#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dn0 s SER 2 N 0.00 4.67 -0.03 1.61 0.15 -1.26 -5.02 113.70 113.82 2dn0 s SER 2 Ca 0.00 -0.05 -0.07 0.00 0.70 0.00 0.00 55.95 56.52 2dn0 s SER 2 Cb 0.00 -1.34 -0.02 0.00 -1.71 0.00 0.00 66.02 62.95 2dn0 s SER 2 CO 0.00 0.31 -0.14 -1.20 1.20 0.00 0.00 173.24 173.41 2dn0 n SER 3 N 2.57 1.29 -4.55 5.45 7.64 -1.26 -4.90 113.62 119.87 2dn0 n SER 3 Ca -0.18 0.20 -0.19 0.00 1.01 0.00 0.00 58.87 59.71 2dn0 n SER 3 Cb 0.53 -0.49 -0.08 0.00 -1.01 0.00 0.00 64.21 63.16 2dn0 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dn0 n GLY 4 N 2.53 -0.14 3.37 0.23 0.00 -1.26 -4.91 105.19 105.01 2dn0 n GLY 4 Ca -0.06 0.36 -0.30 0.00 0.00 0.00 0.00 46.02 46.03 2dn0 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dn0 n SER 5 N 16.60 -2.16 -4.54 1.61 7.64 -1.26 -4.97 113.62 126.53 2dn0 n SER 5 Ca 0.48 -0.19 -0.37 0.00 1.01 0.00 0.00 58.87 59.80 2dn0 n SER 5 Cb 0.41 -1.11 -0.11 0.00 -1.01 0.00 0.00 64.21 62.39 2dn0 n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dn0 s SER 6 N -2.14 5.64 0.00 6.43 0.15 -1.26 -4.70 113.70 117.82 2dn0 s SER 6 Ca 0.63 -0.07 0.00 0.00 0.70 0.00 0.00 55.95 57.21 2dn0 s SER 6 Cb -0.19 -2.03 0.00 0.00 -1.71 0.00 0.00 66.02 62.09 2dn0 s SER 6 CO 0.66 -0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.69 2dn0 n GLY 7 N 4.82 0.42 3.45 9.45 0.00 -1.26 -5.07 105.19 117.00 2dn0 n GLY 7 Ca -0.15 -0.78 -0.44 0.00 0.00 0.00 0.00 46.02 44.65 2dn0 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dn0 s ALA 8 N -0.14 3.34 -0.20 4.61 0.00 -1.26 -4.98 121.76 123.13 2dn0 s ALA 8 Ca 0.00 -2.68 0.01 0.00 0.00 0.00 0.00 51.96 49.29 2dn0 s ALA 8 Cb 0.00 -4.03 0.04 0.00 0.00 0.00 0.00 23.12 19.13 2dn0 s ALA 8 CO 0.00 -2.96 -0.14 0.45 0.00 0.00 0.00 175.76 173.10 2dn0 s SER 9 N 3.65 3.44 0.15 0.00 0.15 -1.26 -5.09 113.70 114.74 2dn0 s SER 9 Ca 0.32 -0.86 -0.34 0.00 0.70 0.00 0.00 55.95 55.77 2dn0 s SER 9 Cb -0.06 -1.38 -0.16 0.00 -1.71 0.00 0.00 66.02 62.71 2dn0 s SER 9 CO -0.08 -0.09 1.17 -0.38 1.20 0.00 0.00 173.24 175.06 2dn0 n ILE 10 N 4.62 0.73 -4.23 6.45 5.41 -1.26 -4.98 119.36 126.10 2dn0 n ILE 10 Ca -0.17 -0.18 -0.28 0.00 1.00 0.00 0.00 62.75 63.11 2dn0 n ILE 10 Cb 0.47 -0.77 -0.04 0.00 -0.71 0.00 0.00 39.64 38.59 2dn0 n ILE 10 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 2dn0 s TYR 11 N -0.09 1.87 -0.11 1.39 2.02 -1.26 -5.15 117.35 116.01 2dn0 s TYR 11 Ca 0.76 -0.84 -0.05 0.00 -0.37 0.00 0.00 57.07 56.57 2dn0 s TYR 11 Cb -0.89 -1.82 0.05 0.00 -0.40 0.00 0.00 41.96 38.90 2dn0 s TYR 11 CO 0.52 -0.12 0.24 -1.59 -1.57 0.00 0.00 175.55 173.03 2dn0 s LYS 12 N -4.08 0.16 0.06 -0.62 -2.85 -1.26 -5.13 119.74 106.02 2dn0 s LYS 12 Ca 0.25 0.62 -0.20 0.00 -1.00 0.00 0.00 55.97 55.64 2dn0 s LYS 12 Cb 0.00 -0.10 0.05 0.00 -2.06 0.00 0.00 37.83 35.72 2dn0 s LYS 12 CO 0.15 -0.23 0.48 1.21 0.10 0.00 0.00 175.35 177.06 2dn0 s ASN 13 N 1.84 -0.38 0.11 0.03 2.47 -1.26 -5.15 114.94 112.61 2dn0 s ASN 13 Ca -0.04 0.07 -0.30 0.00 0.42 0.00 0.00 52.86 53.01 2dn0 s ASN 13 Cb -0.11 0.47 -0.06 0.00 -1.45 0.00 0.00 41.25 40.10 2dn0 s ASN 13 CO -0.08 -0.73 1.15 -0.75 -3.72 0.00 0.00 177.10 172.97 2dn0 s LYS 14 N -2.65 4.51 0.14 0.43 2.20 -1.26 -5.04 119.74 118.07 2dn0 s LYS 14 Ca -0.04 1.74 0.06 0.00 -0.36 0.00 0.00 55.97 57.36 2dn0 s LYS 14 Cb -0.00 -3.32 -0.04 0.00 -1.51 0.00 0.00 37.83 32.96 2dn0 s LYS 14 CO -0.03 -0.10 -0.13 0.15 -0.36 0.00 0.00 175.35 174.87 2dn0 s LYS 15 N 0.40 1.09 -0.27 4.03 1.02 -1.26 -5.13 119.74 119.62 2dn0 s LYS 15 Ca 0.54 -1.36 -0.13 0.00 0.02 0.00 0.00 55.97 55.04 2dn0 s LYS 15 Cb -0.29 -0.86 -0.04 0.00 -0.52 0.00 0.00 37.83 36.11 2dn0 s LYS 15 CO 0.32 0.15 0.27 -1.12 -0.92 0.00 0.00 175.35 174.04 2dn0 s SER 16 N -2.81 6.14 0.29 2.83 0.01 -1.26 -4.97 113.70 113.93 2dn0 s SER 16 Ca 0.14 0.14 0.03 0.00 1.31 0.00 0.00 55.95 57.57 2dn0 s SER 16 Cb -0.02 -2.16 0.75 0.00 0.21 0.00 0.00 66.02 64.81 2dn0 s SER 16 CO 0.03 -0.09 1.44 1.57 0.41 0.00 0.00 173.24 176.60 2dn0 n HIS 17 N 5.07 0.63 -0.27 2.43 -0.00 -1.26 0.08 115.22 121.90 2dn0 n HIS 17 Ca -0.12 1.11 0.08 0.00 0.46 0.00 0.00 57.72 59.25 2dn0 n HIS 17 Cb 0.51 -1.22 0.17 0.00 -0.12 0.00 0.00 29.99 29.33 2dn0 n HIS 17 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 2dn0 n GLU 18 N -5.33 -0.07 0.02 1.57 4.71 -1.26 -0.00 120.64 120.28 2dn0 n GLU 18 Ca 0.23 1.18 -0.20 0.00 -0.01 0.00 0.00 57.16 58.37 2dn0 n GLU 18 Cb 0.75 -1.82 -0.14 0.00 -1.01 0.00 0.00 31.44 29.22 2dn0 n GLU 18 CO 0.00 0.00 0.00 1.96 0.09 0.00 0.00 177.13 179.18 2dn0 h GLN 19 N 0.00 0.23 -0.47 3.49 4.20 -0.72 -3.36 115.11 118.49 2dn0 h GLN 19 Ca 0.42 -0.40 0.07 0.00 0.06 0.00 0.00 58.65 58.81 2dn0 h GLN 19 Cb 0.77 0.15 -0.10 0.00 0.30 0.00 0.00 27.48 28.60 2dn0 h GLN 19 CO -0.76 1.19 -0.44 1.25 -0.67 0.00 0.00 178.83 179.40 2dn0 h LEU 20 N -0.47 -1.48 -0.81 1.46 6.46 0.01 -1.13 115.31 119.35 2dn0 h LEU 20 Ca -0.18 0.23 0.13 0.00 -0.12 0.00 0.00 57.88 57.95 2dn0 h LEU 20 Cb 1.58 0.65 -0.14 0.00 -0.73 0.00 0.00 40.66 42.02 2dn0 h LEU 20 CO 0.09 -0.36 -0.36 0.77 -0.62 0.00 0.00 178.44 177.97 2dn0 h SER 21 N -0.30 -1.28 -0.27 1.25 4.64 -0.84 -0.52 113.55 116.24 2dn0 h SER 21 Ca 0.15 0.27 0.05 0.00 -0.47 0.00 0.00 61.79 61.79 2dn0 h SER 21 Cb 0.58 0.67 -0.08 0.00 -0.31 0.00 0.00 62.40 63.26 2dn0 h SER 21 CO -0.61 -0.30 -0.50 0.00 -0.87 0.00 0.00 176.83 174.55 2dn0 h ALA 22 N 1.24 -0.70 -0.56 5.18 0.00 -1.35 -1.25 119.26 121.82 2dn0 h ALA 22 Ca 0.30 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.31 2dn0 h ALA 22 Cb 0.58 0.97 -0.11 0.00 0.00 0.00 0.00 17.79 19.23 2dn0 h ALA 22 CO -0.85 -1.00 -0.30 -0.07 0.00 0.00 0.00 179.25 177.03 2dn0 h LEU 23 N -0.46 -1.05 -0.09 0.00 3.38 -0.79 -1.63 115.31 114.67 2dn0 h LEU 23 Ca 0.08 0.21 0.04 0.00 0.09 0.00 0.00 57.88 58.30 2dn0 h LEU 23 Cb 0.63 0.53 -0.06 0.00 0.09 0.00 0.00 40.66 41.85 2dn0 h LEU 23 CO -0.50 -0.29 -0.41 0.11 0.09 0.00 0.00 178.44 177.43 2dn0 h LYS 24 N -0.15 -0.49 -1.31 1.13 1.57 -0.60 0.32 116.57 117.03 2dn0 h LYS 24 Ca 0.23 0.03 0.38 0.00 -1.87 0.00 0.00 60.65 59.43 2dn0 h LYS 24 Cb 0.54 0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.91 2dn0 h LYS 24 CO -0.65 -0.33 1.24 0.41 -0.57 0.00 0.00 179.45 179.56 2dn0 n GLY 25 N -1.44 -0.80 0.14 3.86 0.00 -0.55 0.18 105.19 106.58 2dn0 n GLY 25 Ca -0.05 0.46 -0.23 0.00 0.00 0.00 0.00 46.02 46.20 2dn0 n GLY 25 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dn0 h SER 26 N 0.00 0.61 0.52 1.61 0.02 -0.86 -3.33 113.55 112.12 2dn0 h SER 26 Ca 0.62 -0.92 -0.03 0.00 -0.84 0.00 0.00 61.79 60.63 2dn0 h SER 26 Cb 3.10 -0.20 0.01 0.00 0.14 0.00 0.00 62.40 65.45 2dn0 h SER 26 CO -0.01 1.71 -0.25 0.15 -1.14 0.00 0.00 176.83 177.29 2dn0 h PHE 27 N -0.01 -0.64 -0.81 3.45 3.04 0.22 0.50 116.94 122.69 2dn0 h PHE 27 Ca -0.30 -0.02 0.20 0.00 3.98 0.00 0.00 57.97 61.83 2dn0 h PHE 27 Cb 2.01 0.21 -0.15 0.00 2.56 0.00 0.00 35.95 40.58 2dn0 h PHE 27 CO 0.12 -0.40 -0.07 0.00 -2.02 0.00 0.00 178.31 175.94 2dn0 h ARG 29 N 0.00 -0.25 -5.06 0.00 3.08 -1.66 -3.44 114.38 107.05 2dn0 h ARG 29 Ca 0.45 0.02 -0.64 0.00 0.07 0.00 0.00 59.98 59.88 2dn0 h ARG 29 Cb 0.84 0.06 -0.20 0.00 0.08 0.00 0.00 29.97 30.75 2dn0 h ARG 29 CO -0.79 -0.17 -0.60 1.21 -1.07 0.00 0.00 179.97 178.55 2dn0 s ASN 30 N -4.13 5.33 0.14 7.04 2.47 0.16 -5.01 114.94 120.95 2dn0 s ASN 30 Ca -0.04 -0.10 -0.30 0.00 0.42 0.00 0.00 52.86 52.84 2dn0 s ASN 30 Cb 0.00 -1.94 -0.06 0.00 -1.45 0.00 0.00 41.25 37.80 2dn0 s ASN 30 CO 0.11 0.04 1.56 1.56 -3.72 0.00 0.00 177.10 176.65 2dn0 h GLN 31 N 7.70 -0.37 -5.25 0.43 7.50 -1.81 -3.32 115.11 120.00 2dn0 h GLN 31 Ca -0.37 0.03 -0.45 0.00 0.50 0.00 0.00 58.65 58.36 2dn0 h GLN 31 Cb 1.18 0.08 -0.26 0.00 0.05 0.00 0.00 27.48 28.53 2dn0 h GLN 31 CO 0.61 -0.25 -0.80 -0.59 -1.50 0.00 0.00 178.83 176.31 2dn0 s PHE 32 N -5.74 1.19 0.98 2.96 -0.71 -1.26 -4.82 117.98 110.58 2dn0 s PHE 32 Ca -0.15 -0.31 -0.12 0.00 -1.04 0.00 0.00 56.93 55.31 2dn0 s PHE 32 Cb 0.10 -0.72 0.18 0.00 -1.21 0.00 0.00 43.02 41.36 2dn0 s PHE 32 CO 0.63 0.02 1.09 -1.25 -1.34 0.00 0.00 175.22 174.37 2dn0 s PRO 33 N -0.86 0.59 0.00 1.99 0.04 -1.26 -5.06 135.00 130.44 2dn0 s PRO 33 Ca 0.02 0.58 0.00 0.00 0.04 0.00 0.00 61.00 61.65 2dn0 s PRO 33 Cb -0.07 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.72 2dn0 s PRO 33 CO 0.01 -2.64 0.00 0.41 0.04 0.00 0.00 177.00 174.82 2dn0 n GLY 34 N -1.09 0.60 0.70 0.56 0.00 -1.26 -5.01 105.19 99.69 2dn0 n GLY 34 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2dn0 n GLY 34 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dn0 n GLN 35 N 0.00 0.00 -0.03 1.61 3.00 -1.26 -4.76 117.38 115.94 2dn0 n GLN 35 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 56.85 2dn0 n GLN 35 Cb 0.00 -0.55 -0.11 0.00 0.00 0.00 0.00 30.24 29.58 2dn0 n GLN 35 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.06 177.83 2dn0 h SER 36 N 0.00 0.03 -0.40 1.08 0.02 -1.99 -2.97 113.55 109.32 2dn0 h SER 36 Ca 0.00 -0.68 0.06 0.00 -0.84 0.00 0.00 61.79 60.33 2dn0 h SER 36 Cb 0.58 -0.01 -0.09 0.00 0.14 0.00 0.00 62.40 63.03 2dn0 h SER 36 CO 0.00 0.71 -0.46 -0.33 -1.14 0.00 0.00 176.83 175.61 2dn0 h GLU 37 N -0.64 -0.34 0.32 3.45 4.39 -1.97 -1.63 114.58 118.16 2dn0 h GLU 37 Ca -0.00 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 2dn0 h GLU 37 Cb 0.71 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.40 2dn0 h GLU 37 CO 0.01 -0.23 -0.50 0.28 -1.16 0.00 0.00 179.01 177.41 2dn0 h VAL 38 N -0.35 0.00 -1.06 3.13 2.07 -1.86 -0.69 116.25 117.49 2dn0 h VAL 38 Ca 0.12 0.00 0.42 0.00 0.82 0.00 0.00 66.70 68.06 2dn0 h VAL 38 Cb 0.59 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.19 2dn0 h VAL 38 CO -0.58 0.00 0.59 -0.33 0.02 0.00 0.00 177.57 177.28 2dn0 h GLU 39 N -0.86 0.02 0.26 1.57 4.39 -1.27 0.24 114.58 118.93 2dn0 h GLU 39 Ca -0.04 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 2dn0 h GLU 39 Cb 0.80 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 2dn0 h GLU 39 CO -0.16 0.02 -0.13 1.25 -1.16 0.00 0.00 179.01 178.83 2dn0 h HIS 40 N 0.03 -0.33 -0.67 4.33 2.76 -0.35 -3.28 115.15 117.64 2dn0 h HIS 40 Ca 0.85 -0.01 0.13 0.00 -2.20 0.00 0.00 60.37 59.14 2dn0 h HIS 40 Cb 2.30 0.11 -0.13 0.00 1.55 0.00 0.00 27.41 31.24 2dn0 h HIS 40 CO -0.01 -0.20 -0.23 -0.07 -1.30 0.00 0.00 177.93 176.11 2dn0 h LEU 41 N -0.73 -0.84 -1.91 0.26 3.38 0.30 0.61 115.31 116.39 2dn0 h LEU 41 Ca -0.04 0.22 0.42 0.00 0.09 0.00 0.00 57.88 58.57 2dn0 h LEU 41 Cb 0.27 0.49 -0.06 0.00 0.09 0.00 0.00 40.66 41.45 2dn0 h LEU 41 CO 0.06 -0.26 1.09 0.71 0.09 0.00 0.00 178.44 180.13 2dn0 h THR 42 N -0.06 0.21 0.04 0.22 1.35 -0.71 0.67 112.91 114.63 2dn0 h THR 42 Ca 0.30 0.00 -0.35 0.00 -0.55 0.00 0.00 66.41 65.81 2dn0 h THR 42 Cb 0.53 0.23 -0.05 0.00 -1.73 0.00 0.00 68.15 67.13 2dn0 h THR 42 CO -0.71 0.00 -2.11 0.29 -0.25 0.00 0.00 175.52 172.73 2dn0 n LYS 43 N -3.97 0.69 0.26 4.72 5.02 0.19 -0.38 118.16 124.70 2dn0 n LYS 43 Ca 0.32 0.19 0.15 0.00 -2.02 0.00 0.00 58.31 56.95 2dn0 n LYS 43 Cb 1.54 -1.65 0.62 0.00 -0.02 0.00 0.00 35.03 35.52 2dn0 n LYS 43 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2dn0 h VAL 44 N 0.02 0.18 0.00 -0.18 2.07 0.21 -3.29 116.25 115.26 2dn0 h VAL 44 Ca -0.45 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 66.38 2dn0 h VAL 44 Cb 2.04 1.58 -0.00 0.00 -1.52 0.00 0.00 31.29 33.39 2dn0 h VAL 44 CO 0.03 0.07 -1.00 0.35 0.02 0.00 0.00 177.57 177.04 2dn0 n THR 45 N -3.20 0.00 0.00 2.57 -2.24 0.18 -4.93 114.28 106.66 2dn0 n THR 45 Ca 0.00 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2dn0 n THR 45 Cb 0.34 -0.78 0.00 0.00 -2.10 0.00 0.00 70.33 67.79 2dn0 n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dn0 n GLY 46 N 2.93 2.75 3.47 3.38 0.00 0.49 -5.01 105.19 113.21 2dn0 n GLY 46 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2dn0 n GLY 46 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dn0 n LEU 47 N 0.00 0.89 -4.74 0.99 4.77 -1.25 -4.87 117.00 112.79 2dn0 n LEU 47 Ca 0.00 0.73 -0.38 0.00 -0.03 0.00 0.00 56.01 56.33 2dn0 n LEU 47 Cb 0.00 -1.18 0.05 0.00 -2.33 0.00 0.00 43.42 39.95 2dn0 n LEU 47 CO 0.00 -3.02 0.94 -0.44 -1.33 0.00 0.00 177.39 173.54 2dn0 s SER 48 N -1.20 5.08 0.35 -1.43 0.01 -1.26 -4.60 113.70 110.65 2dn0 s SER 48 Ca 0.69 2.66 0.16 0.00 1.31 0.00 0.00 55.95 60.76 2dn0 s SER 48 Cb -0.44 -2.62 1.15 0.00 0.21 0.00 0.00 66.02 64.32 2dn0 s SER 48 CO 0.54 -1.69 1.63 0.74 0.41 0.00 0.00 173.24 174.87 2dn0 h THR 49 N 1.11 0.18 -0.42 1.44 2.02 -1.94 0.75 112.91 116.04 2dn0 h THR 49 Ca -0.51 -0.06 -0.09 0.00 0.77 0.00 0.00 66.41 66.52 2dn0 h THR 49 Cb 1.31 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 2dn0 h THR 49 CO 0.56 0.03 -0.08 -0.09 0.37 0.00 0.00 175.52 176.31 2dn0 h ARG 50 N 0.18 0.80 -0.47 6.66 2.43 -2.00 -2.28 114.38 119.71 2dn0 h ARG 50 Ca 0.76 -0.30 -0.03 0.00 -0.81 0.00 0.00 59.98 59.61 2dn0 h ARG 50 Cb 1.85 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 31.32 2dn0 h ARG 50 CO -0.68 0.91 0.17 0.93 -1.51 0.00 0.00 179.97 179.79 2dn0 h GLU 51 N 0.63 0.71 0.37 0.20 4.39 0.08 -0.05 114.58 120.91 2dn0 h GLU 51 Ca 0.11 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 2dn0 h GLU 51 Cb 0.60 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.14 2dn0 h GLU 51 CO 0.04 0.66 -0.20 0.28 -1.16 0.00 0.00 179.01 178.62 2dn0 h VAL 52 N 0.62 0.58 -0.67 3.13 2.07 -0.91 -2.44 116.25 118.62 2dn0 h VAL 52 Ca 0.15 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.68 2dn0 h VAL 52 Cb 0.23 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 2dn0 h VAL 52 CO -0.01 0.00 0.43 0.03 0.02 0.00 0.00 177.57 178.04 2dn0 h ARG 53 N -0.54 0.90 -0.28 1.57 3.08 -1.37 -2.97 114.38 114.77 2dn0 h ARG 53 Ca -0.04 -0.07 0.06 0.00 0.07 0.00 0.00 59.98 60.00 2dn0 h ARG 53 Cb 0.43 -0.20 -0.08 0.00 0.08 0.00 0.00 29.97 30.21 2dn0 h ARG 53 CO 0.06 0.62 -0.35 -0.22 -1.07 0.00 0.00 179.97 179.00 2dn0 h LYS 54 N 0.91 -0.32 -0.99 0.04 1.63 -0.80 -2.36 116.57 114.68 2dn0 h LYS 54 Ca 0.24 0.02 0.09 0.00 -0.85 0.00 0.00 60.65 60.16 2dn0 h LYS 54 Cb -0.07 0.07 -0.12 0.00 -0.60 0.00 0.00 32.23 31.51 2dn0 h LYS 54 CO -0.05 -0.22 -0.58 1.87 -3.45 0.00 0.00 179.45 177.03 2dn0 n TRP 55 N -5.42 -0.42 -0.29 1.91 -0.00 -0.94 0.42 117.44 112.70 2dn0 n TRP 55 Ca -0.01 1.24 0.18 0.00 -0.00 0.00 0.00 57.50 58.90 2dn0 n TRP 55 Cb 0.34 -0.59 0.34 0.00 -0.00 0.00 0.00 31.31 31.40 2dn0 n TRP 55 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 2dn0 n PHE 56 N -5.24 0.70 -0.20 5.87 3.01 -0.89 0.19 117.46 120.90 2dn0 n PHE 56 Ca 0.02 1.01 -0.04 0.00 1.01 0.00 0.00 57.45 59.46 2dn0 n PHE 56 Cb 0.26 -1.24 0.06 0.00 -0.01 0.00 0.00 39.48 38.56 2dn0 n PHE 56 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 2dn0 h SER 57 N 0.00 0.53 0.09 4.37 0.02 -0.06 -2.78 113.55 115.72 2dn0 h SER 57 Ca 0.59 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.55 2dn0 h SER 57 Cb 1.36 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 63.81 2dn0 h SER 57 CO -0.75 0.36 -0.10 0.44 -1.14 0.00 0.00 176.83 175.65 2dn0 h ASP 58 N 0.66 -0.26 -0.86 3.07 3.32 0.22 -1.19 116.42 121.37 2dn0 h ASP 58 Ca 0.25 0.02 0.15 0.00 0.02 0.00 0.00 57.03 57.47 2dn0 h ASP 58 Cb 0.09 0.09 -0.15 0.00 0.22 0.00 0.00 39.33 39.58 2dn0 h ASP 58 CO -0.13 -0.12 -0.29 0.54 -1.72 0.00 0.00 179.24 177.51 2dn0 n ARG 59 N -2.87 -0.16 0.16 3.56 5.12 -1.09 -0.07 116.66 121.31 2dn0 n ARG 59 Ca -0.02 1.33 -0.14 0.00 -1.93 0.00 0.00 57.85 57.09 2dn0 n ARG 59 Cb 0.09 -1.98 -0.07 0.00 -1.16 0.00 0.00 32.46 29.33 2dn0 n ARG 59 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2dn0 h ARG 60 N 0.00 -0.62 -0.29 5.56 3.08 -1.28 -1.94 114.38 118.88 2dn0 h ARG 60 Ca 0.34 0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.50 2dn0 h ARG 60 Cb 0.56 0.14 -0.08 0.00 0.08 0.00 0.00 29.97 30.67 2dn0 h ARG 60 CO -0.87 -0.41 -0.36 1.88 -1.07 0.00 0.00 179.97 179.14 2dn0 h TYR 61 N -0.64 -1.02 -0.86 3.04 0.05 0.79 -0.42 116.97 117.91 2dn0 h TYR 61 Ca 0.01 0.05 0.20 0.00 0.05 0.00 0.00 58.73 59.05 2dn0 h TYR 61 Cb 0.64 0.49 -0.12 0.00 1.01 0.00 0.00 36.73 38.74 2dn0 h TYR 61 CO -0.28 -0.41 0.35 1.25 -1.05 0.00 0.00 178.16 178.02 2dn0 h HIS 62 N -0.34 0.57 -3.60 4.88 2.76 -0.88 -3.10 115.15 115.45 2dn0 h HIS 62 Ca 0.13 0.04 -0.78 0.00 -2.20 0.00 0.00 60.37 57.57 2dn0 h HIS 62 Cb 0.56 -0.12 -0.29 0.00 1.55 0.00 0.00 27.41 29.12 2dn0 h HIS 62 CO -0.51 -0.04 0.24 0.00 -1.30 0.00 0.00 177.93 176.31 2dn0 s ARG 64 N -0.86 0.82 -1.53 0.00 6.06 -1.17 -4.80 118.95 117.47 2dn0 s ARG 64 Ca 0.26 -0.26 -0.03 0.00 -2.50 0.00 0.00 55.73 53.20 2dn0 s ARG 64 Cb -0.10 -0.78 0.03 0.00 0.06 0.00 0.00 34.95 34.16 2dn0 s ARG 64 CO -0.09 0.10 0.27 0.27 -2.50 0.00 0.00 175.30 173.36 2dn0 n ASN 65 N 3.26 -0.09 -3.71 -2.12 0.23 -1.26 -4.86 115.26 106.71 2dn0 n ASN 65 Ca -0.18 -1.14 -0.39 0.00 -0.53 0.00 0.00 54.58 52.34 2dn0 n ASN 65 Cb 0.55 -2.28 -0.01 0.00 -2.08 0.00 0.00 39.78 35.96 2dn0 n ASN 65 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2dn0 n LEU 66 N -4.46 6.14 -4.56 -4.53 -0.00 -1.26 -5.01 117.00 103.32 2dn0 n LEU 66 Ca -0.26 -5.35 -0.28 0.00 -0.00 0.00 0.00 56.01 50.13 2dn0 n LEU 66 Cb 0.66 -1.09 -0.10 0.00 -0.00 0.00 0.00 43.42 42.90 2dn0 n LEU 66 CO 0.82 1.91 -0.42 -1.59 -0.00 0.00 0.00 177.39 178.11 2dn0 s LYS 67 N -3.27 2.03 0.00 1.47 0.00 -1.26 -4.89 119.74 113.82 2dn0 s LYS 67 Ca 0.36 -1.22 0.00 0.00 0.00 0.00 0.00 55.97 55.12 2dn0 s LYS 67 Cb 0.13 -2.18 0.00 0.00 0.00 0.00 0.00 37.83 35.78 2dn0 s LYS 67 CO 0.00 0.45 0.00 0.41 0.00 0.00 0.00 175.35 176.21 2dn0 n GLY 68 N 0.25 1.38 0.19 0.59 0.00 -1.26 -4.97 105.19 101.37 2dn0 n GLY 68 Ca -0.12 -0.05 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 2dn0 n GLY 68 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2dn0 h SER 69 N 0.00 0.35 -1.90 1.61 0.87 -2.05 -3.45 113.55 108.99 2dn0 h SER 69 Ca 0.00 -0.19 -0.43 0.00 -1.23 0.00 0.00 61.79 59.94 2dn0 h SER 69 Cb 0.00 -0.10 0.03 0.00 -0.44 0.00 0.00 62.40 61.89 2dn0 h SER 69 CO 0.00 0.83 -0.15 -0.13 -0.53 0.00 0.00 176.83 176.85 2dn0 s ARG 70 N -3.90 2.66 -0.09 2.24 3.00 -1.26 -5.05 118.95 116.55 2dn0 s ARG 70 Ca -0.05 -1.05 -0.25 0.00 0.00 0.00 0.00 55.73 54.37 2dn0 s ARG 70 Cb 0.12 -2.63 -0.29 0.00 0.00 0.00 0.00 34.95 32.15 2dn0 s ARG 70 CO 0.80 -0.51 0.83 0.66 0.00 0.00 0.00 175.30 177.09 2dn0 h SER 71 N 0.35 0.24 0.00 0.23 4.64 -2.03 -3.49 113.55 113.49 2dn0 h SER 71 Ca -0.40 -0.98 0.00 0.00 -0.47 0.00 0.00 61.79 59.94 2dn0 h SER 71 Cb 1.29 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2dn0 h SER 71 CO 0.48 1.20 0.00 0.61 -0.87 0.00 0.00 176.83 178.25 2dn0 n GLY 72 N 1.64 0.78 3.56 -0.77 0.00 -1.26 -5.01 105.19 104.12 2dn0 n GLY 72 Ca -0.12 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 2dn0 n GLY 72 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dn0 s PRO 73 N 0.00 2.59 0.94 1.61 0.04 -1.26 -4.97 135.00 133.94 2dn0 s PRO 73 Ca 0.00 0.09 -0.12 0.00 0.04 0.00 0.00 61.00 61.02 2dn0 s PRO 73 Cb 0.00 -4.77 0.15 0.00 0.04 0.00 0.00 34.50 29.92 2dn0 s PRO 73 CO 0.00 -3.10 1.09 -1.54 0.04 0.00 0.00 177.00 173.49 2dn0 s SER 74 N 8.06 3.06 -0.89 6.66 1.04 -1.26 -4.95 113.70 125.42 2dn0 s SER 74 Ca 0.69 1.55 -0.18 0.00 0.48 0.00 0.00 55.95 58.49 2dn0 s SER 74 Cb -0.09 -2.21 0.15 0.00 0.10 0.00 0.00 66.02 63.97 2dn0 s SER 74 CO 0.08 -2.91 1.02 -0.94 0.98 0.00 0.00 173.24 171.47 2dn0 s SER 75 N -3.23 6.64 0.00 7.02 1.04 -1.26 -5.31 113.70 118.60 2dn0 s SER 75 Ca 0.64 -2.16 0.00 0.00 0.48 0.00 0.00 55.95 54.91 2dn0 s SER 75 Cb -0.19 -2.35 0.00 0.00 0.10 0.00 0.00 66.02 63.58 2dn0 s SER 75 CO 0.58 -0.95 0.00 0.61 0.98 0.00 0.00 173.24 174.46