.00 0.00 178.83 179.23 1dk5 h LEU 28 N 0.81 0.99 -0.21 1.46 5.85 0.95 -2.70 115.31 122.45 1dk5 h LEU 28 Ca 0.20 -0.39 0.03 0.00 0.84 0.00 0.00 57.88 58.56 1dk5 h LEU 28 Cb 0.13 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 1dk5 h LEU 28 CO -0.02 1.15 0.04 -0.09 -0.34 0.00 0.00 178.44 179.18 1dk5 h ARG 29 N 0.81 0.12 -0.27 1.25 9.65 0.86 0.44 114.38 127.24 1dk5 h ARG 29 Ca 0.11 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.98 1dk5 h ARG 29 Cb 0.76 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.32 1dk5 h ARG 29 CO 0.06 0.08 0.00 0.43 2.80 0.00 0.00 179.97 183.34 1dk5 n SER 30 N -5.08 0.27 -0.56 -3.80 7.64 0.35 -1.25 113.62 111.19 1dk5 n SER 30 Ca -0.02 -0.98 0.06 0.00 1.01 0.00 0.00 58.87 58.93 1dk5 n SER 30 Cb 0.09 -0.14 0.10 0.00 -1.01 0.00 0.00 64.21 63.26 1dk5 n SER 30 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dk5 n ALA 31 N -0.08 2.33 0.03 -0.43 0.00 0.14 -4.37 120.51 118.13 1dk5 n ALA 31 Ca 0.00 -0.88 0.04 0.00 0.00 0.00 0.00 53.44 52.60 1dk5 n ALA 31 Cb 0.07 -0.42 -0.06 0.00 0.00 0.00 0.00 19.45 19.04 1dk5 n ALA 31 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1dk5 n PHE 32 N 0.59 0.00 -1.70 0.00 3.72 -0.38 -4.24 117.46 115.45 1dk5 n PHE 32 Ca 0.09 0.00 -0.53 0.00 -0.05 0.00 0.00 57.45 56.96 1dk5 n PHE 32 Cb 0.36 -0.17 -0.06 0.00 -0.94 0.00 0.00 39.48 38.67 1dk5 n PHE 32 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1dk5 n LYS 33 N -1.74 1.62 0.00 -1.08 5.02 -1.25 -3.95 118.16 116.78 1dk5 n LYS 33 Ca -0.01 0.59 0.00 0.00 -2.02 0.00 0.00 58.31 56.87 1dk5 n LYS 33 Cb 0.21 -2.35 0.00 0.00 -0.02 0.00 0.00 35.03 32.87 1dk5 n LYS 33 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1dk5 n GLY 34 N 4.28 0.00 0.65 0.72 0.00 -1.26 -3.77 105.19 105.81 1dk5 n GLY 34 Ca 0.25 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.35 1dk5 n GLY 34 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1dk5 n TRP 35 N 0.00 0.06 0.00 1.61 8.01 -1.26 -4.96 117.44 120.90 1dk5 n TRP 35 Ca 0.00 -0.05 0.00 0.00 -1.31 0.00 0.00 57.50 56.14 1dk5 n TRP 35 Cb 0.00 -0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.30 1dk5 n TRP 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1dk5 n GLY 36 N 0.89 0.00 2.59 6.99 0.00 -1.25 -4.61 105.19 109.80 1dk5 n GLY 36 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1dk5 n GLY 36 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1dk5 n THR 37 N 0.00 5.79 -3.67 2.61 -1.04 -1.26 -4.71 114.28 112.00 1dk5 n THR 37 Ca 0.00 -5.41 -0.28 0.00 -2.04 0.00 0.00 64.05 56.32 1dk5 n THR 37 Cb 0.00 -1.71 -0.10 0.00 -1.82 0.00 0.00 70.33 66.70 1dk5 n THR 37 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1dk5 n ASN 38 N 0.51 3.45 0.00 8.00 2.85 -1.26 -4.86 115.26 123.96 1dk5 n ASN 38 Ca 0.52 -3.32 -0.11 0.00 -0.11 0.00 0.00 54.58 51.56 1dk5 n ASN 38 Cb 0.26 -0.74 -0.09 0.00 1.24 0.00 0.00 39.78 40.45 1dk5 n ASN 38 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 1dk5 h GLU 39 N 4.89 -0.10 -1.22 1.20 4.39 -1.91 -3.19 114.58 118.64 1dk5 h GLU 39 Ca 0.17 0.01 0.37 0.00 0.34 0.00 0.00 59.36 60.25 1dk5 h GLU 39 Cb 0.71 0.02 -0.11 0.00 -0.10 0.00 0.00 28.75 29.28 1dk5 h GLU 39 CO 0.79 0.46 0.79 0.87 -1.16 0.00 0.00 179.01 180.76 1dk5 h LYS 40 N -0.82 0.19 0.11 2.33 1.57 -1.97 0.52 116.57 118.49 1dk5 h LYS 40 Ca -0.01 -0.01 -0.28 0.00 -1.87 0.00 0.00 60.65 58.47 1dk5 h LYS 40 Cb 0.61 -0.04 0.02 0.00 0.08 0.00 0.00 32.23 32.89 1dk5 h LYS 40 CO 0.02 0.13 -1.21 1.25 -0.57 0.00 0.00 179.45 179.07 1dk5 h LEU 41 N 0.19 0.74 -0.13 2.94 6.46 -1.97 -0.55 115.31 122.98 1dk5 h LEU 41 Ca 0.72 -0.69 -0.06 0.00 -0.12 0.00 0.00 57.88 57.73 1dk5 h LEU 41 Cb 2.17 -0.23 -0.00 0.00 -0.73 0.00 0.00 40.66 41.87 1dk5 h LEU 41 CO -0.34 1.50 -0.16 0.40 -0.62 0.00 0.00 178.44 179.22 1dk5 h ILE 42 N 0.23 1.36 -0.35 4.05 2.04 -0.56 -2.37 117.51 121.90 1dk5 h ILE 42 Ca -0.16 -1.35 -0.03 0.00 1.00 0.00 0.00 64.86 64.32 1dk5 h ILE 42 Cb 1.88 1.93 -0.02 0.00 -0.74 0.00 0.00 36.82 39.88 1dk5 h ILE 42 CO 0.22 0.39 0.10 0.40 0.00 0.00 0.00 178.15 179.27 1dk5 h ILE 43 N -0.04 1.16 0.00 -0.67 2.04 -0.20 0.33 117.51 120.13 1dk5 h ILE 43 Ca 0.02 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.34 1dk5 h ILE 43 Cb 0.70 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1dk5 h ILE 43 CO 0.04 0.20 0.00 -1.54 0.00 0.00 0.00 178.15 176.85 1dk5 n SER 44 N -4.36 0.40 -0.08 1.72 3.41 -0.22 -2.72 113.62 111.78 1dk5 n SER 44 Ca 0.02 0.54 -0.17 0.00 -0.26 0.00 0.00 58.87 59.00 1dk5 n SER 44 Cb 0.17 -0.65 -0.06 0.00 -0.26 0.00 0.00 64.21 63.42 1dk5 n SER 44 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1dk5 n ILE 45 N -1.88 1.05 -0.16 -1.33 5.41 -0.91 -4.39 119.36 117.15 1dk5 n ILE 45 Ca 0.06 -0.17 -0.11 0.00 1.00 0.00 0.00 62.75 63.53 1dk5 n ILE 45 Cb 0.38 -1.80 -0.00 0.00 -0.71 0.00 0.00 39.64 37.51 1dk5 n ILE 45 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1dk5 h LEU 46 N -0.64 0.98 0.00 1.39 3.38 -1.11 -2.81 115.31 116.50 1dk5 h LEU 46 Ca -0.38 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.21 1dk5 h LEU 46 Cb 1.27 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1dk5 h LEU 46 CO -0.23 1.14 0.00 0.00 0.09 0.00 0.00 178.44 179.44 1dk5 n ALA 47 N -2.50 2.50 -2.53 1.53 0.00 -1.10 -3.14 120.51 115.26 1dk5 n ALA 47 Ca 0.00 -0.12 -0.13 0.00 0.00 0.00 0.00 53.44 53.19 1dk5 n ALA 47 Cb 0.43 -1.30 0.03 0.00 0.00 0.00 0.00 19.45 18.61 1dk5 n ALA 47 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1dk5 n HIS 48 N -0.83 1.99 -3.98 0.00 8.25 -1.06 -4.59 115.22 115.01 1dk5 n HIS 48 Ca 0.14 -2.49 -0.12 0.00 -0.26 0.00 0.00 57.72 54.99 1dk5 n HIS 48 Cb 0.06 -0.27 -0.13 0.00 1.12 0.00 0.00 29.99 30.78 1dk5 n HIS 48 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1dk5 s ARG 49 N -3.55 0.23 0.82 -0.41 1.81 -1.19 -4.29 118.95 112.39 1dk5 s ARG 49 Ca 0.37 -0.32 -0.12 0.00 -1.72 0.00 0.00 55.73 53.94 1dk5 s ARG 49 Cb 0.39 -0.07 0.09 0.00 -0.45 0.00 0.00 34.95 34.91 1dk5 s ARG 49 CO -0.03 0.01 1.17 0.95 -0.68 0.00 0.00 175.30 176.72 1dk5 s THR 50 N -0.66 2.02 0.22 0.02 -4.23 -1.26 -4.84 115.64 106.92 1dk5 s THR 50 Ca -0.06 0.01 -0.05 0.00 -1.18 0.00 0.00 61.69 60.40 1dk5 s THR 50 Cb -0.05 -2.97 0.10 0.00 1.34 0.00 0.00 72.50 70.92 1dk5 s THR 50 CO -0.00 -0.01 1.71 0.00 -0.54 0.00 0.00 174.62 175.78 1dk5 h ALA 51 N -1.12 0.99 0.00 3.99 0.00 -1.96 -1.08 119.26 120.08 1dk5 h ALA 51 Ca -0.47 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.11 1dk5 h ALA 51 Cb 1.33 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1dk5 h ALA 51 CO 0.65 0.63 -0.26 0.00 0.00 0.00 0.00 179.25 180.27 1dk5 h ALA 52 N 1.14 1.03 -0.03 0.00 0.00 -2.00 -1.62 119.26 117.80 1dk5 h ALA 52 Ca 0.17 -0.24 -0.25 0.00 0.00 0.00 0.00 54.91 54.60 1dk5 h ALA 52 Cb 0.47 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.24 1dk5 h ALA 52 CO 0.02 0.33 -0.94 1.96 0.00 0.00 0.00 179.25 180.61 1dk5 h GLN 53 N 0.00 0.69 -0.04 0.00 4.20 -1.84 -2.80 115.11 115.31 1dk5 h GLN 53 Ca -0.00 -0.70 -0.10 0.00 0.06 0.00 0.00 58.65 57.90 1dk5 h GLN 53 Cb 0.76 0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.72 1dk5 h GLN 53 CO 0.03 1.29 -0.44 0.00 -0.67 0.00 0.00 178.83 179.04 1dk5 h ARG 54 N 0.36 0.09 -0.26 1.46 3.08 -0.87 -1.83 114.38 116.41 1dk5 h ARG 54 Ca -0.11 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.85 1dk5 h ARG 54 Cb 1.60 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.64 1dk5 h ARG 54 CO 0.19 0.52 0.00 -0.22 -1.07 0.00 0.00 179.97 179.39 1dk5 h LYS 55 N 0.08 0.46 -0.08 0.04 3.64 -1.24 -0.57 116.57 118.90 1dk5 h LYS 55 Ca 0.00 -0.15 -0.09 0.00 -1.27 0.00 0.00 60.65 59.15 1dk5 h LYS 55 Cb 0.82 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 1dk5 h LYS 55 CO 0.06 0.63 -0.34 1.25 -2.27 0.00 0.00 179.45 178.78 1dk5 h LEU 56 N 0.25 0.16 0.85 5.20 5.85 -1.47 -0.21 115.31 125.94 1dk5 h LEU 56 Ca 0.07 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.70 1dk5 h LEU 56 Cb 0.42 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.41 1dk5 h LEU 56 CO 0.01 0.50 -0.41 0.40 -0.34 0.00 0.00 178.44 178.60 1dk5 h ILE 57 N 0.14 0.00 -1.06 4.05 2.04 -0.99 0.71 117.51 122.40 1dk5 h ILE 57 Ca 0.02 -0.10 0.30 0.00 1.00 0.00 0.00 64.86 66.08 1dk5 h ILE 57 Cb 0.67 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.70 1dk5 h ILE 57 CO 0.05 0.00 0.74 0.03 0.00 0.00 0.00 178.15 178.97 1dk5 h ARG 58 N -1.24 0.11 0.15 2.37 3.08 -0.79 0.48 114.38 118.54 1dk5 h ARG 58 Ca -0.12 -0.01 -0.23 0.00 0.07 0.00 0.00 59.98 59.70 1dk5 h ARG 58 Cb 0.87 -0.02 0.02 0.00 0.08 0.00 0.00 29.97 30.92 1dk5 h ARG 58 CO 0.19 0.07 -1.07 1.96 -1.07 0.00 0.00 179.97 180.06 1dk5 h GLN 59 N 0.11 0.31 0.00 0.04 4.20 -0.80 -3.13 115.11 115.84 1dk5 h GLN 59 Ca 0.53 -0.53 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 1dk5 h GLN 59 Cb 1.89 0.20 -0.01 0.00 0.30 0.00 0.00 27.48 29.86 1dk5 h GLN 59 CO -0.08 1.26 -0.39 1.79 -0.67 0.00 0.00 178.83 180.73 1dk5 h THR 60 N -0.29 1.07 0.00 -0.54 1.35 0.14 -2.16 112.91 112.48 1dk5 h THR 60 Ca -0.20 -1.45 -0.07 0.00 -0.55 0.00 0.00 66.41 64.14 1dk5 h THR 60 Cb 1.74 1.83 -0.01 0.00 -1.73 0.00 0.00 68.15 69.98 1dk5 h THR 60 CO 0.14 0.38 -0.33 0.22 -0.25 0.00 0.00 175.52 175.68 1dk5 h TYR 61 N 0.00 0.00 0.16 4.73 5.03 -0.24 -2.69 116.97 123.95 1dk5 h TYR 61 Ca -0.00 0.00 -0.22 0.00 2.58 0.00 0.00 58.73 61.09 1dk5 h TYR 61 Cb 0.80 0.00 0.02 0.00 1.55 0.00 0.00 36.73 39.10 1dk5 h TYR 61 CO 0.00 0.33 -0.99 0.00 -1.32 0.00 0.00 178.16 176.19 1dk5 h ALA 62 N 1.67 -0.07 0.00 1.82 0.00 -1.38 -3.04 119.26 118.25 1dk5 h ALA 62 Ca -0.00 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.14 1dk5 h ALA 62 Cb 0.74 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1dk5 h ALA 62 CO 0.04 0.48 0.00 -1.91 0.00 0.00 0.00 179.25 177.86 1dk5 n GLU 63 N -4.04 0.17 -0.01 0.00 4.07 -0.86 0.65 120.64 120.62 1dk5 n GLU 63 Ca -0.16 0.30 0.04 0.00 -0.06 0.00 0.00 57.16 57.28 1dk5 n GLU 63 Cb 0.87 -1.76 -0.08 0.00 -0.06 0.00 0.00 31.44 30.41 1dk5 n GLU 63 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1dk5 n THR 64 N -2.07 0.09 0.01 6.31 -2.24 -1.02 -4.57 114.28 110.79 1dk5 n THR 64 Ca 0.04 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1dk5 n THR 64 Cb 0.29 0.12 0.01 0.00 -2.10 0.00 0.00 70.33 68.65 1dk5 n THR 64 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1dk5 n PHE 65 N -1.94 0.01 -0.42 4.78 3.01 -1.15 -4.99 117.46 116.76 1dk5 n PHE 65 Ca -0.04 -0.19 0.00 0.00 1.01 0.00 0.00 57.45 58.24 1dk5 n PHE 65 Cb 0.35 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.80 1dk5 n PHE 65 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dk5 n GLY 66 N -0.14 0.00 3.70 1.37 0.00 0.21 -4.91 105.19 105.42 1dk5 n GLY 66 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1dk5 n GLY 66 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1dk5 s GLU 67 N -0.85 2.52 -0.32 1.61 2.12 -1.23 -4.97 118.70 117.57 1dk5 s GLU 67 Ca 0.00 -1.20 -0.20 0.00 0.36 0.00 0.00 54.97 53.94 1dk5 s GLU 67 Cb 0.00 -2.35 -0.01 0.00 0.26 0.00 0.00 34.13 32.03 1dk5 s GLU 67 CO 0.00 0.41 0.60 0.34 -0.54 0.00 0.00 175.26 176.07 1dk5 s ASP 68 N -3.44 6.44 0.16 -1.70 -1.08 -1.26 -3.61 116.67 112.19 1dk5 s ASP 68 Ca 0.30 0.30 -0.24 0.00 -0.52 0.00 0.00 52.55 52.40 1dk5 s ASP 68 Cb -0.08 -2.31 0.05 0.00 -1.46 0.00 0.00 42.92 39.11 1dk5 s ASP 68 CO 0.21 -0.49 1.59 0.25 0.52 0.00 0.00 175.17 177.25 1dk5 h LEU 69 N 9.16 -1.18 -0.17 -1.34 5.85 -1.88 -0.35 115.31 125.40 1dk5 h LEU 69 Ca -0.27 0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.70 1dk5 h LEU 69 Cb 1.12 0.54 -0.05 0.00 0.37 0.00 0.00 40.66 42.64 1dk5 h LEU 69 CO 0.80 -0.33 -0.13 -0.07 -0.34 0.00 0.00 178.44 178.36 1dk5 h LEU 70 N -0.27 -0.42 -1.99 2.25 3.38 -1.94 0.47 115.31 116.78 1dk5 h LEU 70 Ca 0.17 0.09 0.14 0.00 0.09 0.00 0.00 57.88 58.37 1dk5 h LEU 70 Cb 0.55 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 1dk5 h LEU 70 CO -0.56 -0.17 0.36 0.11 0.09 0.00 0.00 178.44 178.27 1dk5 h LYS 71 N -0.14 0.01 0.00 1.13 1.57 -1.80 1.12 116.57 118.45 1dk5 h LYS 71 Ca 0.10 -0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.80 1dk5 h LYS 71 Cb 0.30 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1dk5 h LYS 71 CO -0.25 0.01 -0.41 1.49 -0.57 0.00 0.00 179.45 179.71 1dk5 h GLU 72 N 0.01 0.00 -0.05 3.15 4.57 0.15 -3.24 114.58 119.17 1dk5 h GLU 72 Ca 0.24 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.40 1dk5 h GLU 72 Cb 0.94 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.52 1dk5 h GLU 72 CO -0.00 0.41 -0.19 1.47 -1.18 0.00 0.00 179.01 179.52 1dk5 n LEU 73 N -3.48 2.74 -0.53 1.64 -0.00 0.34 -4.48 117.00 113.23 1dk5 n LEU 73 Ca 0.00 -3.43 0.06 0.00 -0.00 0.00 0.00 56.01 52.64 1dk5 n LEU 73 Cb 0.55 -0.49 0.19 0.00 -0.00 0.00 0.00 43.42 43.67 1dk5 n LEU 73 CO 0.38 1.00 0.50 -0.90 -0.00 0.00 0.00 177.39 178.36 1dk5 n ASP 74 N -1.23 2.17 0.03 1.45 5.75 0.11 -4.76 116.55 120.07 1dk5 n ASP 74 Ca 0.19 -3.57 -0.11 0.00 -0.01 0.00 0.00 54.79 51.29 1dk5 n ASP 74 Cb 0.71 -0.51 -0.04 0.00 -1.03 0.00 0.00 41.12 40.24 1dk5 n ASP 74 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1dk5 h ARG 75 N 0.74 -0.40 -2.27 0.11 3.08 -1.79 -3.33 114.38 110.52 1dk5 h ARG 75 Ca 0.03 0.03 -0.60 0.00 0.07 0.00 0.00 59.98 59.51 1dk5 h ARG 75 Cb 1.13 0.09 -0.42 0.00 0.08 0.00 0.00 29.97 30.85 1dk5 h ARG 75 CO 0.07 -0.27 -0.64 0.39 -1.07 0.00 0.00 179.97 178.45 1dk5 n GLU 76 N -5.40 2.26 0.00 0.04 1.02 -1.26 -4.95 120.64 112.35 1dk5 n GLU 76 Ca -0.04 -4.51 0.02 0.00 -0.02 0.00 0.00 57.16 52.61 1dk5 n GLU 76 Cb 0.32 -2.16 0.11 0.00 -0.02 0.00 0.00 31.44 29.69 1dk5 n GLU 76 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1dk5 n LEU 77 N 1.04 0.00 0.10 -4.62 4.77 -1.25 -2.42 117.00 114.62 1dk5 n LEU 77 Ca 0.28 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.23 1dk5 n LEU 77 Cb 0.42 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.49 1dk5 n LEU 77 CO 0.37 0.00 0.31 0.74 -1.33 0.00 0.00 177.39 177.48 1dk5 h THR 78 N 0.00 1.38 -3.38 -5.08 2.02 -1.95 -3.41 112.91 102.49 1dk5 h THR 78 Ca 0.00 -2.81 -0.55 0.00 0.77 0.00 0.00 66.41 63.83 1dk5 h THR 78 Cb 0.00 2.59 -0.03 0.00 -1.74 0.00 0.00 68.15 68.97 1dk5 h THR 78 CO 0.00 0.75 0.34 -1.00 0.37 0.00 0.00 175.52 175.99 1dk5 s HIS 79 N -2.93 3.62 0.25 3.16 3.76 -1.02 -4.97 115.29 117.16 1dk5 s HIS 79 Ca 0.02 1.60 -0.13 0.00 -0.15 0.00 0.00 55.06 56.40 1dk5 s HIS 79 Cb 0.10 -3.07 0.33 0.00 1.11 0.00 0.00 32.58 31.05 1dk5 s HIS 79 CO 0.78 -0.02 1.57 0.38 -0.85 0.00 0.00 174.74 176.60 1dk5 h ASP 80 N 6.84 -1.02 -0.09 1.40 -0.00 -1.90 -1.75 116.42 119.90 1dk5 h ASP 80 Ca -0.40 0.28 0.04 0.00 -0.00 0.00 0.00 57.03 56.95 1dk5 h ASP 80 Cb 1.21 0.61 -0.05 0.00 -0.00 0.00 0.00 39.33 41.10 1dk5 h ASP 80 CO 0.76 -0.30 -0.23 0.15 -0.00 0.00 0.00 179.24 179.62 1dk5 h PHE 81 N -0.02 -0.62 0.00 4.15 3.57 -1.92 -1.24 116.94 120.85 1dk5 h PHE 81 Ca 0.39 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.88 1dk5 h PHE 81 Cb 0.64 0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 1dk5 h PHE 81 CO -0.74 -0.32 -0.18 0.93 -2.23 0.00 0.00 178.31 175.78 1dk5 h GLU 82 N -0.32 0.00 0.00 1.11 5.08 -1.62 -1.94 114.58 116.89 1dk5 h GLU 82 Ca 0.09 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.36 1dk5 h GLU 82 Cb 0.45 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1dk5 h GLU 82 CO -0.27 0.18 -0.41 -0.22 -1.00 0.00 0.00 179.01 177.29 1dk5 h LYS 83 N 0.00 0.00 0.20 2.33 3.64 -0.91 -3.03 116.57 118.81 1dk5 h LYS 83 Ca -0.00 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.10 1dk5 h LYS 83 Cb 0.42 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 32.27 1dk5 h LYS 83 CO 0.02 0.41 -1.24 1.25 -2.27 0.00 0.00 179.45 177.62 1dk5 h LEU 84 N 0.00 0.68 -0.76 5.20 5.85 -0.51 -2.97 115.31 122.80 1dk5 h LEU 84 Ca -0.00 -0.93 -0.02 0.00 0.84 0.00 0.00 57.88 57.76 1dk5 h LEU 84 Cb 1.31 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.08 1dk5 h LEU 84 CO 0.05 1.59 0.40 0.58 -0.34 0.00 0.00 178.44 180.72 1dk5 h VAL 85 N -0.07 1.24 0.00 1.05 2.07 -1.46 -0.04 116.25 119.04 1dk5 h VAL 85 Ca -0.22 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 66.68 1dk5 h VAL 85 Cb 1.95 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1dk5 h VAL 85 CO 0.22 0.27 0.00 0.18 0.02 0.00 0.00 177.57 178.26 1dk5 n LEU 86 N -4.42 0.00 -0.30 2.57 7.99 -1.14 0.36 117.00 122.07 1dk5 n LEU 86 Ca 0.07 0.66 0.03 0.00 -0.01 0.00 0.00 56.01 56.76 1dk5 n LEU 86 Cb 0.11 -0.16 0.08 0.00 -0.11 0.00 0.00 43.42 43.34 1dk5 n LEU 86 CO 0.38 -0.16 0.51 0.52 -1.51 0.00 0.00 177.39 177.13 1dk5 n VAL 87 N -1.06 -0.37 0.09 4.08 0.31 -1.12 -0.04 118.33 120.23 1dk5 n VAL 87 Ca 0.00 1.86 -0.13 0.00 -0.01 0.00 0.00 64.34 66.06 1dk5 n VAL 87 Cb 0.00 -2.53 -0.08 0.00 -0.91 0.00 0.00 33.84 30.32 1dk5 n VAL 87 CO 0.00 0.00 0.00 -0.25 -1.32 0.00 0.00 176.83 175.26 1dk5 h TRP 88 N 0.00 -0.17 -0.15 3.52 2.91 -0.92 -3.00 115.95 118.15 1dk5 h TRP 88 Ca 0.35 -0.00 0.04 0.00 1.13 0.00 0.00 58.89 60.40 1dk5 h TRP 88 Cb 0.55 0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 29.25 1dk5 h TRP 88 CO -0.65 0.02 0.10 1.15 -1.03 0.00 0.00 178.44 178.03 1dk5 h THR 89 N -0.33 0.93 -3.47 2.65 2.02 0.36 -3.43 112.91 111.64 1dk5 h THR 89 Ca -0.02 -0.00 -0.55 0.00 0.77 0.00 0.00 66.41 66.61 1dk5 h THR 89 Cb 0.27 0.92 0.19 0.00 -1.74 0.00 0.00 68.15 67.79 1dk5 h THR 89 CO 0.03 0.00 -0.25 0.18 0.37 0.00 0.00 175.52 175.86 1dk5 n LEU 90 N -4.50 1.58 -4.78 2.58 4.77 -0.41 -4.89 117.00 111.36 1dk5 n LEU 90 Ca 0.00 0.56 -0.36 0.00 -0.03 0.00 0.00 56.01 56.19 1dk5 n LEU 90 Cb 0.22 -1.29 -0.02 0.00 -2.33 0.00 0.00 43.42 40.01 1dk5 n LEU 90 CO 0.35 -2.83 0.78 -0.62 -1.33 0.00 0.00 177.39 173.73 1dk5 s ASP 91 N -1.68 6.16 0.64 -1.43 -1.08 -1.26 -4.79 116.67 113.23 1dk5 s ASP 91 Ca 0.66 2.14 0.29 0.00 -0.52 0.00 0.00 52.55 55.12 1dk5 s ASP 91 Cb -0.32 -2.58 1.54 0.00 -1.46 0.00 0.00 42.92 40.10 1dk5 s ASP 91 CO 0.57 -0.91 1.89 -0.65 0.52 0.00 0.00 175.17 176.59 1dk5 h PRO 92 N 1.75 0.00 0.00 4.34 0.11 -1.92 0.11 132.00 136.39 1dk5 h PRO 92 Ca -0.49 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 1dk5 h PRO 92 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1dk5 h PRO 92 CO 0.59 0.00 -0.01 0.77 -0.21 0.00 0.00 178.00 179.14 1dk5 h SER 93 N 0.00 0.01 -0.08 -2.05 0.02 -1.89 -2.71 113.55 106.85 1dk5 h SER 93 Ca 0.06 -0.95 -0.10 0.00 -0.84 0.00 0.00 61.79 59.95 1dk5 h SER 93 Cb 0.83 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.36 1dk5 h SER 93 CO -0.00 0.96 -0.27 -0.33 -1.14 0.00 0.00 176.83 176.05 1dk5 h GLU 94 N -0.95 0.53 -0.96 3.45 5.08 -1.68 -0.87 114.58 119.17 1dk5 h GLU 94 Ca -0.00 -0.21 0.01 0.00 -1.00 0.00 0.00 59.36 58.16 1dk5 h GLU 94 Cb 0.96 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.14 1dk5 h GLU 94 CO 0.00 0.75 0.64 -0.09 -1.00 0.00 0.00 179.01 179.31 1dk5 h ARG 95 N 0.46 1.26 -0.13 2.33 2.43 -0.90 0.12 114.38 119.94 1dk5 h ARG 95 Ca 0.06 -0.08 -0.22 0.00 -0.81 0.00 0.00 59.98 58.94 1dk5 h ARG 95 Cb 0.71 -0.28 0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1dk5 h ARG 95 CO 0.05 0.83 -0.78 -0.44 -1.51 0.00 0.00 179.97 178.12 1dk5 h ASP 96 N 1.29 0.85 -0.66 -3.80 3.45 -1.08 -2.31 116.42 114.16 1dk5 h ASP 96 Ca 0.36 -0.56 0.09 0.00 0.43 0.00 0.00 57.03 57.34 1dk5 h ASP 96 Cb -0.13 -0.25 -0.07 0.00 -0.56 0.00 0.00 39.33 38.32 1dk5 h ASP 96 CO -0.08 1.35 0.31 0.00 -1.57 0.00 0.00 179.24 179.25 1dk5 h ALA 97 N 0.63 0.89 -0.46 3.45 0.00 -0.37 0.75 119.26 124.15 1dk5 h ALA 97 Ca -0.05 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1dk5 h ALA 97 Cb 1.40 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1dk5 h ALA 97 CO 0.16 -0.08 0.21 1.25 0.00 0.00 0.00 179.25 180.78 1dk5 h HIS 98 N 0.54 0.68 -0.16 0.00 -0.00 -0.71 -0.05 115.15 115.45 1dk5 h HIS 98 Ca 0.32 -0.04 -0.06 0.00 -0.00 0.00 0.00 60.37 60.59 1dk5 h HIS 98 Cb 0.34 -0.21 -0.00 0.00 -0.00 0.00 0.00 27.41 27.53 1dk5 h HIS 98 CO -0.12 0.56 -0.13 -0.07 -0.00 0.00 0.00 177.93 178.17 1dk5 h LEU 99 N 0.61 0.40 -0.16 0.26 3.38 -0.80 0.58 115.31 119.58 1dk5 h LEU 99 Ca 0.16 -0.46 0.04 0.00 0.09 0.00 0.00 57.88 57.71 1dk5 h LEU 99 Cb 0.15 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 1dk5 h LEU 99 CO -0.02 0.77 -0.13 0.00 0.09 0.00 0.00 178.44 179.16 1dk5 h ALA 100 N 0.64 -0.01 -0.49 1.53 0.00 0.59 0.21 119.26 121.72 1dk5 h ALA 100 Ca 0.03 0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1dk5 h ALA 100 Cb 0.65 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1dk5 h ALA 100 CO 0.03 -0.57 -0.17 -0.22 0.00 0.00 0.00 179.25 178.32 1dk5 h LYS 101 N -0.14 0.97 -0.80 0.00 1.63 -0.95 -2.70 116.57 114.58 1dk5 h LYS 101 Ca 0.10 -0.38 -0.01 0.00 -0.85 0.00 0.00 60.65 59.51 1dk5 h LYS 101 Cb 0.29 -0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 31.83 1dk5 h LYS 101 CO -0.24 1.05 0.48 1.49 -3.45 0.00 0.00 179.45 178.78 1dk5 h GLU 102 N 0.85 1.09 0.00 1.90 4.81 -0.51 -2.48 114.58 120.24 1dk5 h GLU 102 Ca 0.12 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1dk5 h GLU 102 Cb 0.73 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.89 1dk5 h GLU 102 CO 0.06 0.78 0.16 0.00 -0.73 0.00 0.00 179.01 179.28 1dk5 h ALA 103 N 1.25 1.15 -0.58 2.92 0.00 -0.25 -2.22 119.26 121.54 1dk5 h ALA 103 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1dk5 h ALA 103 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1dk5 h ALA 103 CO -0.05 -0.15 0.00 0.25 0.00 0.00 0.00 179.25 179.29 1dk5 n THR 104 N -2.83 1.24 -4.28 0.00 -2.24 -0.93 -1.67 114.28 103.57 1dk5 n THR 104 Ca -0.02 -1.09 -0.32 0.00 -2.27 0.00 0.00 64.05 60.35 1dk5 n THR 104 Cb 0.21 0.38 -0.09 0.00 -2.10 0.00 0.00 70.33 68.74 1dk5 n THR 104 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1dk5 s LYS 105 N -1.27 2.63 0.00 -0.78 1.02 -0.83 -4.87 119.74 115.63 1dk5 s LYS 105 Ca 0.42 -0.72 0.00 0.00 0.02 0.00 0.00 55.97 55.69 1dk5 s LYS 105 Cb 0.24 -2.58 0.00 0.00 -0.52 0.00 0.00 37.83 34.97 1dk5 s LYS 105 CO 0.25 0.59 0.35 -2.13 -0.92 0.00 0.00 175.35 173.49 1dk5 n ARG 106 N 1.16 0.00 0.00 1.68 3.00 -1.26 -0.55 116.66 120.69 1dk5 n ARG 106 Ca -0.14 0.35 0.10 0.00 -0.00 0.00 0.00 57.85 58.17 1dk5 n ARG 106 Cb 0.52 -0.52 0.58 0.00 0.00 0.00 0.00 32.46 33.04 1dk5 n ARG 106 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 1dk5 n TRP 107 N -2.33 0.00 -2.79 -0.14 7.02 -1.26 -3.17 117.44 114.78 1dk5 n TRP 107 Ca 0.00 0.00 -0.00 0.00 -1.02 0.00 0.00 57.50 56.48 1dk5 n TRP 107 Cb 0.00 -0.14 0.06 0.00 -2.42 0.00 0.00 31.31 28.81 1dk5 n TRP 107 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1dk5 n THR 108 N -1.14 0.97 -2.33 -0.99 -2.24 0.07 -5.10 114.28 103.52 1dk5 n THR 108 Ca 0.13 -2.45 -0.43 0.00 -2.27 0.00 0.00 64.05 59.03 1dk5 n THR 108 Cb 0.12 1.23 -0.02 0.00 -2.10 0.00 0.00 70.33 69.55 1dk5 n THR 108 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1dk5 s LYS 109 N -2.88 4.25 -0.18 -0.78 2.20 0.29 -4.05 119.74 118.59 1dk5 s LYS 109 Ca 0.24 1.80 -0.04 0.00 -0.36 0.00 0.00 55.97 57.61 1dk5 s LYS 109 Cb 0.34 -3.73 0.09 0.00 -1.51 0.00 0.00 37.83 33.02 1dk5 s LYS 109 CO -0.06 -0.66 0.27 0.45 -0.36 0.00 0.00 175.35 174.98 1dk5 s SER 110 N 2.10 0.73 0.39 1.43 0.15 -0.67 -4.98 113.70 112.84 1dk5 s SER 110 Ca 0.59 0.22 0.24 0.00 0.70 0.00 0.00 55.95 57.70 1dk5 s SER 110 Cb -0.26 0.65 0.43 0.00 -1.71 0.00 0.00 66.02 65.14 1dk5 s SER 110 CO 0.20 -0.28 1.64 0.78 1.20 0.00 0.00 173.24 176.78 1dk5 h ASN 111 N 8.28 0.00 0.21 5.45 -0.26 -1.95 -3.17 115.58 124.14 1dk5 h ASN 111 Ca -0.16 -0.00 -0.14 0.00 -0.56 0.00 0.00 56.30 55.44 1dk5 h ASN 111 Cb 1.14 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.38 1dk5 h ASN 111 CO 0.21 0.00 -0.53 -0.26 -1.06 0.00 0.00 177.43 175.80 1dk5 h PHE 112 N 0.00 0.43 -0.13 1.19 0.04 -1.95 -2.48 116.94 114.04 1dk5 h PHE 112 Ca 0.00 -0.15 -0.20 0.00 2.80 0.00 0.00 57.97 60.42 1dk5 h PHE 112 Cb 0.95 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 39.02 1dk5 h PHE 112 CO 0.00 0.80 -0.75 0.28 -0.60 0.00 0.00 178.31 178.05 1dk5 h VAL 113 N 0.27 1.32 -0.05 -0.55 2.07 -1.95 -0.77 116.25 116.60 1dk5 h VAL 113 Ca 0.01 -2.03 0.03 0.00 0.82 0.00 0.00 66.70 65.53 1dk5 h VAL 113 Cb 1.02 2.02 -0.04 0.00 -1.52 0.00 0.00 31.29 32.76 1dk5 h VAL 113 CO 0.09 0.63 -0.14 -0.07 0.02 0.00 0.00 177.57 178.09 1dk5 h LEU 114 N 0.43 -0.43 -0.14 2.57 3.38 -1.49 0.41 115.31 120.04 1dk5 h LEU 114 Ca -0.04 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.03 1dk5 h LEU 114 Cb 1.35 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 42.27 1dk5 h LEU 114 CO 0.14 -0.20 -0.04 0.58 0.09 0.00 0.00 178.44 179.01 1dk5 h VAL 115 N -0.22 0.84 -0.72 1.22 2.07 -1.41 0.18 116.25 118.22 1dk5 h VAL 115 Ca 0.07 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.75 1dk5 h VAL 115 Cb 0.31 0.84 -0.12 0.00 -1.52 0.00 0.00 31.29 30.80 1dk5 h VAL 115 CO -0.18 0.00 0.09 -0.08 0.02 0.00 0.00 177.57 177.42 1dk5 h GLU 116 N -0.02 0.18 -0.69 1.57 4.81 -0.60 0.21 114.58 120.05 1dk5 h GLU 116 Ca 0.07 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.24 1dk5 h GLU 116 Cb 0.12 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 1dk5 h GLU 116 CO -0.15 0.12 0.25 -0.07 -0.73 0.00 0.00 179.01 178.43 1dk5 h LEU 117 N 0.18 0.96 0.12 1.64 3.38 0.96 0.11 115.31 122.67 1dk5 h LEU 117 Ca 0.40 -0.15 -0.29 0.00 0.09 0.00 0.00 57.88 57.93 1dk5 h LEU 117 Cb 0.70 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1dk5 h LEU 117 CO -0.57 0.87 -1.37 0.00 0.09 0.00 0.00 178.44 177.46 1dk5 h ALA 118 N 1.26 0.17 0.03 1.53 0.00 0.11 -3.39 119.26 118.97 1dk5 h ALA 118 Ca 0.23 -0.98 -0.35 0.00 0.00 0.00 0.00 54.91 53.80 1dk5 h ALA 118 Cb 0.23 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1dk5 h ALA 118 CO -0.02 1.04 -2.15 0.00 0.00 0.00 0.00 179.25 178.13 1dk5 n THR 120 N -3.10 1.65 -4.57 0.00 -2.24 0.37 -4.11 114.28 102.28 1dk5 n THR 120 Ca -0.31 -0.85 -0.27 0.00 -2.27 0.00 0.00 64.05 60.35 1dk5 n THR 120 Cb 1.07 -0.34 -0.11 0.00 -2.10 0.00 0.00 70.33 68.85 1dk5 n THR 120 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1dk5 s ARG 121 N -2.06 1.87 0.71 -0.78 3.00 -1.26 -5.03 118.95 115.41 1dk5 s ARG 121 Ca 0.33 -2.01 -0.10 0.00 0.00 0.00 0.00 55.73 53.96 1dk5 s ARG 121 Cb 0.25 -1.66 0.04 0.00 0.00 0.00 0.00 34.95 33.58 1dk5 s ARG 121 CO 0.10 0.06 1.07 -1.54 0.00 0.00 0.00 175.30 174.98 1dk5 s SER 122 N -3.65 5.06 0.09 0.23 1.04 -1.26 -4.86 113.70 110.36 1dk5 s SER 122 Ca 0.34 0.81 -0.28 0.00 0.48 0.00 0.00 55.95 57.30 1dk5 s SER 122 Cb 0.06 -1.52 -0.13 0.00 0.10 0.00 0.00 66.02 64.52 1dk5 s SER 122 CO 0.17 -1.51 1.66 -0.65 0.98 0.00 0.00 173.24 173.89 1dk5 h PRO 123 N -0.67 -0.48 -0.42 4.02 0.11 -1.93 -1.55 132.00 131.07 1dk5 h PRO 123 Ca -0.45 0.03 0.08 0.00 0.11 0.00 0.00 66.00 65.77 1dk5 h PRO 123 Cb 1.29 0.11 -0.08 0.00 0.11 0.00 0.00 31.00 32.43 1dk5 h PRO 123 CO 0.63 -0.32 -0.10 -0.22 -0.21 0.00 0.00 178.00 177.78 1dk5 h LYS 124 N -0.50 0.01 -0.40 1.05 3.64 -1.94 -0.43 116.57 117.99 1dk5 h LYS 124 Ca -0.02 -0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.44 1dk5 h LYS 124 Cb 0.44 -0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.19 1dk5 h LYS 124 CO -0.02 0.00 -0.07 0.93 -2.27 0.00 0.00 179.45 178.03 1dk5 h GLU 125 N 0.01 0.03 -0.05 1.90 5.08 -1.85 0.62 114.58 120.32 1dk5 h GLU 125 Ca 0.20 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.57 1dk5 h GLU 125 Cb 0.31 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 1dk5 h GLU 125 CO -0.43 0.02 0.07 1.25 -1.00 0.00 0.00 179.01 178.92 1dk5 h LEU 126 N 0.03 0.00 0.15 1.33 5.85 -0.21 -0.63 115.31 121.82 1dk5 h LEU 126 Ca 0.20 0.00 -0.32 0.00 0.84 0.00 0.00 57.88 58.59 1dk5 h LEU 126 Cb 0.29 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.33 1dk5 h LEU 126 CO -0.39 0.00 -1.60 1.62 -0.34 0.00 0.00 178.44 177.73 1dk5 h VAL 127 N 0.00 1.09 0.00 1.05 3.04 0.17 -2.43 116.25 119.17 1dk5 h VAL 127 Ca 0.02 -2.70 0.00 0.00 -1.01 0.00 0.00 66.70 63.02 1dk5 h VAL 127 Cb 0.17 2.77 0.00 0.00 -2.01 0.00 0.00 31.29 32.22 1dk5 h VAL 127 CO -0.00 0.83 0.00 -0.07 -1.01 0.00 0.00 177.57 177.32 1dk5 h LEU 128 N 0.08 0.00 0.23 3.16 3.38 0.47 0.17 115.31 122.80 1dk5 h LEU 128 Ca -0.28 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.37 1dk5 h LEU 128 Cb 2.05 0.00 0.04 0.00 0.09 0.00 0.00 40.66 42.84 1dk5 h LEU 128 CO 0.17 0.00 -1.42 0.00 0.09 0.00 0.00 178.44 177.28 1dk5 h ALA 129 N 2.01 -0.14 -0.19 1.53 0.00 -1.19 -1.20 119.26 120.09 1dk5 h ALA 129 Ca 0.00 -0.84 -0.03 0.00 0.00 0.00 0.00 54.91 54.04 1dk5 h ALA 129 Cb 0.33 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1dk5 h ALA 129 CO 0.00 0.68 -0.02 0.00 0.00 0.00 0.00 179.25 179.91 1dk5 h ARG 130 N 0.15 0.28 -0.27 0.00 3.08 -0.69 0.17 114.38 117.10 1dk5 h ARG 130 Ca -0.24 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 59.63 1dk5 h ARG 130 Cb 2.11 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 32.11 1dk5 h ARG 130 CO 0.27 0.32 -0.38 0.93 -1.07 0.00 0.00 179.97 180.04 1dk5 h GLU 131 N 0.27 0.62 -0.03 0.04 5.08 -0.54 -2.58 114.58 117.45 1dk5 h GLU 131 Ca 0.06 -0.31 -0.14 0.00 -1.00 0.00 0.00 59.36 57.98 1dk5 h GLU 131 Cb 0.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1dk5 h GLU 131 CO 0.01 0.90 -0.61 0.00 -1.00 0.00 0.00 179.01 178.31 1dk5 h ALA 132 N 1.06 0.93 0.00 3.43 0.00 -0.12 -2.65 119.26 121.92 1dk5 h ALA 132 Ca 0.05 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1dk5 h ALA 132 Cb 0.89 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1dk5 h ALA 132 CO 0.08 0.75 0.00 -0.92 0.00 0.00 0.00 179.25 179.16 1dk5 h TYR 133 N 0.07 0.00 0.01 0.00 5.03 -0.47 -0.70 116.97 120.91 1dk5 h TYR 133 Ca -0.01 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.30 1dk5 h TYR 133 Cb 1.09 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.37 1dk5 h TYR 133 CO 0.01 0.00 -0.01 0.45 -1.32 0.00 0.00 178.16 177.29 1dk5 h HIS 134 N 0.00 -0.01 -0.46 -3.82 3.86 -1.11 -2.95 115.15 110.66 1dk5 h HIS 134 Ca 0.00 -0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.28 1dk5 h HIS 134 Cb 0.55 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 28.93 1dk5 h HIS 134 CO 0.00 0.02 -0.48 0.00 0.86 0.00 0.00 177.93 178.33 1dk5 h ALA 135 N -0.97 -0.54 -0.18 2.45 0.00 -1.43 0.90 119.26 119.48 1dk5 h ALA 135 Ca -0.00 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1dk5 h ALA 135 Cb 0.04 1.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1dk5 h ALA 135 CO 0.00 -0.93 -0.25 -0.09 0.00 0.00 0.00 179.25 177.98 1dk5 h ARG 136 N -0.32 0.34 0.00 0.00 9.65 -1.30 -3.37 114.38 119.37 1dk5 h ARG 136 Ca 0.12 -0.12 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 1dk5 h ARG 136 Cb 0.58 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.14 1dk5 h ARG 136 CO -0.62 0.57 0.00 0.66 2.80 0.00 0.00 179.97 183.38 1dk5 n TYR 137 N -4.14 0.00 -2.51 2.20 0.53 -0.87 -5.00 117.16 107.36 1dk5 n TYR 137 Ca -0.01 0.00 -0.21 0.00 -1.02 0.00 0.00 57.90 56.66 1dk5 n TYR 137 Cb 0.38 0.00 -0.00 0.00 -1.03 0.00 0.00 39.34 38.69 1dk5 n TYR 137 CO 0.00 0.00 0.00 1.63 -1.02 0.00 0.00 176.86 177.47 1dk5 n LYS 138 N -0.45 -2.27 -3.73 -0.72 4.01 0.31 -4.97 118.16 110.32 1dk5 n LYS 138 Ca 0.00 0.99 -0.10 0.00 -0.51 0.00 0.00 58.31 58.70 1dk5 n LYS 138 Cb 0.02 -5.70 -0.04 0.00 -0.51 0.00 0.00 35.03 28.80 1dk5 n LYS 138 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1dk5 s LYS 139 N -5.17 1.33 0.46 1.97 1.02 -1.25 -5.06 119.74 113.04 1dk5 s LYS 139 Ca 0.05 -0.86 -0.20 0.00 0.02 0.00 0.00 55.97 54.98 1dk5 s LYS 139 Cb -0.02 0.51 -0.10 0.00 -0.52 0.00 0.00 37.83 37.69 1dk5 s LYS 139 CO 0.07 -0.56 0.97 -1.12 -0.92 0.00 0.00 175.35 173.79 1dk5 s SER 140 N -2.87 6.76 0.29 2.83 0.01 -1.26 -3.79 113.70 115.66 1dk5 s SER 140 Ca 0.09 1.72 0.04 0.00 1.31 0.00 0.00 55.95 59.11 1dk5 s SER 140 Cb -0.00 -2.54 0.44 0.00 0.21 0.00 0.00 66.02 64.12 1dk5 s SER 140 CO -0.04 -0.49 1.71 0.25 0.41 0.00 0.00 173.24 175.09 1dk5 h LEU 141 N 1.66 0.37 0.00 2.44 5.85 -1.89 -2.37 115.31 121.38 1dk5 h LEU 141 Ca -0.49 -0.14 -0.19 0.00 0.84 0.00 0.00 57.88 57.91 1dk5 h LEU 141 Cb 1.19 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.09 1dk5 h LEU 141 CO 0.61 0.69 -0.94 1.05 -0.34 0.00 0.00 178.44 179.50 1dk5 h GLU 142 N 0.32 0.00 0.28 1.25 9.09 -1.93 0.18 114.58 123.77 1dk5 h GLU 142 Ca 0.04 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.45 1dk5 h GLU 142 Cb 0.73 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.82 1dk5 h GLU 142 CO 0.06 0.80 -0.25 1.49 0.05 0.00 0.00 179.01 181.15 1dk5 h GLU 143 N 0.00 -0.53 -0.38 1.06 4.81 -1.89 0.70 114.58 118.35 1dk5 h GLU 143 Ca -0.04 0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1dk5 h GLU 143 Cb 1.68 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 31.17 1dk5 h GLU 143 CO 0.11 -0.35 0.01 -0.44 -0.73 0.00 0.00 179.01 177.60 1dk5 h ASP 144 N -0.55 0.65 -0.44 1.04 3.45 -1.44 -1.75 116.42 117.37 1dk5 h ASP 144 Ca -0.01 -0.30 -0.06 0.00 0.43 0.00 0.00 57.03 57.08 1dk5 h ASP 144 Cb 0.50 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 39.07 1dk5 h ASP 144 CO -0.03 0.79 0.06 0.58 -1.57 0.00 0.00 179.24 179.06 1dk5 h VAL 145 N 0.48 1.23 -0.32 -1.35 2.07 -0.47 -0.75 116.25 117.16 1dk5 h VAL 145 Ca 0.11 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.70 1dk5 h VAL 145 Cb 0.45 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1dk5 h VAL 145 CO 0.02 0.33 0.16 0.00 0.02 0.00 0.00 177.57 178.10 1dk5 h ALA 146 N 1.29 0.41 -0.66 1.67 0.00 0.62 -2.50 119.26 120.09 1dk5 h ALA 146 Ca 0.16 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1dk5 h ALA 146 Cb 0.38 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1dk5 h ALA 146 CO 0.01 -0.05 0.41 -0.92 0.00 0.00 0.00 179.25 178.70 1dk5 h TYR 147 N 0.38 0.86 -0.29 0.00 3.20 -0.93 -3.14 116.97 117.06 1dk5 h TYR 147 Ca 0.11 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.98 1dk5 h TYR 147 Cb 0.09 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.07 1dk5 h TYR 147 CO -0.02 0.57 0.00 0.72 -1.64 0.00 0.00 178.16 177.79 1dk5 n HIS 148 N -4.59 0.37 -4.36 -3.82 8.25 -0.32 -4.90 115.22 105.86 1dk5 n HIS 148 Ca 0.05 -0.19 -0.18 0.00 -0.26 0.00 0.00 57.72 57.14 1dk5 n HIS 148 Cb 0.05 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.05 1dk5 n HIS 148 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1dk5 s THR 149 N -1.63 1.07 0.22 1.59 -4.23 -0.95 -5.06 115.64 106.66 1dk5 s THR 149 Ca 0.31 -2.03 -0.06 0.00 -1.18 0.00 0.00 61.69 58.73 1dk5 s THR 149 Cb 0.17 -2.47 -0.02 0.00 1.34 0.00 0.00 72.50 71.52 1dk5 s THR 149 CO 0.24 -0.23 0.29 0.42 -0.54 0.00 0.00 174.62 174.80 1dk5 s THR 150 N -3.39 0.00 0.00 3.99 -4.23 -1.26 -4.74 115.64 106.01 1dk5 s THR 150 Ca 0.31 -1.72 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 1dk5 s THR 150 Cb 0.06 -2.36 0.00 0.00 1.34 0.00 0.00 72.50 71.55 1dk5 s THR 150 CO 0.11 -0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.79 1dk5 n GLY 151 N -0.32 1.45 0.28 3.99 0.00 -1.26 -0.98 105.19 108.35 1dk5 n GLY 151 Ca 0.00 -0.26 -0.00 0.00 0.00 0.00 0.00 46.02 45.76 1dk5 n GLY 151 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1dk5 h ASP 152 N 0.42 -0.73 -0.28 1.61 3.45 -1.99 -0.43 116.42 118.47 1dk5 h ASP 152 Ca 0.00 0.21 0.06 0.00 0.43 0.00 0.00 57.03 57.73 1dk5 h ASP 152 Cb 0.00 0.46 -0.06 0.00 -0.56 0.00 0.00 39.33 39.17 1dk5 h ASP 152 CO 0.00 -0.24 -0.11 0.45 -1.57 0.00 0.00 179.24 177.77 1dk5 h HIS 153 N -0.03 -0.26 -0.65 4.55 3.86 -1.92 -1.76 115.15 118.95 1dk5 h HIS 153 Ca 0.32 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.53 1dk5 h HIS 153 Cb 0.52 0.16 -0.03 0.00 1.06 0.00 0.00 27.41 29.11 1dk5 h HIS 153 CO -0.57 -0.17 0.30 -0.09 0.86 0.00 0.00 177.93 178.25 1dk5 h ARG 154 N -0.06 0.92 -0.61 2.45 2.43 0.06 -1.01 114.38 118.56 1dk5 h ARG 154 Ca 0.14 -0.13 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1dk5 h ARG 154 Cb 0.28 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 1dk5 h ARG 154 CO -0.32 0.72 0.30 -0.22 -1.51 0.00 0.00 179.97 178.94 1dk5 h LYS 155 N 0.91 0.85 0.02 0.20 3.64 -0.27 -2.05 116.57 119.88 1dk5 h LYS 155 Ca 0.22 -0.10 -0.28 0.00 -1.27 0.00 0.00 60.65 59.22 1dk5 h LYS 155 Cb 0.11 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.73 1dk5 h LYS 155 CO -0.03 0.65 -1.58 1.25 -2.27 0.00 0.00 179.45 177.48 1dk5 h LEU 156 N 0.86 0.07 0.08 5.20 7.12 -1.29 -3.40 115.31 123.94 1dk5 h LEU 156 Ca 0.21 -0.12 -0.28 0.00 0.13 0.00 0.00 57.88 57.82 1dk5 h LEU 156 Cb 0.07 -0.02 0.02 0.00 -0.53 0.00 0.00 40.66 40.20 1dk5 h LEU 156 CO -0.03 1.10 -1.22 -0.07 -0.13 0.00 0.00 178.44 178.10 1dk5 h LEU 157 N 0.01 0.68 0.39 2.25 3.38 -0.96 -2.84 115.31 118.22 1dk5 h LEU 157 Ca -0.24 -0.65 -0.02 0.00 0.09 0.00 0.00 57.88 57.06 1dk5 h LEU 157 Cb 1.97 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.51 1dk5 h LEU 157 CO 0.10 1.48 -0.19 0.58 0.09 0.00 0.00 178.44 180.49 1dk5 h VAL 158 N 0.19 0.40 -0.27 1.22 2.07 -1.60 -1.96 116.25 116.30 1dk5 h VAL 158 Ca -0.16 -0.64 0.08 0.00 0.82 0.00 0.00 66.70 66.80 1dk5 h VAL 158 Cb 1.90 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1dk5 h VAL 158 CO 0.22 0.08 0.19 1.55 0.02 0.00 0.00 177.57 179.64 1dk5 h PRO 159 N -0.98 0.01 -0.39 1.57 0.13 -1.77 0.38 132.00 130.95 1dk5 h PRO 159 Ca -0.05 -0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.02 1dk5 h PRO 159 Cb 0.54 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.65 1dk5 h PRO 159 CO 0.09 0.01 0.05 -0.07 -0.23 0.00 0.00 178.00 177.84 1dk5 h LEU 160 N 0.01 0.63 0.00 1.56 3.38 -1.22 -1.68 115.31 118.00 1dk5 h LEU 160 Ca 0.13 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1dk5 h LEU 160 Cb 0.50 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1dk5 h LEU 160 CO -0.00 0.75 -0.34 -0.37 0.09 0.00 0.00 178.44 178.57 1dk5 h VAL 161 N 0.49 0.00 -0.00 1.22 -1.51 -0.46 -3.26 116.25 112.73 1dk5 h VAL 161 Ca 0.12 -0.78 0.00 0.00 -1.23 0.00 0.00 66.70 64.80 1dk5 h VAL 161 Cb 0.40 1.59 0.00 0.00 -2.13 0.00 0.00 31.29 31.15 1dk5 h VAL 161 CO 0.01 0.00 -0.75 -1.54 -1.23 0.00 0.00 177.57 174.06 1dk5 n SER 162 N -2.63 1.21 -4.73 4.19 3.41 0.00 -4.86 113.62 110.22 1dk5 n SER 162 Ca 0.03 -1.03 -0.41 0.00 -0.26 0.00 0.00 58.87 57.20 1dk5 n SER 162 Cb 0.49 0.71 -0.03 0.00 -0.26 0.00 0.00 64.21 65.12 1dk5 n SER 162 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1dk5 s SER 163 N -2.83 7.06 -0.60 4.04 0.15 -0.64 -4.97 113.70 115.91 1dk5 s SER 163 Ca 0.12 2.19 0.06 0.00 0.70 0.00 0.00 55.95 59.03 1dk5 s SER 163 Cb 0.17 -2.60 0.24 0.00 -1.71 0.00 0.00 66.02 62.12 1dk5 s SER 163 CO 0.75 -0.42 0.68 0.00 1.20 0.00 0.00 173.24 175.45 1dk5 n TYR 164 N 2.97 2.84 -1.57 3.44 9.36 -1.26 -5.00 117.16 127.94 1dk5 n TYR 164 Ca 0.06 -4.05 -0.40 0.00 3.32 0.00 0.00 57.90 56.83 1dk5 n TYR 164 Cb 0.45 -0.51 0.02 0.00 -0.63 0.00 0.00 39.34 38.67 1dk5 n TYR 164 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1dk5 n ARG 165 N 1.07 1.00 -1.84 2.98 1.74 -1.26 -4.97 116.66 115.39 1dk5 n ARG 165 Ca 0.28 0.37 -0.38 0.00 -0.77 0.00 0.00 57.85 57.34 1dk5 n ARG 165 Cb 0.43 -1.94 0.04 0.00 -1.02 0.00 0.00 32.46 29.96 1dk5 n ARG 165 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1dk5 s TYR 166 N -1.43 2.35 -0.15 -1.55 6.14 -1.26 -4.77 117.35 116.67 1dk5 s TYR 166 Ca 0.67 1.39 0.01 0.00 0.64 0.00 0.00 57.07 59.79 1dk5 s TYR 166 Cb -0.51 -3.75 0.03 0.00 0.42 0.00 0.00 41.96 38.14 1dk5 s TYR 166 CO 0.54 -2.75 0.80 0.41 0.64 0.00 0.00 175.55 175.19 1dk5 n GLY 167 N 0.69 0.87 3.15 8.97 0.00 -1.26 -4.36 105.19 113.26 1dk5 n GLY 167 Ca 0.10 -0.05 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 1dk5 n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dk5 n GLY 168 N -0.15 -2.85 0.00 -0.02 0.00 -1.26 -4.98 105.19 95.93 1dk5 n GLY 168 Ca 0.01 -1.47 0.09 0.00 0.00 0.00 0.00 46.02 44.65 1dk5 n GLY 168 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1dk5 n GLU 169 N -4.62 0.93 -1.64 1.61 -0.58 -1.26 -4.59 120.64 110.49 1dk5 n GLU 169 Ca 0.14 -0.06 -0.51 0.00 -0.42 0.00 0.00 57.16 56.31 1dk5 n GLU 169 Cb 0.54 -1.37 -0.05 0.00 -0.57 0.00 0.00 31.44 29.98 1dk5 n GLU 169 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 1dk5 n GLU 170 N -1.67 1.53 -3.63 3.49 0.00 -1.26 -4.79 120.64 114.31 1dk5 n GLU 170 Ca 0.01 0.55 -0.22 0.00 0.00 0.00 0.00 57.16 57.51 1dk5 n GLU 170 Cb 0.35 -2.26 -0.03 0.00 0.00 0.00 0.00 31.44 29.50 1dk5 n GLU 170 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.13 177.27 1dk5 s VAL 171 N 1.24 2.54 -0.47 3.84 -7.23 -1.26 -4.64 120.40 114.42 1dk5 s VAL 171 Ca 0.85 -1.38 0.03 0.00 -1.81 0.00 0.00 61.98 59.67 1dk5 s VAL 171 Cb -0.86 -2.92 0.16 0.00 0.56 0.00 0.00 36.38 33.32 1dk5 s VAL 171 CO 0.47 0.00 0.34 -0.62 -0.31 0.00 0.00 175.10 174.97 1dk5 s ASP 172 N -4.13 2.77 0.41 4.85 2.15 -1.26 -5.00 116.67 116.46 1dk5 s ASP 172 Ca 0.47 -3.05 0.19 0.00 0.43 0.00 0.00 52.55 50.59 1dk5 s ASP 172 Cb -0.02 -0.80 1.12 0.00 -0.30 0.00 0.00 42.92 42.91 1dk5 s ASP 172 CO 0.27 -0.19 1.80 -0.07 -0.17 0.00 0.00 175.17 176.82 1dk5 h LEU 173 N 5.96 0.41 0.72 -1.34 3.38 -1.98 0.21 115.31 122.67 1dk5 h LEU 173 Ca 0.16 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 1dk5 h LEU 173 Cb 0.89 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.64 1dk5 h LEU 173 CO 0.45 0.11 -0.34 0.03 0.09 0.00 0.00 178.44 178.78 1dk5 h ARG 174 N 0.38 -0.93 -0.89 1.13 3.08 -2.00 -0.64 114.38 114.51 1dk5 h ARG 174 Ca 0.55 0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.72 1dk5 h ARG 174 Cb 1.43 0.21 -0.06 0.00 0.08 0.00 0.00 29.97 31.63 1dk5 h ARG 174 CO -0.24 -0.60 0.58 1.25 -1.07 0.00 0.00 179.97 179.89 1dk5 h LEU 175 N -1.03 0.90 -1.91 3.04 5.85 -1.64 -0.91 115.31 119.60 1dk5 h LEU 175 Ca -0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1dk5 h LEU 175 Cb 0.75 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 1dk5 h LEU 175 CO 0.16 0.59 0.05 0.00 -0.34 0.00 0.00 178.44 178.90 1dk5 h ALA 176 N 1.51 1.94 -0.01 1.25 0.00 -0.24 -0.02 119.26 123.69 1dk5 h ALA 176 Ca 0.38 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.28 1dk5 h ALA 176 Cb 0.16 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1dk5 h ALA 176 CO -0.13 0.06 -0.00 -0.22 0.00 0.00 0.00 179.25 178.95 1dk5 h LYS 177 N 0.11 0.01 0.05 0.00 3.64 0.33 -2.27 116.57 118.44 1dk5 h LYS 177 Ca 0.03 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1dk5 h LYS 177 Cb -0.01 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1dk5 h LYS 177 CO -0.01 0.42 -0.02 0.00 -2.27 0.00 0.00 179.45 177.57 1dk5 h ALA 178 N 0.60 -0.06 -0.71 5.00 0.00 -1.31 -3.01 119.26 119.76 1dk5 h ALA 178 Ca 0.00 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.82 1dk5 h ALA 178 Cb 0.41 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1dk5 h ALA 178 CO 0.00 -0.38 0.47 0.93 0.00 0.00 0.00 179.25 180.27 1dk5 h GLU 179 N -0.38 0.71 -0.38 0.00 5.08 -1.09 0.87 114.58 119.40 1dk5 h GLU 179 Ca -0.01 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1dk5 h GLU 179 Cb 0.34 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1dk5 h GLU 179 CO 0.01 0.47 0.25 1.03 -1.00 0.00 0.00 179.01 179.77 1dk5 h SER 180 N 0.73 0.40 -0.02 1.42 0.87 -1.27 -1.92 113.55 113.76 1dk5 h SER 180 Ca 0.31 -0.01 -0.17 0.00 -1.23 0.00 0.00 61.79 60.69 1dk5 h SER 180 Cb 0.27 -0.10 0.01 0.00 -0.44 0.00 0.00 62.40 62.15 1dk5 h SER 180 CO -0.10 0.29 -0.66 0.11 -0.53 0.00 0.00 176.83 175.93 1dk5 h LYS 181 N 0.47 0.49 -0.45 2.24 1.57 -0.79 -2.30 116.57 117.81 1dk5 h LYS 181 Ca 0.14 -0.50 0.09 0.00 -1.87 0.00 0.00 60.65 58.52 1dk5 h LYS 181 Cb -0.00 0.13 -0.09 0.00 0.08 0.00 0.00 32.23 32.36 1dk5 h LYS 181 CO -0.03 1.14 -0.14 0.82 -0.57 0.00 0.00 179.45 180.67 1dk5 h ILE 182 N 0.04 0.50 0.02 1.86 2.04 -0.81 0.06 117.51 121.22 1dk5 h ILE 182 Ca -0.08 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.81 1dk5 h ILE 182 Cb 1.35 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 37.88 1dk5 h ILE 182 CO 0.13 0.00 -0.43 -0.07 0.00 0.00 0.00 178.15 177.78 1dk5 h LEU 183 N -0.03 -1.31 0.00 1.44 3.38 -1.41 -0.69 115.31 116.69 1dk5 h LEU 183 Ca 0.22 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1dk5 h LEU 183 Cb 0.36 0.51 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1dk5 h LEU 183 CO -0.48 -0.47 0.00 1.57 0.09 0.00 0.00 178.44 179.15 1dk5 n HIS 184 N -5.46 0.00 -0.36 1.13 -0.00 -0.15 -0.00 115.22 110.38 1dk5 n HIS 184 Ca -0.06 0.00 0.29 0.00 0.46 0.00 0.00 57.72 58.41 1dk5 n HIS 184 Cb 0.38 -0.26 0.55 0.00 -0.12 0.00 0.00 29.99 30.53 1dk5 n HIS 184 CO 0.00 0.00 0.00 1.05 0.46 0.00 0.00 176.34 177.85 1dk5 h GLU 185 N 0.00 0.20 -0.39 1.57 4.11 -1.11 0.86 114.58 119.82 1dk5 h GLU 185 Ca 0.00 -0.01 -0.15 0.00 0.07 0.00 0.00 59.36 59.27 1dk5 h GLU 185 Cb 0.00 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1dk5 h GLU 185 CO 0.00 0.13 -0.34 0.87 0.07 0.00 0.00 179.01 179.74 1dk5 h LYS 186 N 0.21 0.93 -0.04 1.06 1.79 -0.38 -0.99 116.57 119.15 1dk5 h LYS 186 Ca 0.77 -0.47 -0.00 0.00 -2.18 0.00 0.00 60.65 58.76 1dk5 h LYS 186 Cb 2.02 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 32.68 1dk5 h LYS 186 CO -0.54 1.13 0.02 0.82 -1.08 0.00 0.00 179.45 179.80 1dk5 h ILE 187 N 0.75 1.06 -0.04 1.86 1.08 0.45 -0.87 117.51 121.79 1dk5 h ILE 187 Ca 0.07 -0.17 -0.01 0.00 -0.39 0.00 0.00 64.86 64.35 1dk5 h ILE 187 Cb 0.94 1.10 -0.00 0.00 -3.07 0.00 0.00 36.82 35.78 1dk5 h ILE 187 CO 0.09 0.05 -0.04 -1.28 -0.69 0.00 0.00 178.15 176.28 1dk5 h SER 188 N -0.00 0.05 -0.01 1.72 0.87 -0.97 -0.53 113.55 114.67 1dk5 h SER 188 Ca 0.01 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1dk5 h SER 188 Cb 0.06 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1dk5 h SER 188 CO -0.00 0.11 0.00 0.47 -0.53 0.00 0.00 176.83 176.88 1dk5 n ASP 189 N -4.45 0.24 -0.82 6.23 10.43 -0.38 -4.84 116.55 122.96 1dk5 n ASP 189 Ca -0.02 -1.28 -0.11 0.00 2.57 0.00 0.00 54.79 55.95 1dk5 n ASP 189 Cb 0.15 -0.01 -0.05 0.00 1.84 0.00 0.00 41.12 43.05 1dk5 n ASP 189 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1dk5 n LYS 190 N -0.71 -1.15 -2.46 -1.24 4.76 -0.21 -4.86 118.16 112.29 1dk5 n LYS 190 Ca 0.19 0.84 -0.43 0.00 -2.87 0.00 0.00 58.31 56.03 1dk5 n LYS 190 Cb 0.13 -4.95 0.00 0.00 -1.84 0.00 0.00 35.03 28.37 1dk5 n LYS 190 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1dk5 n ALA 191 N 1.20 5.10 -0.12 7.82 0.00 -0.36 -4.74 120.51 129.41 1dk5 n ALA 191 Ca -0.11 -4.31 -0.13 0.00 0.00 0.00 0.00 53.44 48.89 1dk5 n ALA 191 Cb 0.45 -2.98 -0.03 0.00 0.00 0.00 0.00 19.45 16.90 1dk5 n ALA 191 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1dk5 h TYR 192 N 5.98 1.02 -0.79 0.00 0.05 -1.88 -3.13 116.97 118.23 1dk5 h TYR 192 Ca 0.38 -0.29 -0.27 0.00 0.05 0.00 0.00 58.73 58.59 1dk5 h TYR 192 Cb 0.67 -0.22 -0.16 0.00 1.01 0.00 0.00 36.73 38.03 1dk5 h TYR 192 CO 1.22 1.09 0.34 -1.13 -1.05 0.00 0.00 178.16 178.64 1dk5 n SER 193 N -4.15 4.67 -4.76 3.88 3.41 -1.26 -4.73 113.62 110.68 1dk5 n SER 193 Ca -0.02 -3.28 -0.41 0.00 -0.26 0.00 0.00 58.87 54.90 1dk5 n SER 193 Cb 0.50 -0.77 -0.02 0.00 -0.26 0.00 0.00 64.21 63.66 1dk5 n SER 193 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1dk5 s ASP 194 N -1.03 6.84 0.47 4.04 2.15 -1.18 -4.79 116.67 123.17 1dk5 s ASP 194 Ca 0.55 2.61 0.36 0.00 0.43 0.00 0.00 52.55 56.50 1dk5 s ASP 194 Cb 0.45 -2.64 1.53 0.00 -0.30 0.00 0.00 42.92 41.95 1dk5 s ASP 194 CO 0.13 -0.49 1.61 0.44 -0.17 0.00 0.00 175.17 176.69 1dk5 h ASP 195 N 3.69 0.16 0.79 -0.34 3.32 -1.93 1.15 116.42 123.26 1dk5 h ASP 195 Ca -0.48 0.10 -0.17 0.00 0.02 0.00 0.00 57.03 56.50 1dk5 h ASP 195 Cb 1.22 0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.85 1dk5 h ASP 195 CO 0.67 -0.15 -0.82 -0.33 -1.72 0.00 0.00 179.24 176.89 1dk5 h GLU 196 N 0.04 0.02 -0.13 3.56 4.39 -1.97 0.80 114.58 121.31 1dk5 h GLU 196 Ca 0.86 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 60.49 1dk5 h GLU 196 Cb 2.94 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 31.59 1dk5 h GLU 196 CO -0.31 0.83 -0.08 0.28 -1.16 0.00 0.00 179.01 178.57 1dk5 h VAL 197 N 0.01 1.33 0.16 3.13 2.07 0.10 -2.28 116.25 120.77 1dk5 h VAL 197 Ca -0.01 -1.15 -0.01 0.00 0.82 0.00 0.00 66.70 66.35 1dk5 h VAL 197 Cb 1.45 1.82 0.00 0.00 -1.52 0.00 0.00 31.29 33.04 1dk5 h VAL 197 CO 0.11 0.33 -0.08 0.40 0.02 0.00 0.00 177.57 178.36 1dk5 h ILE 198 N -0.09 0.94 -0.65 4.57 2.04 -1.42 -2.28 117.51 120.63 1dk5 h ILE 198 Ca 0.03 -0.43 0.11 0.00 1.00 0.00 0.00 64.86 65.57 1dk5 h ILE 198 Cb 0.56 1.21 -0.08 0.00 -0.74 0.00 0.00 36.82 37.76 1dk5 h ILE 198 CO 0.02 0.10 0.22 -0.09 0.00 0.00 0.00 178.15 178.40 1dk5 h ARG 199 N -0.42 0.36 -0.34 2.37 2.43 -0.88 0.12 114.38 118.03 1dk5 h ARG 199 Ca -0.02 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.02 1dk5 h ARG 199 Cb 0.33 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1dk5 h ARG 199 CO 0.04 0.24 -0.19 0.82 -1.51 0.00 0.00 179.97 179.37 1dk5 h ILE 200 N 0.37 1.29 0.00 1.20 2.04 -1.41 -1.86 117.51 119.14 1dk5 h ILE 200 Ca 0.34 -1.31 -0.10 0.00 1.00 0.00 0.00 64.86 64.79 1dk5 h ILE 200 Cb 0.47 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 1dk5 h ILE 200 CO -0.36 0.43 -0.46 -0.07 0.00 0.00 0.00 178.15 177.68 1dk5 h LEU 201 N 0.50 0.00 0.00 1.44 3.38 -0.83 -3.28 115.31 116.51 1dk5 h LEU 201 Ca 0.07 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 1dk5 h LEU 201 Cb 0.73 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1dk5 h LEU 201 CO 0.05 0.46 -2.00 0.00 0.09 0.00 0.00 178.44 177.04 1dk5 n ALA 202 N -2.35 2.30 -0.12 1.53 0.00 0.38 -4.73 120.51 117.51 1dk5 n ALA 202 Ca -0.01 -0.76 -0.17 0.00 0.00 0.00 0.00 53.44 52.50 1dk5 n ALA 202 Cb 0.54 -0.62 -0.12 0.00 0.00 0.00 0.00 19.45 19.25 1dk5 n ALA 202 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1dk5 n THR 203 N -2.50 1.49 -1.34 0.00 -2.24 -0.70 -4.78 114.28 104.21 1dk5 n THR 203 Ca -0.13 -0.60 -0.34 0.00 -2.27 0.00 0.00 64.05 60.71 1dk5 n THR 203 Cb 0.78 -1.32 0.10 0.00 -2.10 0.00 0.00 70.33 67.79 1dk5 n THR 203 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1dk5 s ARG 204 N -2.52 2.02 1.04 -0.78 1.81 -1.24 -4.64 118.95 114.65 1dk5 s ARG 204 Ca -0.32 1.69 -0.12 0.00 -1.72 0.00 0.00 55.73 55.26 1dk5 s ARG 204 Cb 0.09 -1.83 0.22 0.00 -0.45 0.00 0.00 34.95 32.97 1dk5 s ARG 204 CO 0.63 -1.91 1.08 -1.54 -0.68 0.00 0.00 175.30 172.87 1dk5 s SER 205 N -2.20 1.99 0.11 0.23 1.04 -1.26 -4.75 113.70 108.86 1dk5 s SER 205 Ca 0.72 1.73 -0.18 0.00 0.48 0.00 0.00 55.95 58.70 1dk5 s SER 205 Cb -0.27 -2.37 -0.05 0.00 0.10 0.00 0.00 66.02 63.43 1dk5 s SER 205 CO 0.47 -3.61 1.67 0.11 0.98 0.00 0.00 173.24 172.87 1dk5 h LYS 206 N -2.21 0.41 0.18 4.02 1.79 -1.89 0.33 116.57 119.19 1dk5 h LYS 206 Ca -0.54 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 57.87 1dk5 h LYS 206 Cb 1.30 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.86 1dk5 h LYS 206 CO 0.48 0.42 -0.32 0.00 -1.08 0.00 0.00 179.45 178.94 1dk5 h ALA 207 N 0.98 -0.90 -1.00 3.86 0.00 -1.90 -1.62 119.26 118.67 1dk5 h ALA 207 Ca 0.10 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 55.07 1dk5 h ALA 207 Cb 0.15 0.66 -0.09 0.00 0.00 0.00 0.00 17.79 18.50 1dk5 h ALA 207 CO -0.01 -0.96 0.62 0.37 0.00 0.00 0.00 179.25 179.27 1dk5 h GLN 208 N -0.54 0.86 0.00 0.00 5.75 -1.79 0.97 115.11 120.35 1dk5 h GLN 208 Ca -0.02 -0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.41 1dk5 h GLN 208 Cb 0.50 -0.19 -0.00 0.00 1.07 0.00 0.00 27.48 28.86 1dk5 h GLN 208 CO -0.12 0.57 -0.09 1.25 -2.65 0.00 0.00 178.83 177.78 1dk5 h LEU 209 N 0.88 0.00 0.05 -2.39 5.85 -0.64 -1.23 115.31 117.83 1dk5 h LEU 209 Ca 0.53 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.98 1dk5 h LEU 209 Cb 0.68 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 1dk5 h LEU 209 CO -0.31 0.09 -1.40 -1.13 -0.34 0.00 0.00 178.44 175.34 1dk5 h ASN 210 N 0.00 0.15 -0.58 1.25 -1.24 0.19 -2.94 115.58 112.42 1dk5 h ASN 210 Ca -0.00 -0.22 -0.10 0.00 0.71 0.00 0.00 56.30 56.70 1dk5 h ASN 210 Cb 0.19 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.17 1dk5 h ASN 210 CO 0.01 1.18 -0.02 0.00 -1.29 0.00 0.00 177.43 177.31 1dk5 h ALA 211 N 0.80 0.78 -0.84 1.57 0.00 -1.05 -2.72 119.26 117.79 1dk5 h ALA 211 Ca -0.18 -0.31 0.06 0.00 0.00 0.00 0.00 54.91 54.48 1dk5 h ALA 211 Cb 1.93 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 19.46 1dk5 h ALA 211 CO 0.13 0.63 0.55 1.15 0.00 0.00 0.00 179.25 181.71 1dk5 h THR 212 N 0.92 1.06 0.00 0.00 2.02 -1.23 -2.71 112.91 112.98 1dk5 h THR 212 Ca 0.16 -0.32 -0.10 0.00 0.77 0.00 0.00 66.41 66.92 1dk5 h THR 212 Cb 0.57 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 1dk5 h THR 212 CO 0.03 0.17 -0.67 -0.07 0.37 0.00 0.00 175.52 175.36 1dk5 h LEU 213 N 0.94 0.00 0.50 2.58 3.38 -1.31 -2.82 115.31 118.58 1dk5 h LEU 213 Ca 0.36 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.30 1dk5 h LEU 213 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1dk5 h LEU 213 CO -0.13 0.44 -0.24 0.78 0.09 0.00 0.00 178.44 179.39 1dk5 h ASN 214 N 0.00 -0.56 -0.94 -0.43 -0.26 -1.26 -1.16 115.58 110.96 1dk5 h ASN 214 Ca -0.04 0.02 0.27 0.00 -0.56 0.00 0.00 56.30 55.99 1dk5 h ASN 214 Cb 1.37 0.15 -0.04 0.00 -1.06 0.00 0.00 38.32 38.74 1dk5 h ASN 214 CO 0.05 -0.15 0.80 -0.74 -1.06 0.00 0.00 177.43 176.33 1dk5 h HIS 215 N -1.18 0.00 0.18 1.19 2.76 -1.61 0.46 115.15 116.95 1dk5 h HIS 215 Ca -0.07 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.09 1dk5 h HIS 215 Cb 0.51 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.48 1dk5 h HIS 215 CO 0.00 0.00 -0.08 -0.92 -1.30 0.00 0.00 177.93 175.63 1dk5 h TYR 216 N 0.00 -0.22 -0.27 5.26 3.20 -1.22 -3.30 116.97 120.42 1dk5 h TYR 216 Ca 0.45 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.33 1dk5 h TYR 216 Cb 2.03 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 40.36 1dk5 h TYR 216 CO 0.00 0.18 0.18 1.57 -1.64 0.00 0.00 178.16 178.45 1dk5 h LYS 217 N -0.71 0.27 0.00 1.82 2.10 0.12 -2.73 116.57 117.44 1dk5 h LYS 217 Ca -0.02 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 1dk5 h LYS 217 Cb 0.50 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.77 1dk5 h LYS 217 CO 0.04 0.18 0.00 -0.25 -2.00 0.00 0.00 179.45 177.42 1dk5 n ASP 218 N -4.50 0.00 0.00 7.07 8.00 -0.55 -1.48 116.55 125.09 1dk5 n ASP 218 Ca 0.02 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.62 1dk5 n ASP 218 Cb 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 1dk5 n ASP 218 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1dk5 n GLU 219 N -0.19 0.00 -0.24 -1.24 -0.58 -1.24 0.16 120.64 117.30 1dk5 n GLU 219 Ca 0.00 0.04 0.30 0.00 -0.42 0.00 0.00 57.16 57.08 1dk5 n GLU 219 Cb 0.00 -0.43 0.49 0.00 -0.57 0.00 0.00 31.44 30.93 1dk5 n GLU 219 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1dk5 h HIS 220 N 0.00 0.00 0.00 -0.32 3.86 -1.71 -3.46 115.15 113.52 1dk5 h HIS 220 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1dk5 h HIS 220 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1dk5 h HIS 220 CO 0.00 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.20 1dk5 n GLY 221 N -1.73 1.99 3.92 2.45 0.00 0.12 -5.02 105.19 106.93 1dk5 n GLY 221 Ca 0.24 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 45.33 1dk5 n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dk5 s GLU 222 N 0.00 2.38 0.50 1.61 2.02 -1.24 -4.55 118.70 119.41 1dk5 s GLU 222 Ca 0.00 -0.12 -0.18 0.00 0.02 0.00 0.00 54.97 54.69 1dk5 s GLU 222 Cb 0.00 -2.16 -0.08 0.00 0.10 0.00 0.00 34.13 31.99 1dk5 s GLU 222 CO 0.00 -1.14 1.00 0.34 0.02 0.00 0.00 175.26 175.48 1dk5 s ASP 223 N -4.47 6.49 0.48 -0.19 2.15 -1.26 -3.94 116.67 115.93 1dk5 s ASP 223 Ca 0.59 1.73 0.25 0.00 0.43 0.00 0.00 52.55 55.54 1dk5 s ASP 223 Cb -0.11 -2.53 1.29 0.00 -0.30 0.00 0.00 42.92 41.26 1dk5 s ASP 223 CO 0.46 -0.68 1.86 -0.29 -0.17 0.00 0.00 175.17 176.35 1dk5 h ILE 224 N 1.25 0.60 -0.10 4.11 6.09 -1.93 -0.72 117.51 126.81 1dk5 h ILE 224 Ca -0.48 -0.07 -0.03 0.00 -1.37 0.00 0.00 64.86 62.91 1dk5 h ILE 224 Cb 1.20 0.38 -0.01 0.00 0.47 0.00 0.00 36.82 38.86 1dk5 h ILE 224 CO 0.60 0.04 -0.08 -0.07 -3.07 0.00 0.00 178.15 175.57 1dk5 h LEU 225 N 0.20 0.13 -2.67 2.19 3.38 -1.96 -2.41 115.31 114.18 1dk5 h LEU 225 Ca 0.46 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.41 1dk5 h LEU 225 Cb 1.48 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.19 1dk5 h LEU 225 CO -0.11 0.23 0.00 0.11 0.09 0.00 0.00 178.44 178.77 1dk5 h LYS 226 N 0.14 0.00 -0.05 1.13 1.79 -1.49 -2.05 116.57 116.04 1dk5 h LYS 226 Ca 0.03 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1dk5 h LYS 226 Cb 0.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.88 1dk5 h LYS 226 CO 0.01 0.00 0.00 1.04 -1.08 0.00 0.00 179.45 179.42 1dk5 n GLN 227 N -3.01 1.87 -1.09 3.15 6.02 -0.91 -4.32 117.38 119.08 1dk5 n GLN 227 Ca -0.02 -1.75 -0.04 0.00 -0.01 0.00 0.00 57.00 55.17 1dk5 n GLN 227 Cb 0.10 -1.39 0.14 0.00 1.02 0.00 0.00 30.24 30.11 1dk5 n GLN 227 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1dk5 n LEU 228 N 1.15 3.49 0.00 1.08 4.77 -0.77 -4.95 117.00 121.77 1dk5 n LEU 228 Ca 0.12 -4.20 0.00 0.00 -0.03 0.00 0.00 56.01 51.90 1dk5 n LEU 228 Cb 0.51 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1dk5 n LEU 228 CO 0.13 1.65 0.10 -0.62 -1.33 0.00 0.00 177.39 177.32 1dk5 n GLU 229 N -0.98 0.00 0.00 3.23 1.02 -1.21 -4.78 120.64 117.92 1dk5 n GLU 229 Ca 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 1dk5 n GLU 229 Cb 0.79 -0.70 0.00 0.00 -0.02 0.00 0.00 31.44 31.51 1dk5 n GLU 229 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1dk5 n ASP 230 N -0.21 0.00 -0.35 1.62 2.03 -1.26 -4.85 116.55 113.53 1dk5 n ASP 230 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1dk5 n ASP 230 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1dk5 n ASP 230 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1dk5 n GLY 231 N 1.52 0.16 0.00 0.27 0.00 -1.26 -4.45 105.19 101.43 1dk5 n GLY 231 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1dk5 n GLY 231 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1dk5 n ASP 232 N -3.21 0.00 -0.02 1.61 3.85 -1.26 -4.89 116.55 112.64 1dk5 n ASP 232 Ca 0.00 -0.14 -0.12 0.00 -0.71 0.00 0.00 54.79 53.82 1dk5 n ASP 232 Cb 0.00 0.00 -0.06 0.00 -1.35 0.00 0.00 41.12 39.71 1dk5 n ASP 232 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1dk5 h GLU 233 N 0.00 0.15 -0.95 0.11 4.81 -1.99 -2.26 114.58 114.45 1dk5 h GLU 233 Ca 0.00 -0.03 0.16 0.00 -0.13 0.00 0.00 59.36 59.36 1dk5 h GLU 233 Cb 0.00 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.28 1dk5 h GLU 233 CO 0.00 0.28 0.60 0.35 -0.73 0.00 0.00 179.01 179.51 1dk5 h PHE 234 N -0.02 0.91 -0.18 0.92 3.57 -1.97 1.05 116.94 121.22 1dk5 h PHE 234 Ca 0.03 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.40 1dk5 h PHE 234 Cb 0.20 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.64 1dk5 h PHE 234 CO -0.01 0.29 -0.53 0.28 -2.23 0.00 0.00 178.31 176.11 1dk5 h VAL 235 N 0.73 1.32 -0.34 1.41 2.07 -1.83 -0.32 116.25 119.30 1dk5 h VAL 235 Ca 0.50 -1.78 -0.14 0.00 0.82 0.00 0.00 66.70 66.10 1dk5 h VAL 235 Cb 0.79 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 1dk5 h VAL 235 CO -0.26 0.55 -0.34 0.00 0.02 0.00 0.00 177.57 177.54 1dk5 h ALA 236 N 1.01 0.76 -0.24 1.67 0.00 0.22 0.28 119.26 122.97 1dk5 h ALA 236 Ca 0.01 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 1dk5 h ALA 236 Cb 1.07 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1dk5 h ALA 236 CO 0.10 0.65 -0.11 -0.07 0.00 0.00 0.00 179.25 179.83 1dk5 h LEU 237 N 0.64 0.37 -0.09 0.00 3.38 0.14 0.04 115.31 119.78 1dk5 h LEU 237 Ca 0.06 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1dk5 h LEU 237 Cb 0.88 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 1dk5 h LEU 237 CO 0.08 0.51 -0.00 -0.07 0.09 0.00 0.00 178.44 179.04 1dk5 h LEU 238 N 0.36 0.17 -1.22 1.67 3.38 -0.45 -1.05 115.31 118.17 1dk5 h LEU 238 Ca 0.07 -0.32 0.16 0.00 0.09 0.00 0.00 57.88 57.87 1dk5 h LEU 238 Cb 0.41 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.04 1dk5 h LEU 238 CO 0.02 0.45 0.59 -0.09 0.09 0.00 0.00 178.44 179.51 1dk5 h ARG 239 N -0.12 0.70 -0.13 1.13 2.43 -0.23 -0.74 114.38 117.42 1dk5 h ARG 239 Ca 0.03 -0.04 -0.23 0.00 -0.81 0.00 0.00 59.98 58.93 1dk5 h ARG 239 Cb 0.37 -0.16 0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1dk5 h ARG 239 CO 0.01 0.46 -0.82 0.00 -1.51 0.00 0.00 179.97 178.11 1dk5 h ALA 240 N 1.60 0.30 0.05 2.80 0.00 -0.58 -2.96 119.26 120.46 1dk5 h ALA 240 Ca 0.48 -0.62 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1dk5 h ALA 240 Cb 0.77 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1dk5 h ALA 240 CO -0.24 0.69 -0.03 1.15 0.00 0.00 0.00 179.25 180.82 1dk5 h THR 241 N 0.51 0.94 0.16 0.00 2.02 -0.13 0.13 112.91 116.55 1dk5 h THR 241 Ca -0.06 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.13 1dk5 h THR 241 Cb 1.45 0.94 -0.03 0.00 -1.74 0.00 0.00 68.15 68.77 1dk5 h THR 241 CO 0.17 0.00 -0.25 0.40 0.37 0.00 0.00 175.52 176.20 1dk5 h ILE 242 N -0.07 0.45 0.05 3.11 1.08 -1.22 -1.59 117.51 119.32 1dk5 h ILE 242 Ca -0.01 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.47 1dk5 h ILE 242 Cb 0.06 0.45 -0.01 0.00 -3.07 0.00 0.00 36.82 34.24 1dk5 h ILE 242 CO 0.01 0.00 -0.08 0.11 -0.69 0.00 0.00 178.15 177.50 1dk5 h LYS 243 N -0.49 -0.15 -0.56 2.37 1.57 -1.42 0.07 116.57 117.97 1dk5 h LYS 243 Ca 0.02 0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.91 1dk5 h LYS 243 Cb 0.49 0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.75 1dk5 h LYS 243 CO -0.12 -0.10 0.08 0.78 -0.57 0.00 0.00 179.45 179.52 1dk5 h GLY 244 N -0.16 0.67 1.12 3.86 0.00 -0.50 0.73 103.07 108.78 1dk5 h GLY 244 Ca 0.01 0.01 -0.20 0.00 0.00 0.00 0.00 47.33 47.15 1dk5 h GLY 244 CO -0.04 -0.12 -0.67 1.41 0.00 0.00 0.00 176.54 177.12 1dk5 h LEU 245 N 0.20 0.91 0.00 3.11 3.38 -1.17 -3.32 115.31 118.42 1dk5 h LEU 245 Ca 0.29 -0.60 -0.27 0.00 0.09 0.00 0.00 57.88 57.39 1dk5 h LEU 245 Cb 0.43 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 1dk5 h LEU 245 CO -0.41 1.36 -2.02 0.52 0.09 0.00 0.00 178.44 177.98 1dk5 n VAL 246 N -4.01 1.03 -3.07 1.22 0.31 0.00 -4.77 118.33 109.04 1dk5 n VAL 246 Ca -0.07 -0.42 -0.26 0.00 -0.01 0.00 0.00 64.34 63.57 1dk5 n VAL 246 Cb 0.69 -1.07 -0.05 0.00 -0.91 0.00 0.00 33.84 32.50 1dk5 n VAL 246 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1dk5 n TYR 247 N -2.96 3.68 0.31 3.52 4.01 0.25 -4.92 117.16 121.04 1dk5 n TYR 247 Ca -0.31 -4.02 0.19 0.00 -0.16 0.00 0.00 57.90 53.61 1dk5 n TYR 247 Cb 0.86 -0.50 1.03 0.00 -0.31 0.00 0.00 39.34 40.41 1dk5 n TYR 247 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1dk5 h PRO 248 N 3.26 0.00 0.00 -0.72 0.13 -1.48 -2.63 132.00 130.57 1dk5 h PRO 248 Ca 0.14 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1dk5 h PRO 248 Cb 0.57 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.70 1dk5 h PRO 248 CO 0.80 0.00 -0.00 0.93 -0.23 0.00 0.00 178.00 179.50 1dk5 h GLU 249 N 0.00 -0.00 -0.36 0.86 3.07 -1.91 -2.83 114.58 113.41 1dk5 h GLU 249 Ca 0.02 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 58.89 1dk5 h GLU 249 Cb 0.21 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.10 1dk5 h GLU 249 CO -0.00 0.86 0.24 0.45 -1.40 0.00 0.00 179.01 179.16 1dk5 h HIS 250 N -0.97 0.41 0.76 4.33 3.86 -1.91 0.09 115.15 121.71 1dk5 h HIS 250 Ca -0.00 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.18 1dk5 h HIS 250 Cb 0.87 -0.14 0.01 0.00 1.06 0.00 0.00 27.41 29.21 1dk5 h HIS 250 CO 0.24 0.25 -0.36 -0.92 0.86 0.00 0.00 177.93 177.99 1dk5 h TYR 251 N 0.43 -0.94 -0.65 2.45 3.20 -1.51 0.92 116.97 120.86 1dk5 h TYR 251 Ca 0.14 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.99 1dk5 h TYR 251 Cb 0.02 0.31 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 1dk5 h TYR 251 CO -0.00 -0.58 0.43 0.74 -1.64 0.00 0.00 178.16 177.10 1dk5 h PHE 252 N -1.03 0.83 -0.39 -3.82 0.04 -1.22 -0.50 116.94 110.85 1dk5 h PHE 252 Ca -0.10 0.02 -0.14 0.00 2.80 0.00 0.00 57.97 60.54 1dk5 h PHE 252 Cb 0.78 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.64 1dk5 h PHE 252 CO -0.02 0.53 -0.31 0.28 -0.60 0.00 0.00 178.31 178.19 1dk5 h VAL 253 N 0.89 1.27 -0.08 -0.55 2.07 -0.73 0.24 116.25 119.36 1dk5 h VAL 253 Ca 0.24 -1.47 -0.04 0.00 0.82 0.00 0.00 66.70 66.25 1dk5 h VAL 253 Cb -0.09 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1dk5 h VAL 253 CO -0.05 0.49 -0.14 -0.33 0.02 0.00 0.00 177.57 177.56 1dk5 h GLU 254 N 0.73 0.12 -0.13 1.57 5.08 -0.03 0.04 114.58 121.96 1dk5 h GLU 254 Ca 0.08 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.36 1dk5 h GLU 254 Cb 0.87 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.10 1dk5 h GLU 254 CO 0.08 0.27 -0.14 0.28 -1.00 0.00 0.00 179.01 178.50 1dk5 h VAL 255 N 0.12 1.35 -0.72 3.13 2.07 -0.43 -0.79 116.25 120.98 1dk5 h VAL 255 Ca 0.02 -1.31 0.04 0.00 0.82 0.00 0.00 66.70 66.27 1dk5 h VAL 255 Cb 0.33 1.91 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 1dk5 h VAL 255 CO 0.02 0.38 0.47 -0.07 0.02 0.00 0.00 177.57 178.40 1dk5 h LEU 256 N -0.05 0.74 0.54 2.57 3.38 0.07 -2.31 115.31 120.25 1dk5 h LEU 256 Ca 0.02 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1dk5 h LEU 256 Cb 0.67 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1dk5 h LEU 256 CO 0.03 0.51 -0.30 0.03 0.09 0.00 0.00 178.44 178.81 1dk5 h ARG 257 N 0.86 -0.74 0.00 1.13 2.47 -0.73 -0.41 114.38 116.96 1dk5 h ARG 257 Ca 0.29 0.05 0.00 0.00 -1.26 0.00 0.00 59.98 59.06 1dk5 h ARG 257 Cb 0.07 0.17 0.00 0.00 -1.65 0.00 0.00 29.97 28.56 1dk5 h ARG 257 CO -0.08 -0.49 0.00 -0.25 0.56 0.00 0.00 179.97 179.70 1dk5 n ASP 258 N -4.20 0.00 -0.09 7.04 8.00 -0.33 -2.09 116.55 124.88 1dk5 n ASP 258 Ca -0.09 0.19 -0.10 0.00 0.71 0.00 0.00 54.79 55.49 1dk5 n ASP 258 Cb 0.31 -0.25 -0.12 0.00 -0.02 0.00 0.00 41.12 41.05 1dk5 n ASP 258 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dk5 n ALA 259 N -1.25 1.59 -2.73 2.24 0.00 -0.89 -4.82 120.51 114.66 1dk5 n ALA 259 Ca 0.02 -1.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.10 1dk5 n ALA 259 Cb 0.03 -0.05 -0.07 0.00 0.00 0.00 0.00 19.45 19.36 1dk5 n ALA 259 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1dk5 s ILE 260 N -2.39 5.33 0.25 0.00 1.01 -0.19 -0.84 121.20 124.37 1dk5 s ILE 260 Ca -0.14 0.44 -0.16 0.00 0.00 0.00 0.00 60.65 60.79 1dk5 s ILE 260 Cb 0.05 -3.56 0.01 0.00 0.01 0.00 0.00 42.46 38.97 1dk5 s ILE 260 CO 0.60 0.49 0.55 0.20 0.00 0.00 0.00 174.94 176.77 1dk5 s ASN 261 N -0.16 -0.16 -0.00 3.58 0.02 -1.26 -4.83 114.94 112.13 1dk5 s ASN 261 Ca 0.16 -0.78 -0.24 0.00 -1.02 0.00 0.00 52.86 50.97 1dk5 s ASN 261 Cb -0.13 0.62 -0.17 0.00 0.02 0.00 0.00 41.25 41.60 1dk5 s ASN 261 CO 0.04 -1.19 1.20 0.03 0.02 0.00 0.00 177.10 177.20 1dk5 h ARG 262 N 2.18 -0.34 0.00 -0.60 -0.00 -1.96 -3.43 114.38 110.23 1dk5 h ARG 262 Ca -0.24 0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.26 1dk5 h ARG 262 Cb 1.25 0.08 0.00 0.00 0.00 0.00 0.00 29.97 31.30 1dk5 h ARG 262 CO 0.32 0.00 0.00 -2.13 0.00 0.00 0.00 179.97 178.16 1dk5 n ARG 263 N -5.08 0.00 -3.29 0.04 0.63 -1.26 -4.82 116.66 102.88 1dk5 n ARG 263 Ca -0.09 0.34 -0.46 0.00 -0.92 0.00 0.00 57.85 56.71 1dk5 n ARG 263 Cb 0.26 -0.82 -0.03 0.00 0.45 0.00 0.00 32.46 32.31 1dk5 n ARG 263 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1dk5 s GLY 264 N -1.91 2.38 -0.04 5.14 0.00 -1.26 -5.05 107.32 106.59 1dk5 s GLY 264 Ca 0.00 -2.97 -0.19 0.00 0.00 0.00 0.00 44.72 41.56 1dk5 s GLY 264 CO 0.00 1.30 0.52 -1.59 0.00 0.00 0.00 173.10 173.33 1dk5 s THR 265 N 0.92 5.01 -1.24 0.90 2.01 -1.26 -4.57 115.64 117.41 1dk5 s THR 265 Ca 0.13 1.08 -0.11 0.00 0.31 0.00 0.00 61.69 63.10 1dk5 s THR 265 Cb -0.17 -3.86 0.17 0.00 0.01 0.00 0.00 72.50 68.66 1dk5 s THR 265 CO -0.04 0.42 1.64 -0.62 -0.69 0.00 0.00 174.62 175.33 1dk5 n GLU 266 N 2.85 3.52 -0.19 4.92 -0.58 -0.02 -4.83 120.64 126.30 1dk5 n GLU 266 Ca -0.08 -3.72 0.29 0.00 -0.42 0.00 0.00 57.16 53.22 1dk5 n GLU 266 Cb 0.51 -2.97 0.72 0.00 -0.57 0.00 0.00 31.44 29.14 1dk5 n GLU 266 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1dk5 h GLU 267 N 6.42 0.01 0.17 3.49 3.07 -1.95 -0.54 114.58 125.25 1dk5 h GLU 267 Ca 0.35 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.20 1dk5 h GLU 267 Cb 0.75 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.66 1dk5 h GLU 267 CO 1.43 0.01 -0.08 -0.44 -1.40 0.00 0.00 179.01 178.53 1dk5 h ASP 268 N 0.01 -0.19 -0.37 1.42 3.45 -1.98 0.12 116.42 118.89 1dk5 h ASP 268 Ca 0.43 -0.04 -0.12 0.00 0.43 0.00 0.00 57.03 57.73 1dk5 h ASP 268 Cb 1.72 0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 40.52 1dk5 h ASP 268 CO -0.01 -0.08 -0.20 0.45 -1.57 0.00 0.00 179.24 177.83 1dk5 h HIS 269 N -0.28 0.97 -0.51 4.55 3.86 -1.54 -1.98 115.15 120.23 1dk5 h HIS 269 Ca -0.02 -0.22 -0.01 0.00 -1.16 0.00 0.00 60.37 58.96 1dk5 h HIS 269 Cb 0.22 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.43 1dk5 h HIS 269 CO -0.05 0.98 0.29 1.25 0.86 0.00 0.00 177.93 181.26 1dk5 h LEU 270 N 0.75 0.62 -1.25 2.43 5.85 -1.28 0.34 115.31 122.77 1dk5 h LEU 270 Ca 0.10 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1dk5 h LEU 270 Cb 0.74 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 1dk5 h LEU 270 CO 0.06 0.51 0.34 0.74 -0.34 0.00 0.00 178.44 179.75 1dk5 h THR 271 N 0.68 1.19 0.06 1.05 2.02 -0.83 -1.67 112.91 115.40 1dk5 h THR 271 Ca 0.18 -0.47 -0.00 0.00 0.77 0.00 0.00 66.41 66.89 1dk5 h THR 271 Cb 0.02 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 66.78 1dk5 h THR 271 CO -0.03 0.21 -0.03 -0.09 0.37 0.00 0.00 175.52 175.95 1dk5 h ARG 272 N 0.86 -0.08 0.85 6.66 2.43 -0.52 -0.70 114.38 123.89 1dk5 h ARG 272 Ca 0.22 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.35 1dk5 h ARG 272 Cb 0.02 0.02 0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1dk5 h ARG 272 CO -0.04 0.21 -0.41 0.28 -1.51 0.00 0.00 179.97 178.50 1dk5 h VAL 273 N -0.37 0.08 -0.52 0.20 2.07 -0.83 -1.80 116.25 115.09 1dk5 h VAL 273 Ca -0.01 -0.11 0.10 0.00 0.82 0.00 0.00 66.70 67.51 1dk5 h VAL 273 Cb 0.33 0.09 -0.09 0.00 -1.52 0.00 0.00 31.29 30.09 1dk5 h VAL 273 CO 0.01 0.00 -0.09 0.40 0.02 0.00 0.00 177.57 177.92 1dk5 h ILE 274 N -1.24 0.51 0.14 4.57 1.08 -1.38 -0.85 117.51 120.35 1dk5 h ILE 274 Ca -0.12 -0.01 -0.01 0.00 -0.39 0.00 0.00 64.86 64.33 1dk5 h ILE 274 Cb 0.88 0.48 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 1dk5 h ILE 274 CO 0.19 0.01 -0.07 0.00 -0.69 0.00 0.00 178.15 177.59 1dk5 h ALA 275 N 1.50 -0.19 0.00 1.87 0.00 -1.17 -1.60 119.26 119.66 1dk5 h ALA 275 Ca 0.25 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1dk5 h ALA 275 Cb 0.39 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1dk5 h ALA 275 CO -0.50 -0.42 0.00 0.25 0.00 0.00 0.00 179.25 178.58 1dk5 n THR 276 N -5.01 0.62 0.00 0.00 -2.24 -0.68 -3.31 114.28 103.67 1dk5 n THR 276 Ca -0.09 0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1dk5 n THR 276 Cb 0.23 -0.85 0.00 0.00 -2.10 0.00 0.00 70.33 67.61 1dk5 n THR 276 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1dk5 n ARG 277 N -1.40 4.51 -0.27 -0.78 5.12 -0.35 -4.70 116.66 118.80 1dk5 n ARG 277 Ca 0.06 0.00 0.06 0.00 -1.93 0.00 0.00 57.85 56.05 1dk5 n ARG 277 Cb 0.18 -0.62 0.20 0.00 -1.16 0.00 0.00 32.46 31.06 1dk5 n ARG 277 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1dk5 h ALA 278 N 0.00 1.12 -0.50 7.54 0.00 -1.28 0.33 119.26 126.47 1dk5 h ALA 278 Ca 0.00 0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 1dk5 h ALA 278 Cb 0.00 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 1dk5 h ALA 278 CO 0.00 -0.21 0.15 -0.85 0.00 0.00 0.00 179.25 178.34 1dk5 n GLU 279 N -5.00 3.11 0.03 0.00 0.28 -1.26 -0.85 120.64 116.95 1dk5 n GLU 279 Ca 0.15 -2.17 0.00 0.00 -0.16 0.00 0.00 57.16 54.99 1dk5 n GLU 279 Cb 0.44 -1.97 0.00 0.00 1.43 0.00 0.00 31.44 31.35 1dk5 n GLU 279 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1dk5 n VAL 280 N 0.07 0.05 -1.92 3.84 0.31 0.93 -4.84 118.33 116.77 1dk5 n VAL 280 Ca 0.27 0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.62 1dk5 n VAL 280 Cb 1.05 -0.66 0.00 0.00 -0.91 0.00 0.00 33.84 33.32 1dk5 n VAL 280 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1dk5 n ASP 281 N -2.81 0.00 0.26 4.52 3.85 0.14 -3.69 116.55 118.82 1dk5 n ASP 281 Ca 0.00 -0.92 0.11 0.00 -0.71 0.00 0.00 54.79 53.27 1dk5 n ASP 281 Cb 0.06 0.00 0.71 0.00 -1.35 0.00 0.00 41.12 40.54 1dk5 n ASP 281 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 1dk5 h LEU 282 N 0.00 0.00 -1.46 -2.12 5.85 -1.38 -1.98 115.31 114.23 1dk5 h LEU 282 Ca 0.00 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 1dk5 h LEU 282 Cb 0.92 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 1dk5 h LEU 282 CO 0.00 0.10 -0.27 0.50 -0.34 0.00 0.00 178.44 178.43 1dk5 h LYS 283 N 0.00 0.00 0.02 1.25 3.64 -1.50 0.24 116.57 120.22 1dk5 h LYS 283 Ca -0.00 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.09 1dk5 h LYS 283 Cb 0.25 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 1dk5 h LYS 283 CO 0.01 0.27 -1.61 0.82 -2.27 0.00 0.00 179.45 176.68 1dk5 h ILE 284 N 0.00 0.99 -0.49 2.00 2.04 -1.42 -3.24 117.51 117.38 1dk5 h ILE 284 Ca -0.00 -2.79 -0.11 0.00 1.00 0.00 0.00 64.86 62.95 1dk5 h ILE 284 Cb 0.53 2.52 -0.01 0.00 -0.74 0.00 0.00 36.82 39.12 1dk5 h ILE 284 CO 0.04 0.62 -0.14 0.40 0.00 0.00 0.00 178.15 179.07 1dk5 h ILE 285 N 0.01 1.27 -0.26 -0.67 2.04 -1.01 -2.29 117.51 116.59 1dk5 h ILE 285 Ca -0.25 -1.29 0.06 0.00 1.00 0.00 0.00 64.86 64.38 1dk5 h ILE 285 Cb 1.98 1.07 -0.06 0.00 -0.74 0.00 0.00 36.82 39.07 1dk5 h ILE 285 CO 0.09 0.45 -0.14 0.00 0.00 0.00 0.00 178.15 178.55 1dk5 h ALA 286 N 0.89 0.07 0.38 1.87 0.00 -0.61 -2.11 119.26 119.75 1dk5 h ALA 286 Ca 0.12 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1dk5 h ALA 286 Cb 0.70 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 1dk5 h ALA 286 CO 0.05 -0.54 -0.52 -0.44 0.00 0.00 0.00 179.25 177.80 1dk5 h ASP 287 N -0.10 -1.47 -1.29 0.00 3.32 -1.54 -1.28 116.42 114.07 1dk5 h ASP 287 Ca 0.14 0.13 0.37 0.00 0.02 0.00 0.00 57.03 57.70 1dk5 h ASP 287 Cb 0.32 0.51 -0.08 0.00 0.22 0.00 0.00 39.33 40.30 1dk5 h ASP 287 CO -0.33 -0.64 0.89 -0.33 -1.72 0.00 0.00 179.24 177.11 1dk5 h GLU 288 N -0.93 0.11 0.65 3.56 4.39 -1.08 0.24 114.58 121.52 1dk5 h GLU 288 Ca -0.04 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 1dk5 h GLU 288 Cb 0.84 -0.02 0.01 0.00 -0.10 0.00 0.00 28.75 29.48 1dk5 h GLU 288 CO -0.14 0.07 -0.31 -0.92 -1.16 0.00 0.00 179.01 176.55 1dk5 h TYR 289 N 0.11 -0.81 -0.41 4.33 3.20 -0.59 -3.18 116.97 119.62 1dk5 h TYR 289 Ca 0.67 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.56 1dk5 h TYR 289 Cb 2.35 0.27 -0.05 0.00 1.54 0.00 0.00 36.73 40.84 1dk5 h TYR 289 CO -0.00 -0.51 -0.24 0.94 -1.64 0.00 0.00 178.16 176.71 1dk5 n GLN 290 N -5.09 -0.18 -0.12 1.82 7.27 0.72 -1.51 117.38 120.29 1dk5 n GLN 290 Ca -0.11 1.12 -0.03 0.00 0.07 0.00 0.00 57.00 58.05 1dk5 n GLN 290 Cb 0.35 -1.67 -0.03 0.00 2.41 0.00 0.00 30.24 31.30 1dk5 n GLN 290 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 1dk5 n LYS 291 N -3.91 -0.13 -0.25 3.69 4.81 -0.49 0.30 118.16 122.18 1dk5 n LYS 291 Ca 0.01 0.73 -0.00 0.00 -0.87 0.00 0.00 58.31 58.18 1dk5 n LYS 291 Cb 0.11 -1.08 0.03 0.00 0.02 0.00 0.00 35.03 34.11 1dk5 n LYS 291 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 1dk5 n ARG 292 N -3.66 -0.15 0.00 1.64 3.00 -0.57 -3.18 116.66 113.75 1dk5 n ARG 292 Ca 0.01 1.03 0.00 0.00 -0.00 0.00 0.00 57.85 58.88 1dk5 n ARG 292 Cb 0.08 -1.53 0.00 0.00 0.00 0.00 0.00 32.46 31.01 1dk5 n ARG 292 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1dk5 n ASP 293 N -4.99 0.49 -0.34 6.15 10.43 0.89 -4.99 116.55 124.19 1dk5 n ASP 293 Ca 0.07 -1.15 -0.04 0.00 2.57 0.00 0.00 54.79 56.24 1dk5 n ASP 293 Cb 0.27 0.00 -0.02 0.00 1.84 0.00 0.00 41.12 43.22 1dk5 n ASP 293 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1dk5 n SER 294 N -0.07 -4.81 -4.35 -2.24 7.64 0.89 -4.95 113.62 105.72 1dk5 n SER 294 Ca 0.00 0.11 -0.42 0.00 1.01 0.00 0.00 58.87 59.57 1dk5 n SER 294 Cb 0.27 -2.70 -0.10 0.00 -1.01 0.00 0.00 64.21 60.67 1dk5 n SER 294 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1dk5 s ILE 295 N -1.73 4.68 0.34 0.44 1.01 -1.25 -5.01 121.20 119.68 1dk5 s ILE 295 Ca 0.00 -1.07 -0.27 0.00 0.00 0.00 0.00 60.65 59.31 1dk5 s ILE 295 Cb 0.00 -3.73 -0.12 0.00 0.01 0.00 0.00 42.46 38.61 1dk5 s ILE 295 CO 0.00 -0.41 1.15 -2.65 0.00 0.00 0.00 174.94 173.03 1dk5 n PRO 296 N 5.03 1.75 -0.32 2.79 -0.02 -1.26 -4.26 135.00 138.70 1dk5 n PRO 296 Ca -0.11 0.61 0.10 0.00 -2.02 0.00 0.00 63.50 62.08 1dk5 n PRO 296 Cb 0.45 -2.13 0.27 0.00 -0.02 0.00 0.00 33.50 32.06 1dk5 n PRO 296 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1dk5 h LEU 297 N 2.18 0.64 -0.57 2.45 7.12 -1.94 0.65 115.31 125.84 1dk5 h LEU 297 Ca -0.44 0.10 0.11 0.00 0.13 0.00 0.00 57.88 57.78 1dk5 h LEU 297 Cb 1.31 -0.01 -0.09 0.00 -0.53 0.00 0.00 40.66 41.34 1dk5 h LEU 297 CO 0.61 0.25 0.07 1.23 -0.13 0.00 0.00 178.44 180.47 1dk5 h GLY 298 N 0.69 0.68 0.00 3.75 0.00 -1.96 0.24 103.07 106.47 1dk5 h GLY 298 Ca 0.52 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.86 1dk5 h GLY 298 CO -0.38 -0.14 0.00 0.54 0.00 0.00 0.00 176.54 176.57 1dk5 n ARG 299 N -5.18 0.00 -0.30 4.80 5.12 0.19 -0.74 116.66 120.55 1dk5 n ARG 299 Ca 0.08 0.15 0.27 0.00 -1.93 0.00 0.00 57.85 56.42 1dk5 n ARG 299 Cb 0.31 -1.12 0.46 0.00 -1.16 0.00 0.00 32.46 30.96 1dk5 n ARG 299 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1dk5 n ALA 300 N -0.89 0.89 -0.02 7.54 0.00 -0.98 0.29 120.51 127.34 1dk5 n ALA 300 Ca 0.00 0.66 -0.13 0.00 0.00 0.00 0.00 53.44 53.97 1dk5 n ALA 300 Cb 0.00 -0.75 -0.09 0.00 0.00 0.00 0.00 19.45 18.61 1dk5 n ALA 300 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1dk5 h ILE 301 N 0.00 1.35 0.00 0.00 2.04 -0.35 -2.72 117.51 117.83 1dk5 h ILE 301 Ca 0.62 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1dk5 h ILE 301 Cb 1.89 2.01 0.00 0.00 -0.74 0.00 0.00 36.82 39.98 1dk5 h ILE 301 CO -0.41 0.29 0.00 0.00 0.00 0.00 0.00 178.15 178.03 1dk5 n ALA 302 N -2.34 1.51 0.17 1.87 0.00 0.85 -2.26 120.51 120.31 1dk5 n ALA 302 Ca -0.08 0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.52 1dk5 n ALA 302 Cb 0.25 -1.29 -0.06 0.00 0.00 0.00 0.00 19.45 18.35 1dk5 n ALA 302 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1dk5 n LYS 303 N -1.93 0.55 -2.02 0.00 3.00 -0.15 -4.41 118.16 113.20 1dk5 n LYS 303 Ca 0.02 -0.02 -0.07 0.00 -0.00 0.00 0.00 58.31 58.23 1dk5 n LYS 303 Cb 0.16 -1.66 0.06 0.00 0.00 0.00 0.00 35.03 33.59 1dk5 n LYS 303 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1dk5 n ASP 304 N -2.36 2.69 -3.66 3.14 8.00 -0.96 -5.03 116.55 118.37 1dk5 n ASP 304 Ca -0.01 -2.91 -0.05 0.00 0.71 0.00 0.00 54.79 52.53 1dk5 n ASP 304 Cb 0.53 -0.41 -0.02 0.00 -0.02 0.00 0.00 41.12 41.20 1dk5 n ASP 304 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1dk5 s THR 305 N -3.44 0.00 0.00 -3.53 -4.23 -1.11 -4.85 115.64 98.48 1dk5 s THR 305 Ca 0.38 -0.42 0.00 0.00 -1.18 0.00 0.00 61.69 60.47 1dk5 s THR 305 Cb 0.37 -1.64 0.00 0.00 1.34 0.00 0.00 72.50 72.57 1dk5 s THR 305 CO -0.04 0.00 0.00 -2.11 -0.54 0.00 0.00 174.62 171.93 1dk5 n ARG 306 N -0.39 0.00 0.00 3.99 -4.01 -1.26 -4.78 116.66 110.21 1dk5 n ARG 306 Ca -0.07 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.74 1dk5 n ARG 306 Cb 0.61 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 30.03 1dk5 n ARG 306 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1dk5 n GLY 307 N 0.00 0.96 0.17 2.89 0.00 -1.26 -1.03 105.19 106.92 1dk5 n GLY 307 Ca 0.00 -0.79 0.03 0.00 0.00 0.00 0.00 46.02 45.27 1dk5 n GLY 307 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1dk5 h ASP 308 N 1.82 0.00 0.38 1.61 5.19 -2.01 -2.82 116.42 120.59 1dk5 h ASP 308 Ca 0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 1dk5 h ASP 308 Cb 0.00 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.48 1dk5 h ASP 308 CO 0.00 0.45 -0.50 0.22 -3.12 0.00 0.00 179.24 176.29 1dk5 h TYR 309 N 0.00 -1.41 -0.66 4.55 3.20 -1.90 -0.76 116.97 119.99 1dk5 h TYR 309 Ca -0.00 0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.02 1dk5 h TYR 309 Cb 0.95 0.57 -0.11 0.00 1.54 0.00 0.00 36.73 39.67 1dk5 h TYR 309 CO 0.00 -0.64 -0.02 1.49 -1.64 0.00 0.00 178.16 177.35 1dk5 h GLU 310 N -0.92 0.09 0.34 1.82 4.81 -0.93 -1.75 114.58 118.06 1dk5 h GLU 310 Ca -0.05 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 1dk5 h GLU 310 Cb 0.82 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 1dk5 h GLU 310 CO -0.13 0.06 -0.32 0.77 -0.73 0.00 0.00 179.01 178.67 1dk5 h SER 311 N 0.10 -0.87 -0.97 1.04 0.02 -1.24 -1.90 113.55 109.72 1dk5 h SER 311 Ca 0.35 0.07 0.24 0.00 -0.84 0.00 0.00 61.79 61.60 1dk5 h SER 311 Cb 0.57 0.28 -0.18 0.00 0.14 0.00 0.00 62.40 63.21 1dk5 h SER 311 CO -0.59 -0.43 -0.09 -0.03 -1.14 0.00 0.00 176.83 174.56 1dk5 h MET 312 N -0.66 0.01 0.40 3.45 1.85 -0.64 0.12 114.93 119.47 1dk5 h MET 312 Ca -0.04 -0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 59.04 1dk5 h MET 312 Cb 0.56 -0.00 -0.02 0.00 0.43 0.00 0.00 31.60 32.57 1dk5 h MET 312 CO -0.03 0.01 -0.35 -0.07 -0.40 0.00 0.00 176.91 176.07 1dk5 h LEU 313 N 0.01 -0.93 -1.66 3.39 3.38 -0.91 -0.79 115.31 117.81 1dk5 h LEU 313 Ca 0.54 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.62 1dk5 h LEU 313 Cb 1.00 0.30 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 1dk5 h LEU 313 CO -0.95 -0.50 0.29 -0.07 0.09 0.00 0.00 178.44 177.30 1dk5 h LEU 314 N -0.76 0.38 -0.89 1.67 3.38 -0.07 0.24 115.31 119.27 1dk5 h LEU 314 Ca -0.03 -0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 1dk5 h LEU 314 Cb 0.67 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1dk5 h LEU 314 CO -0.03 0.26 -0.55 0.00 0.09 0.00 0.00 178.44 178.21 1dk5 h ALA 315 N 1.75 1.08 0.11 1.53 0.00 -0.57 -2.06 119.26 121.10 1dk5 h ALA 315 Ca 0.18 -0.51 -0.28 0.00 0.00 0.00 0.00 54.91 54.31 1dk5 h ALA 315 Cb 0.15 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1dk5 h ALA 315 CO -0.04 0.69 -1.30 -0.07 0.00 0.00 0.00 179.25 178.53 1dk5 h LEU 316 N 0.00 0.35 0.00 0.00 3.38 0.31 -3.26 115.31 116.09 1dk5 h LEU 316 Ca -0.01 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1dk5 h LEU 316 Cb 0.98 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1dk5 h LEU 316 CO 0.07 1.33 0.00 -0.11 0.09 0.00 0.00 178.44 179.82 1dk5 n LEU 317 N -3.47 0.00 -1.08 1.67 7.94 0.71 -3.72 117.00 119.04 1dk5 n LEU 317 Ca -0.10 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 54.69 1dk5 n LEU 317 Cb 1.02 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.94 1dk5 n LEU 317 CO 0.52 0.00 -0.13 0.61 -1.11 0.00 0.00 177.39 177.28 1dk5 n GLY 318 N -0.33 0.57 0.00 -3.96 0.00 -1.20 -4.88 105.19 95.39 1dk5 n GLY 318 Ca 0.02 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1dk5 n GLY 318 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1dk5 n GLN 319 N -2.38 0.34 0.00 1.61 6.02 -0.90 -5.00 117.38 117.07 1dk5 n GLN 319 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.87 1dk5 n GLN 319 Cb 0.49 -0.98 0.00 0.00 1.02 0.00 0.00 30.24 30.77 1dk5 n GLN 319 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44