#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 -0.22 0.00 1.61 0.15 -1.26 -5.19 113.70 108.80 2dn0 s SER 2 Ca 0.00 0.05 -0.21 0.00 0.70 0.00 0.00 55.95 56.49 2dn0 s SER 2 Cb 0.00 0.22 0.04 0.00 -1.71 0.00 0.00 66.02 64.57 2dn0 s SER 2 CO 0.00 -0.34 0.45 -0.55 1.20 0.00 0.00 173.24 174.00 2dn0 s SER 3 N -2.07 -0.36 0.00 5.45 0.15 -1.26 -5.15 113.70 110.46 2dn0 s SER 3 Ca 0.07 0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.94 2dn0 s SER 3 Cb -0.01 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.72 2dn0 s SER 3 CO -0.05 -0.58 0.00 0.61 1.20 0.00 0.00 173.24 174.42 2dn0 n GLY 4 N 0.86 -0.37 3.13 9.45 0.00 -1.26 -5.18 105.19 111.82 2dn0 n GLY 4 Ca -0.20 0.81 -0.09 0.00 0.00 0.00 0.00 46.02 46.54 2dn0 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dn0 s SER 5 N 0.00 0.21 -0.14 1.61 0.15 -1.26 -5.16 113.70 109.10 2dn0 s SER 5 Ca 0.00 -0.62 -0.07 0.00 0.70 0.00 0.00 55.95 55.97 2dn0 s SER 5 Cb 0.00 0.25 0.06 0.00 -1.71 0.00 0.00 66.02 64.61 2dn0 s SER 5 CO 0.00 -0.56 0.33 -0.94 1.20 0.00 0.00 173.24 173.26 2dn0 s SER 6 N -2.37 -0.28 0.00 5.45 1.04 -1.26 -5.15 113.70 111.13 2dn0 s SER 6 Ca -0.01 0.72 0.00 0.00 0.48 0.00 0.00 55.95 57.14 2dn0 s SER 6 Cb 0.01 0.68 0.00 0.00 0.10 0.00 0.00 66.02 66.81 2dn0 s SER 6 CO -0.07 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.57 2dn0 n GLY 7 N 4.51 3.34 0.47 7.32 0.00 -1.26 -5.11 105.19 114.47 2dn0 n GLY 7 Ca -0.20 -0.74 -0.04 0.00 0.00 0.00 0.00 46.02 45.03 2dn0 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dn0 n ALA 8 N -3.00 1.65 -3.55 4.61 0.00 -1.26 -4.98 120.51 113.99 2dn0 n ALA 8 Ca 0.00 -0.40 -0.35 0.00 0.00 0.00 0.00 53.44 52.68 2dn0 n ALA 8 Cb 0.00 0.09 -0.14 0.00 0.00 0.00 0.00 19.45 19.41 2dn0 n ALA 8 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dn0 s SER 9 N -5.60 4.70 0.02 0.00 0.15 -1.26 -4.98 113.70 106.73 2dn0 s SER 9 Ca -0.13 -0.95 -0.17 0.00 0.70 0.00 0.00 55.95 55.40 2dn0 s SER 9 Cb 0.02 -1.74 -0.28 0.00 -1.71 0.00 0.00 66.02 62.31 2dn0 s SER 9 CO 0.19 -0.19 1.07 -0.29 1.20 0.00 0.00 173.24 175.22 2dn0 h ILE 10 N 6.16 1.36 -3.20 6.45 6.09 -2.03 -3.44 117.51 128.90 2dn0 h ILE 10 Ca -0.29 -2.36 -0.59 0.00 -1.37 0.00 0.00 64.86 60.25 2dn0 h ILE 10 Cb 1.10 2.75 -0.08 0.00 0.47 0.00 0.00 36.82 41.06 2dn0 h ILE 10 CO 0.57 0.70 -0.23 -0.72 -3.07 0.00 0.00 178.15 175.41 2dn0 s TYR 11 N -2.96 3.57 -0.42 2.19 1.13 -1.26 -4.99 117.35 114.61 2dn0 s TYR 11 Ca -0.11 0.82 0.04 0.00 -1.41 0.00 0.00 57.07 56.41 2dn0 s TYR 11 Cb 0.04 -2.38 0.45 0.00 -1.10 0.00 0.00 41.96 38.96 2dn0 s TYR 11 CO 0.89 0.36 1.39 1.63 -2.51 0.00 0.00 175.55 177.30 2dn0 n LYS 12 N 3.00 3.36 -4.50 -3.49 4.76 -1.26 -5.02 118.16 115.01 2dn0 n LYS 12 Ca -0.11 -4.01 -0.25 0.00 -2.87 0.00 0.00 58.31 51.07 2dn0 n LYS 12 Cb 0.52 -2.28 -0.09 0.00 -1.84 0.00 0.00 35.03 31.35 2dn0 n LYS 12 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2dn0 s ASN 13 N -3.11 2.71 -0.58 4.39 -0.87 -1.26 -5.12 114.94 111.11 2dn0 s ASN 13 Ca 0.53 -1.62 0.04 0.00 -1.57 0.00 0.00 52.86 50.24 2dn0 s ASN 13 Cb 0.43 0.41 0.14 0.00 -0.02 0.00 0.00 41.25 42.21 2dn0 s ASN 13 CO -0.03 -0.88 0.33 -0.54 -2.57 0.00 0.00 177.10 173.42 2dn0 s LYS 14 N -3.75 2.13 0.02 -0.60 3.01 -1.26 -5.09 119.74 114.20 2dn0 s LYS 14 Ca 0.26 -2.85 -0.27 0.00 -1.01 0.00 0.00 55.97 52.09 2dn0 s LYS 14 Cb 0.04 -3.36 -0.04 0.00 -1.01 0.00 0.00 37.83 33.46 2dn0 s LYS 14 CO 0.14 -1.16 0.85 0.15 0.51 0.00 0.00 175.35 175.84 2dn0 s LYS 15 N -0.65 4.54 0.35 1.68 1.02 -1.26 -5.06 119.74 120.35 2dn0 s LYS 15 Ca 0.19 1.20 0.09 0.00 0.02 0.00 0.00 55.97 57.48 2dn0 s LYS 15 Cb -0.19 -3.42 -0.05 0.00 -0.52 0.00 0.00 37.83 33.65 2dn0 s LYS 15 CO -0.05 0.12 0.03 -1.54 -0.92 0.00 0.00 175.35 172.98 2dn0 s SER 16 N 0.49 4.20 0.26 2.83 1.04 -1.26 -4.98 113.70 116.28 2dn0 s SER 16 Ca 0.44 -1.01 -0.04 0.00 0.48 0.00 0.00 55.95 55.83 2dn0 s SER 16 Cb -0.21 -0.53 0.36 0.00 0.10 0.00 0.00 66.02 65.75 2dn0 s SER 16 CO 0.25 -0.27 1.89 0.45 0.98 0.00 0.00 173.24 176.54 2dn0 h HIS 17 N 1.77 1.21 -0.94 5.02 -0.00 -1.97 0.24 115.15 120.49 2dn0 h HIS 17 Ca -0.43 0.03 0.32 0.00 -0.00 0.00 0.00 60.37 60.29 2dn0 h HIS 17 Cb 1.25 -0.40 -0.17 0.00 -0.00 0.00 0.00 27.41 28.09 2dn0 h HIS 17 CO 0.70 0.67 0.23 0.39 -0.00 0.00 0.00 177.93 179.92 2dn0 n GLU 18 N -4.47 -0.07 -0.13 2.45 1.02 -1.26 -0.18 120.64 118.00 2dn0 n GLU 18 Ca 0.14 1.36 -0.25 0.00 -0.02 0.00 0.00 57.16 58.39 2dn0 n GLU 18 Cb 0.13 -2.27 -0.10 0.00 -0.02 0.00 0.00 31.44 29.18 2dn0 n GLU 18 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dn0 n GLN 19 N -5.27 0.55 0.06 3.49 10.64 -0.93 -4.47 117.38 121.46 2dn0 n GLN 19 Ca 0.28 0.21 -0.13 0.00 -1.83 0.00 0.00 57.00 55.53 2dn0 n GLN 19 Cb 0.94 -1.42 -0.08 0.00 -0.86 0.00 0.00 30.24 28.81 2dn0 n GLN 19 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.06 175.16 2dn0 h LEU 20 N -0.68 -1.32 -0.81 2.61 3.38 -0.06 -2.58 115.31 115.85 2dn0 h LEU 20 Ca -0.62 0.14 0.08 0.00 0.09 0.00 0.00 57.88 57.58 2dn0 h LEU 20 Cb 1.63 0.50 -0.10 0.00 0.09 0.00 0.00 40.66 42.78 2dn0 h LEU 20 CO -0.31 -0.44 -0.45 -0.24 0.09 0.00 0.00 178.44 177.09 2dn0 n SER 21 N -4.89 -0.81 -0.26 -0.43 2.88 0.74 0.02 113.62 110.88 2dn0 n SER 21 Ca -0.06 1.44 -0.07 0.00 -1.33 0.00 0.00 58.87 58.85 2dn0 n SER 21 Cb 0.33 -0.21 -0.02 0.00 -0.75 0.00 0.00 64.21 63.56 2dn0 n SER 21 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dn0 h ALA 22 N 0.52 -0.21 -0.53 -1.46 0.00 -1.62 0.15 119.26 116.12 2dn0 h ALA 22 Ca 0.15 0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.29 2dn0 h ALA 22 Cb 0.36 0.98 -0.06 0.00 0.00 0.00 0.00 17.79 19.06 2dn0 h ALA 22 CO -0.77 -0.78 0.18 -0.07 0.00 0.00 0.00 179.25 177.81 2dn0 h LEU 23 N -0.15 0.16 -0.23 0.00 3.38 -0.19 0.22 115.31 118.49 2dn0 h LEU 23 Ca 0.22 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.30 2dn0 h LEU 23 Cb 0.56 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 2dn0 h LEU 23 CO -0.77 0.12 0.01 0.11 0.09 0.00 0.00 178.44 178.00 2dn0 h LYS 24 N 0.35 0.08 0.62 1.13 1.57 0.62 0.63 116.57 121.58 2dn0 h LYS 24 Ca 0.26 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.00 2dn0 h LYS 24 Cb 0.30 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.60 2dn0 h LYS 24 CO -0.27 0.05 -0.30 0.78 -0.57 0.00 0.00 179.45 179.14 2dn0 h GLY 25 N 0.08 -0.87 0.08 3.86 0.00 -0.21 -0.44 103.07 105.58 2dn0 h GLY 25 Ca 0.11 0.32 0.26 0.00 0.00 0.00 0.00 47.33 48.03 2dn0 h GLY 25 CO -0.18 -0.32 0.67 1.76 0.00 0.00 0.00 176.54 178.48 2dn0 h SER 26 N -0.95 0.14 -0.13 0.19 0.02 -0.97 0.12 113.55 111.97 2dn0 h SER 26 Ca -0.09 0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 60.75 2dn0 h SER 26 Cb 0.64 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.18 2dn0 h SER 26 CO 0.14 0.04 -0.44 0.15 -1.14 0.00 0.00 176.83 175.58 2dn0 h PHE 27 N 0.13 0.70 0.20 3.45 3.57 -0.71 -2.00 116.94 122.27 2dn0 h PHE 27 Ca 0.48 -0.29 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 2dn0 h PHE 27 Cb 1.68 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 40.30 2dn0 h PHE 27 CO -0.00 1.05 -0.10 0.00 -2.23 0.00 0.00 178.31 177.03 2dn0 h ARG 29 N -0.28 -0.41 -5.46 0.00 0.11 -1.49 -3.37 114.38 103.47 2dn0 h ARG 29 Ca -0.03 0.03 -0.62 0.00 0.10 0.00 0.00 59.98 59.46 2dn0 h ARG 29 Cb 0.20 0.09 -0.13 0.00 1.11 0.00 0.00 29.97 31.25 2dn0 h ARG 29 CO 0.04 -0.28 0.12 1.21 0.10 0.00 0.00 179.97 181.16 2dn0 s ASN 30 N -4.90 6.46 0.20 0.08 2.47 -0.75 -4.96 114.94 113.54 2dn0 s ASN 30 Ca -0.15 0.36 -0.16 0.00 0.42 0.00 0.00 52.86 53.32 2dn0 s ASN 30 Cb 0.10 -2.32 0.19 0.00 -1.45 0.00 0.00 41.25 37.77 2dn0 s ASN 30 CO 0.65 -0.48 1.61 1.56 -3.72 0.00 0.00 177.10 176.73 2dn0 h GLN 31 N 8.23 -0.07 -3.49 0.43 7.50 -1.74 -3.38 115.11 122.58 2dn0 h GLN 31 Ca -0.27 0.00 -0.18 0.00 0.50 0.00 0.00 58.65 58.71 2dn0 h GLN 31 Cb 1.12 0.02 -0.24 0.00 0.05 0.00 0.00 27.48 28.42 2dn0 h GLN 31 CO 0.80 -0.05 -0.56 -0.59 -1.50 0.00 0.00 178.83 176.93 2dn0 s PHE 32 N -6.15 -0.05 0.54 2.96 -0.71 -1.26 -4.94 117.98 108.36 2dn0 s PHE 32 Ca -0.14 0.13 -0.09 0.00 -1.04 0.00 0.00 56.93 55.79 2dn0 s PHE 32 Cb 0.18 -0.00 0.13 0.00 -1.21 0.00 0.00 43.02 42.12 2dn0 s PHE 32 CO 0.72 -0.14 0.48 -0.35 -1.34 0.00 0.00 175.22 174.58 2dn0 n PRO 33 N 2.43 -1.96 -3.76 1.99 -0.04 -1.26 -5.09 135.00 127.30 2dn0 n PRO 33 Ca -0.16 -0.76 -0.11 0.00 -0.04 0.00 0.00 63.50 62.43 2dn0 n PRO 33 Cb 0.58 -0.72 0.01 0.00 -0.04 0.00 0.00 33.50 33.33 2dn0 n PRO 33 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dn0 n GLY 34 N -0.71 1.45 0.49 0.55 0.00 -1.26 -4.96 105.19 100.75 2dn0 n GLY 34 Ca 0.07 -1.39 0.31 0.00 0.00 0.00 0.00 46.02 45.01 2dn0 n GLY 34 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2dn0 h GLN 35 N 0.00 0.00 0.00 1.61 4.15 -1.99 -0.17 115.11 118.70 2dn0 h GLN 35 Ca -0.30 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.10 2dn0 h GLN 35 Cb 1.18 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.86 2dn0 h GLN 35 CO 0.39 0.00 -0.29 1.03 -1.93 0.00 0.00 178.83 178.03 2dn0 h SER 36 N 0.00 0.00 -0.34 -0.69 0.87 -2.00 -3.24 113.55 108.16 2dn0 h SER 36 Ca 0.47 -0.18 0.06 0.00 -1.23 0.00 0.00 61.79 60.91 2dn0 h SER 36 Cb 1.92 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 63.80 2dn0 h SER 36 CO -0.00 0.75 -0.48 -0.08 -0.53 0.00 0.00 176.83 176.48 2dn0 h GLU 37 N -1.00 -0.39 -0.23 2.24 4.57 -1.78 -2.03 114.58 115.96 2dn0 h GLU 37 Ca -0.03 0.03 0.05 0.00 -1.18 0.00 0.00 59.36 58.22 2dn0 h GLU 37 Cb 0.42 0.09 -0.07 0.00 -0.16 0.00 0.00 28.75 29.03 2dn0 h GLU 37 CO -0.02 -0.26 -0.48 0.28 -1.18 0.00 0.00 179.01 177.35 2dn0 h VAL 38 N -0.40 0.07 -1.03 0.32 2.07 -1.25 0.71 116.25 116.73 2dn0 h VAL 38 Ca 0.10 0.00 0.35 0.00 0.82 0.00 0.00 66.70 67.97 2dn0 h VAL 38 Cb 0.61 0.07 -0.15 0.00 -1.52 0.00 0.00 31.29 30.30 2dn0 h VAL 38 CO -0.55 0.00 0.59 -0.33 0.02 0.00 0.00 177.57 177.31 2dn0 h GLU 39 N -0.47 0.23 0.19 1.57 4.39 -1.42 0.28 114.58 119.35 2dn0 h GLU 39 Ca 0.08 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 2dn0 h GLU 39 Cb 0.63 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 2dn0 h GLU 39 CO -0.48 0.16 -0.09 1.25 -1.16 0.00 0.00 179.01 178.68 2dn0 h HIS 40 N 0.24 -0.24 -0.04 4.33 2.76 -0.26 -3.29 115.15 118.66 2dn0 h HIS 40 Ca 0.76 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.96 2dn0 h HIS 40 Cb 1.87 0.08 -0.05 0.00 1.55 0.00 0.00 27.41 30.86 2dn0 h HIS 40 CO -0.01 0.17 -0.23 -0.07 -1.30 0.00 0.00 177.93 176.50 2dn0 h LEU 41 N -0.78 -0.67 -1.97 0.26 3.38 0.72 -0.63 115.31 115.61 2dn0 h LEU 41 Ca -0.03 0.10 0.56 0.00 0.09 0.00 0.00 57.88 58.60 2dn0 h LEU 41 Cb 0.52 0.29 -0.08 0.00 0.09 0.00 0.00 40.66 41.47 2dn0 h LEU 41 CO 0.04 -0.29 1.40 0.71 0.09 0.00 0.00 178.44 180.40 2dn0 h THR 42 N -0.34 0.02 0.05 0.22 1.35 -0.65 1.58 112.91 115.15 2dn0 h THR 42 Ca 0.07 0.00 -0.33 0.00 -0.55 0.00 0.00 66.41 65.60 2dn0 h THR 42 Cb 0.44 0.02 -0.04 0.00 -1.73 0.00 0.00 68.15 66.84 2dn0 h THR 42 CO -0.23 0.00 -1.90 0.29 -0.25 0.00 0.00 175.52 173.43 2dn0 n LYS 43 N -3.92 0.69 -0.01 4.72 5.02 -0.35 -1.56 118.16 122.75 2dn0 n LYS 43 Ca 0.43 0.26 -0.13 0.00 -2.02 0.00 0.00 58.31 56.86 2dn0 n LYS 43 Cb 1.98 -1.73 -0.09 0.00 -0.02 0.00 0.00 35.03 35.17 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 0.03 1.32 0.13 -0.18 2.07 0.32 -3.34 116.25 116.60 2dn0 h VAL 44 Ca -0.37 -0.94 -0.33 0.00 0.82 0.00 0.00 66.70 65.88 2dn0 h VAL 44 Cb 2.03 1.94 -0.01 0.00 -1.52 0.00 0.00 31.29 33.73 2dn0 h VAL 44 CO 0.08 0.25 -1.73 0.71 0.02 0.00 0.00 177.57 176.89 2dn0 h THR 45 N -0.37 0.84 0.00 2.57 1.35 -0.67 -3.44 112.91 113.18 2dn0 h THR 45 Ca 0.00 -2.40 0.00 0.00 -0.55 0.00 0.00 66.41 63.47 2dn0 h THR 45 Cb 0.40 2.62 0.00 0.00 -1.73 0.00 0.00 68.15 69.45 2dn0 h THR 45 CO 0.00 0.80 0.00 0.61 -0.25 0.00 0.00 175.52 176.68 2dn0 n GLY 46 N 1.85 0.71 3.96 5.82 0.00 -0.60 -5.00 105.19 111.94 2dn0 n GLY 46 Ca -0.28 -0.46 -0.22 0.00 0.00 0.00 0.00 46.02 45.06 2dn0 n GLY 46 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dn0 s LEU 47 N 0.00 4.01 0.33 0.99 1.43 -1.24 -5.01 118.68 119.19 2dn0 s LEU 47 Ca 0.00 0.15 -0.28 0.00 -1.03 0.00 0.00 54.13 52.96 2dn0 s LEU 47 Cb 0.00 -3.01 -0.12 0.00 0.03 0.00 0.00 46.19 43.08 2dn0 s LEU 47 CO 0.00 -0.36 1.35 -1.20 0.23 0.00 0.00 176.35 176.37 2dn0 n SER 48 N -1.71 2.97 -0.33 2.29 7.64 -1.26 -4.68 113.62 118.54 2dn0 n SER 48 Ca -0.03 1.20 0.27 0.00 1.01 0.00 0.00 58.87 61.31 2dn0 n SER 48 Cb 0.57 -1.50 0.50 0.00 -1.01 0.00 0.00 64.21 62.77 2dn0 n SER 48 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2dn0 h THR 49 N 2.71 0.09 -0.02 0.44 2.02 -1.96 1.50 112.91 117.68 2dn0 h THR 49 Ca -0.47 -0.03 -0.17 0.00 0.77 0.00 0.00 66.41 66.51 2dn0 h THR 49 Cb 1.27 -0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 2dn0 h THR 49 CO 0.65 0.02 -0.76 0.03 0.37 0.00 0.00 175.52 175.83 2dn0 h ARG 50 N 0.09 0.20 -0.53 6.66 3.08 -1.99 -2.86 114.38 119.02 2dn0 h ARG 50 Ca 0.77 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 60.60 2dn0 h ARG 50 Cb 1.90 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 31.97 2dn0 h ARG 50 CO -0.75 0.87 0.15 0.93 -1.07 0.00 0.00 179.97 180.10 2dn0 h GLU 51 N 0.12 0.80 -0.12 0.04 4.39 0.17 0.13 114.58 120.11 2dn0 h GLU 51 Ca -0.03 -0.15 -0.19 0.00 0.34 0.00 0.00 59.36 59.33 2dn0 h GLU 51 Cb 1.34 -0.13 0.01 0.00 -0.10 0.00 0.00 28.75 29.87 2dn0 h GLU 51 CO 0.12 0.71 -0.66 0.28 -1.16 0.00 0.00 179.01 178.29 2dn0 h VAL 52 N 0.78 1.32 -0.26 3.13 2.07 -1.20 -1.55 116.25 120.54 2dn0 h VAL 52 Ca 0.18 -1.92 -0.13 0.00 0.82 0.00 0.00 66.70 65.65 2dn0 h VAL 52 Cb 0.25 2.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 2dn0 h VAL 52 CO -0.01 0.59 -0.36 0.03 0.02 0.00 0.00 177.57 177.85 2dn0 h ARG 53 N 0.34 0.58 -0.08 1.57 3.08 -1.28 -3.16 114.38 115.43 2dn0 h ARG 53 Ca -0.05 -0.28 -0.06 0.00 0.07 0.00 0.00 59.98 59.67 2dn0 h ARG 53 Cb 1.30 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.35 2dn0 h ARG 53 CO 0.14 0.86 -0.17 -0.22 -1.07 0.00 0.00 179.97 179.50 2dn0 h LYS 54 N 0.49 0.25 -0.86 0.04 3.64 -0.78 -3.24 116.57 116.12 2dn0 h LYS 54 Ca 0.05 -0.17 0.22 0.00 -1.27 0.00 0.00 60.65 59.48 2dn0 h LYS 54 Cb 0.85 0.02 -0.14 0.00 -0.41 0.00 0.00 32.23 32.55 2dn0 h LYS 54 CO 0.07 0.76 0.16 2.35 -2.27 0.00 0.00 179.45 180.52 2dn0 h TRP 55 N -0.22 0.21 -0.91 1.91 7.01 -1.27 0.33 115.95 123.00 2dn0 h TRP 55 Ca 0.00 0.05 0.23 0.00 2.11 0.00 0.00 58.89 61.29 2dn0 h TRP 55 Cb 0.76 0.04 -0.13 0.00 -2.10 0.00 0.00 29.16 27.74 2dn0 h TRP 55 CO 0.11 -0.24 0.40 0.74 -2.79 0.00 0.00 178.44 176.67 2dn0 h PHE 56 N 0.16 0.67 -0.10 2.65 -1.00 -1.57 0.21 116.94 117.97 2dn0 h PHE 56 Ca 0.52 0.04 0.02 0.00 2.81 0.00 0.00 57.97 61.36 2dn0 h PHE 56 Cb 1.02 -0.15 -0.02 0.00 3.61 0.00 0.00 35.95 40.42 2dn0 h PHE 56 CO -0.33 -0.07 -0.00 1.03 -1.61 0.00 0.00 178.31 177.33 2dn0 h SER 57 N 0.38 -0.04 -0.02 2.17 0.87 -0.47 -2.97 113.55 113.47 2dn0 h SER 57 Ca 0.58 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 61.17 2dn0 h SER 57 Cb 1.13 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 63.10 2dn0 h SER 57 CO -0.55 -0.01 -0.24 -0.78 -0.53 0.00 0.00 176.83 174.73 2dn0 h ASP 58 N 0.03 -0.75 -0.86 6.23 3.58 -0.90 -2.00 116.42 121.76 2dn0 h ASP 58 Ca 0.04 0.09 0.14 0.00 0.42 0.00 0.00 57.03 57.72 2dn0 h ASP 58 Cb 0.05 0.29 -0.14 0.00 1.72 0.00 0.00 39.33 41.25 2dn0 h ASP 58 CO -0.08 -0.23 -0.30 -1.14 -2.88 0.00 0.00 179.24 174.61 2dn0 n ARG 59 N -3.82 -0.17 0.08 0.28 3.00 -1.05 -0.07 116.66 114.91 2dn0 n ARG 59 Ca -0.03 1.32 -0.14 0.00 -0.00 0.00 0.00 57.85 59.00 2dn0 n ARG 59 Cb 0.17 -1.96 -0.07 0.00 0.00 0.00 0.00 32.46 30.60 2dn0 n ARG 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2dn0 h ARG 60 N 0.00 -0.58 -0.88 -0.14 3.08 -1.24 0.91 114.38 115.53 2dn0 h ARG 60 Ca 0.33 0.04 0.23 0.00 0.07 0.00 0.00 59.98 60.64 2dn0 h ARG 60 Cb 0.54 0.13 -0.17 0.00 0.08 0.00 0.00 29.97 30.56 2dn0 h ARG 60 CO -0.86 -0.38 -0.04 0.98 -1.07 0.00 0.00 179.97 178.60 2dn0 n TYR 61 N -5.45 0.50 -0.02 3.04 9.36 0.90 0.76 117.16 126.25 2dn0 n TYR 61 Ca -0.06 1.07 -0.16 0.00 3.32 0.00 0.00 57.90 62.06 2dn0 n TYR 61 Cb 0.37 -1.13 -0.09 0.00 -0.63 0.00 0.00 39.34 37.87 2dn0 n TYR 61 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 2dn0 h HIS 62 N 0.00 0.69 -0.27 2.98 2.76 -1.09 -2.70 115.15 117.51 2dn0 h HIS 62 Ca 0.51 -0.32 0.06 0.00 -2.20 0.00 0.00 60.37 58.43 2dn0 h HIS 62 Cb 0.99 -0.10 -0.08 0.00 1.55 0.00 0.00 27.41 29.78 2dn0 h HIS 62 CO -0.50 1.10 -0.31 0.00 -1.30 0.00 0.00 177.93 176.92 2dn0 h ARG 64 N -0.30 0.13 -0.86 0.00 0.11 -1.04 -3.03 114.38 109.39 2dn0 h ARG 64 Ca 0.14 -0.02 0.15 0.00 0.10 0.00 0.00 59.98 60.35 2dn0 h ARG 64 Cb 0.53 -0.02 -0.15 0.00 1.11 0.00 0.00 29.97 31.43 2dn0 h ARG 64 CO -0.44 0.18 -0.33 -0.91 0.10 0.00 0.00 179.97 178.57 2dn0 h ASN 65 N 0.04 -1.19 -0.63 0.08 2.35 -1.05 -3.40 115.58 111.78 2dn0 h ASN 65 Ca 0.03 0.28 -0.79 0.00 -0.55 0.00 0.00 56.30 55.27 2dn0 h ASN 65 Cb 0.09 0.65 -0.01 0.00 0.05 0.00 0.00 38.32 39.10 2dn0 h ASN 65 CO -0.00 -0.29 1.08 0.18 -1.65 0.00 0.00 177.43 176.74 2dn0 n LEU 66 N -5.49 1.25 -4.58 1.61 4.77 -0.79 -4.80 117.00 108.98 2dn0 n LEU 66 Ca 0.10 0.86 -0.41 0.00 -0.03 0.00 0.00 56.01 56.53 2dn0 n LEU 66 Cb 0.40 -0.96 -0.03 0.00 -2.33 0.00 0.00 43.42 40.50 2dn0 n LEU 66 CO -0.08 -0.75 1.45 -0.75 -1.33 0.00 0.00 177.39 175.93 2dn0 s LYS 67 N 4.76 3.10 0.00 3.23 2.20 -1.26 -4.57 119.74 127.20 2dn0 s LYS 67 Ca 1.11 0.81 0.00 0.00 -0.36 0.00 0.00 55.97 57.53 2dn0 s LYS 67 Cb -1.38 -4.23 0.00 0.00 -1.51 0.00 0.00 37.83 30.72 2dn0 s LYS 67 CO 0.69 -2.16 0.00 0.41 -0.36 0.00 0.00 175.35 173.93 2dn0 n GLY 68 N 5.44 1.17 3.37 5.54 0.00 -1.26 -5.17 105.19 114.28 2dn0 n GLY 68 Ca 0.18 -0.20 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 2dn0 n GLY 68 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dn0 s SER 69 N 0.00 -0.49 -0.01 1.61 0.15 -1.26 -5.05 113.70 108.65 2dn0 s SER 69 Ca 0.00 1.15 -0.20 0.00 0.70 0.00 0.00 55.95 57.60 2dn0 s SER 69 Cb 0.00 1.60 -0.26 0.00 -1.71 0.00 0.00 66.02 65.65 2dn0 s SER 69 CO 0.00 -0.23 1.04 0.08 1.20 0.00 0.00 173.24 175.33 2dn0 h ARG 70 N 8.12 0.39 -4.73 5.44 0.11 -2.00 -3.42 114.38 118.28 2dn0 h ARG 70 Ca -0.16 -0.48 -0.66 0.00 0.10 0.00 0.00 59.98 58.78 2dn0 h ARG 70 Cb 1.11 0.15 -0.39 0.00 1.11 0.00 0.00 29.97 31.95 2dn0 h ARG 70 CO 0.12 1.15 -0.76 0.45 0.10 0.00 0.00 179.97 181.03 2dn0 s SER 71 N -6.84 4.58 0.13 0.08 0.15 -1.26 -5.05 113.70 105.50 2dn0 s SER 71 Ca -0.13 -1.79 -0.04 0.00 0.70 0.00 0.00 55.95 54.69 2dn0 s SER 71 Cb 0.03 -1.56 0.02 0.00 -1.71 0.00 0.00 66.02 62.79 2dn0 s SER 71 CO 0.83 -0.29 0.24 0.61 1.20 0.00 0.00 173.24 175.83 2dn0 n GLY 72 N 4.36 1.97 0.24 9.45 0.00 -1.26 -5.05 105.19 114.89 2dn0 n GLY 72 Ca -0.04 -1.20 -0.10 0.00 0.00 0.00 0.00 46.02 44.68 2dn0 n GLY 72 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dn0 h PRO 73 N 0.00 0.70 -7.32 1.61 0.13 -1.98 -3.45 132.00 121.69 2dn0 h PRO 73 Ca -0.11 -0.37 -0.46 0.00 -0.87 0.00 0.00 66.00 64.19 2dn0 h PRO 73 Cb 0.43 0.01 0.16 0.00 0.13 0.00 0.00 31.00 31.73 2dn0 h PRO 73 CO 0.14 0.98 0.19 -1.54 -0.23 0.00 0.00 178.00 177.54 2dn0 s SER 74 N -6.85 2.66 0.20 1.44 1.04 -1.26 -5.06 113.70 105.87 2dn0 s SER 74 Ca -0.09 1.34 0.08 0.00 0.48 0.00 0.00 55.95 57.76 2dn0 s SER 74 Cb 0.12 -2.02 -0.04 0.00 0.10 0.00 0.00 66.02 64.18 2dn0 s SER 74 CO 0.85 -3.13 0.02 -0.44 0.98 0.00 0.00 173.24 171.51 2dn0 s SER 75 N -3.31 4.78 0.00 7.02 0.01 -1.26 -5.06 113.70 115.88 2dn0 s SER 75 Ca 0.65 -0.44 0.22 0.00 1.31 0.00 0.00 55.95 57.69 2dn0 s SER 75 Cb -0.19 -1.01 1.30 0.00 0.21 0.00 0.00 66.02 66.33 2dn0 s SER 75 CO 0.58 0.06 1.68 0.61 0.41 0.00 0.00 173.24 176.58