#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9h s SER 2 N 0.00 4.62 0.43 1.61 0.01 -1.26 -5.10 113.70 114.01 2d9h s SER 2 Ca 0.00 -0.73 0.04 0.00 1.31 0.00 0.00 55.95 56.58 2d9h s SER 2 Cb 0.00 -1.76 -0.05 0.00 0.21 0.00 0.00 66.02 64.42 2d9h s SER 2 CO 0.00 -0.13 0.02 -0.94 0.41 0.00 0.00 173.24 172.60 2d9h s SER 3 N 1.42 3.64 0.09 2.44 1.04 -1.26 -5.17 113.70 115.90 2d9h s SER 3 Ca 0.02 -1.49 0.00 0.00 0.48 0.00 0.00 55.95 54.96 2d9h s SER 3 Cb -0.16 0.02 -0.00 0.00 0.10 0.00 0.00 66.02 65.98 2d9h s SER 3 CO -0.02 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.17 2d9h n GLY 4 N -1.02 4.07 3.75 7.32 0.00 -1.26 -5.11 105.19 112.95 2d9h n GLY 4 Ca -0.09 -2.20 -0.41 0.00 0.00 0.00 0.00 46.02 43.32 2d9h n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9h s SER 5 N -1.49 6.73 0.18 1.61 0.01 -1.26 -4.92 113.70 114.56 2d9h s SER 5 Ca 0.01 2.63 -0.19 0.00 1.31 0.00 0.00 55.95 59.71 2d9h s SER 5 Cb 0.00 -2.63 0.12 0.00 0.21 0.00 0.00 66.02 63.72 2d9h s SER 5 CO 0.00 -0.62 1.62 -1.28 0.41 0.00 0.00 173.24 173.37 2d9h h SER 6 N 4.57 -0.79 -3.90 2.44 0.87 -2.02 -3.48 113.55 111.24 2d9h h SER 6 Ca -0.47 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 2d9h h SER 6 Cb 1.22 0.42 0.00 0.00 -0.44 0.00 0.00 62.40 63.60 2d9h h SER 6 CO 0.74 -0.25 -0.80 0.61 -0.53 0.00 0.00 176.83 176.60 2d9h n GLY 7 N -1.40 -3.93 3.79 5.77 0.00 -1.26 -4.90 105.19 103.26 2d9h n GLY 7 Ca 0.03 -0.91 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 2d9h n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d9h s LEU 8 N -4.75 3.49 -0.13 0.99 1.43 -0.60 -4.89 118.68 114.23 2d9h s LEU 8 Ca 0.00 1.93 -0.02 0.00 -1.03 0.00 0.00 54.13 55.00 2d9h s LEU 8 Cb 0.00 -4.55 0.04 0.00 0.03 0.00 0.00 46.19 41.72 2d9h s LEU 8 CO 0.00 -1.34 0.03 -1.58 0.23 0.00 0.00 176.35 173.69 2d9h s GLN 9 N -3.97 0.55 0.48 1.70 2.00 -1.26 -2.16 119.66 117.00 2d9h s GLN 9 Ca 0.66 -0.13 -0.22 0.00 -2.00 0.00 0.00 55.36 53.67 2d9h s GLN 9 Cb -0.19 -1.53 -0.07 0.00 0.80 0.00 0.00 33.01 32.03 2d9h s GLN 9 CO 0.37 -0.48 1.16 0.00 -0.50 0.00 0.00 175.29 175.83 2d9h n GLU 11 N -0.72 0.69 0.16 0.00 0.28 -1.26 -2.78 120.64 117.01 2d9h n GLU 11 Ca 0.09 -0.02 -0.16 0.00 -0.16 0.00 0.00 57.16 56.91 2d9h n GLU 11 Cb 0.49 -1.52 -0.08 0.00 1.43 0.00 0.00 31.44 31.75 2d9h n GLU 11 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 2d9h h ILE 12 N 0.00 0.10 0.00 3.84 5.03 -1.98 -3.37 117.51 121.12 2d9h h ILE 12 Ca -0.50 0.00 -0.15 0.00 -0.12 0.00 0.00 64.86 64.09 2d9h h ILE 12 Cb 2.14 0.10 -0.03 0.00 -3.03 0.00 0.00 36.82 36.00 2d9h h ILE 12 CO 0.03 0.00 -1.59 0.00 -0.68 0.00 0.00 178.15 175.91 2d9h n GLY 14 N 2.90 1.47 3.97 0.00 0.00 -1.12 -5.08 105.19 107.34 2d9h n GLY 14 Ca -0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 2d9h n GLY 14 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2d9h s PHE 15 N -2.00 1.71 -0.03 1.61 5.36 -1.24 -4.74 117.98 118.65 2d9h s PHE 15 Ca 0.00 -0.08 -0.01 0.00 -0.96 0.00 0.00 56.93 55.88 2d9h s PHE 15 Cb 0.00 -3.26 0.02 0.00 -0.34 0.00 0.00 43.02 39.44 2d9h s PHE 15 CO 0.00 -1.89 0.06 0.95 -1.46 0.00 0.00 175.22 172.89 2d9h s THR 16 N -3.31 -0.03 -0.07 0.12 -4.23 -1.26 0.33 115.64 107.18 2d9h s THR 16 Ca 0.67 0.13 -0.08 0.00 -1.18 0.00 0.00 61.69 61.23 2d9h s THR 16 Cb -0.05 -0.11 0.02 0.00 1.34 0.00 0.00 72.50 73.69 2d9h s THR 16 CO 0.46 0.05 0.21 0.00 -0.54 0.00 0.00 174.62 174.80 2d9h h ARG 18 N 5.58 0.06 -6.30 0.00 -0.00 -1.95 -1.58 114.38 110.18 2d9h h ARG 18 Ca -0.26 -0.10 -0.55 0.00 -0.50 0.00 0.00 59.98 58.57 2d9h h ARG 18 Cb 1.19 0.04 -0.01 0.00 0.00 0.00 0.00 29.97 31.19 2d9h h ARG 18 CO 0.38 1.05 0.91 -0.65 0.00 0.00 0.00 179.97 181.66 2d9h s GLN 19 N -2.28 4.25 0.11 0.04 -0.21 -1.26 -4.75 119.66 115.55 2d9h s GLN 19 Ca -0.20 1.97 -0.27 0.00 0.02 0.00 0.00 55.36 56.88 2d9h s GLN 19 Cb -0.01 -3.72 -0.09 0.00 1.00 0.00 0.00 33.01 30.20 2d9h s GLN 19 CO 0.70 -0.67 1.64 -0.22 -2.12 0.00 0.00 175.29 174.61 2d9h h LYS 20 N 8.35 -0.47 -0.72 2.91 1.63 -2.01 -2.29 116.57 123.97 2d9h h LYS 20 Ca -0.36 0.03 0.14 0.00 -0.85 0.00 0.00 60.65 59.61 2d9h h LYS 20 Cb 1.16 0.11 -0.10 0.00 -0.60 0.00 0.00 32.23 32.80 2d9h h LYS 20 CO 0.93 -0.31 0.23 0.00 -3.45 0.00 0.00 179.45 176.84 2d9h h ALA 21 N 0.22 0.96 -0.26 5.00 0.00 -2.00 -1.49 119.26 121.70 2d9h h ALA 21 Ca 0.03 0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.13 2d9h h ALA 21 Cb 0.51 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.39 2d9h h ALA 21 CO -0.14 -0.27 -0.13 0.77 0.00 0.00 0.00 179.25 179.47 2d9h h SER 22 N 0.35 -0.43 -0.30 0.00 0.02 -1.83 -2.58 113.55 108.79 2d9h h SER 22 Ca 0.40 0.10 0.05 0.00 -0.84 0.00 0.00 61.79 61.49 2d9h h SER 22 Cb 0.63 0.23 -0.08 0.00 0.14 0.00 0.00 62.40 63.32 2d9h h SER 22 CO -0.44 -0.16 -0.52 0.25 -1.14 0.00 0.00 176.83 174.82 2d9h h LEU 23 N -0.09 -1.70 -0.53 5.07 5.85 -0.80 -0.15 115.31 122.96 2d9h h LEU 23 Ca 0.14 0.22 0.08 0.00 0.84 0.00 0.00 57.88 59.16 2d9h h LEU 23 Cb 0.30 0.69 -0.10 0.00 0.37 0.00 0.00 40.66 41.92 2d9h h LEU 23 CO -0.32 -0.43 -0.42 0.78 -0.34 0.00 0.00 178.44 177.71 2d9h h ASN 24 N -0.45 -1.45 -0.33 1.25 2.35 -1.31 0.68 115.58 116.32 2d9h h ASN 24 Ca 0.07 0.24 0.10 0.00 -0.55 0.00 0.00 56.30 56.16 2d9h h ASN 24 Cb 0.63 0.66 -0.01 0.00 0.05 0.00 0.00 38.32 39.64 2d9h h ASN 24 CO -0.53 -0.34 0.28 -0.25 -1.65 0.00 0.00 177.43 174.94 2d9h h TRP 25 N -0.25 0.00 0.00 1.19 2.91 -0.98 0.47 115.95 119.29 2d9h h TRP 25 Ca 0.17 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.19 2d9h h TRP 25 Cb 0.57 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.22 2d9h h TRP 25 CO -0.68 0.00 -0.04 1.25 -1.03 0.00 0.00 178.44 177.94 2d9h h HIS 26 N 0.00 0.00 0.04 2.65 2.76 0.21 -3.33 115.15 117.48 2d9h h HIS 26 Ca 0.16 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 58.04 2d9h h HIS 26 Cb 0.72 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.65 2d9h h HIS 26 CO 0.00 0.00 -1.59 1.04 -1.30 0.00 0.00 177.93 176.08 2d9h n GLN 27 N -2.48 0.63 -0.36 5.26 6.02 0.15 -4.19 117.38 122.41 2d9h n GLN 27 Ca 0.05 0.45 0.26 0.00 -0.01 0.00 0.00 57.00 57.76 2d9h n GLN 27 Cb 0.46 -1.72 0.53 0.00 1.02 0.00 0.00 30.24 30.53 2d9h n GLN 27 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 2d9h h ARG 28 N -0.63 0.30 -0.91 -1.09 0.11 -1.28 0.56 114.38 111.43 2d9h h ARG 28 Ca -0.40 -0.02 0.02 0.00 0.10 0.00 0.00 59.98 59.68 2d9h h ARG 28 Cb 1.57 -0.07 -0.05 0.00 1.11 0.00 0.00 29.97 32.54 2d9h h ARG 28 CO -0.12 0.20 0.60 1.57 0.10 0.00 0.00 179.97 182.31 2d9h h LYS 29 N 0.30 1.17 -1.00 0.08 2.10 -1.73 -2.14 116.57 115.36 2d9h h LYS 29 Ca 0.70 -0.07 0.20 0.00 -2.00 0.00 0.00 60.65 59.48 2d9h h LYS 29 Cb 1.82 -0.26 -0.10 0.00 -0.90 0.00 0.00 32.23 32.79 2d9h h LYS 29 CO -0.44 0.78 0.61 0.45 -2.00 0.00 0.00 179.45 178.85 2d9h h HIS 30 N 1.21 1.02 -0.78 0.07 3.86 -0.04 0.23 115.15 120.71 2d9h h HIS 30 Ca 0.34 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.63 2d9h h HIS 30 Cb -0.11 -0.31 -0.05 0.00 1.06 0.00 0.00 27.41 28.01 2d9h h HIS 30 CO -0.01 0.22 0.51 0.00 0.86 0.00 0.00 177.93 179.51 2d9h h ALA 31 N 1.65 1.57 0.09 2.45 0.00 -1.38 -2.12 119.26 121.50 2d9h h ALA 31 Ca 0.57 -0.03 -0.27 0.00 0.00 0.00 0.00 54.91 55.18 2d9h h ALA 31 Cb 0.95 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2d9h h ALA 31 CO -0.37 0.34 -1.32 0.93 0.00 0.00 0.00 179.25 178.83 2d9h h GLU 32 N 0.92 0.18 -0.61 0.00 4.39 -0.73 -3.24 114.58 115.49 2d9h h GLU 32 Ca 0.32 -0.31 0.00 0.00 0.34 0.00 0.00 59.36 59.71 2d9h h GLU 32 Cb 0.11 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 2d9h h GLU 32 CO -0.10 1.08 0.00 2.41 -1.16 0.00 0.00 179.01 181.24 2d9h n THR 33 N -3.43 0.05 0.26 1.13 -1.04 0.32 -3.88 114.28 107.69 2d9h n THR 33 Ca -0.10 -0.03 0.11 0.00 -2.04 0.00 0.00 64.05 62.00 2d9h n THR 33 Cb 1.01 -0.30 0.71 0.00 -1.82 0.00 0.00 70.33 69.94 2d9h n THR 33 CO 0.00 0.00 0.00 -0.37 -0.64 0.00 0.00 175.07 174.06 2d9h h VAL 34 N 0.09 0.68 -0.53 12.58 -1.51 -1.44 -2.62 116.25 123.51 2d9h h VAL 34 Ca 0.00 -0.47 -0.03 0.00 -1.23 0.00 0.00 66.70 64.97 2d9h h VAL 34 Cb 0.33 1.29 -0.02 0.00 -2.13 0.00 0.00 31.29 30.76 2d9h h VAL 34 CO 0.01 0.11 0.22 0.00 -1.23 0.00 0.00 177.57 176.68 2d9h h ALA 35 N 1.89 0.69 -0.69 5.19 0.00 -1.87 -3.17 119.26 121.29 2d9h h ALA 35 Ca -0.00 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 54.82 2d9h h ALA 35 Cb 0.28 -0.21 -0.10 0.00 0.00 0.00 0.00 17.79 17.76 2d9h h ALA 35 CO 0.01 0.29 -0.56 0.00 0.00 0.00 0.00 179.25 178.99 2d9h h ALA 36 N 1.07 -0.66 -2.48 0.00 0.00 -1.78 -3.39 119.26 112.01 2d9h h ALA 36 Ca 0.18 0.06 -0.54 0.00 0.00 0.00 0.00 54.91 54.61 2d9h h ALA 36 Cb 0.19 1.25 0.05 0.00 0.00 0.00 0.00 17.79 19.27 2d9h h ALA 36 CO -0.02 -1.00 1.03 1.28 0.00 0.00 0.00 179.25 180.55 2d9h n LEU 37 N -5.27 3.86 -0.00 0.00 7.99 -1.20 -4.18 117.00 118.20 2d9h n LEU 37 Ca -0.01 1.02 0.00 0.00 -0.01 0.00 0.00 56.01 57.02 2d9h n LEU 37 Cb 0.30 -1.53 -0.02 0.00 -0.11 0.00 0.00 43.42 42.06 2d9h n LEU 37 CO -0.08 0.10 -0.54 0.54 -1.51 0.00 0.00 177.39 175.90 2d9h n ARG 38 N 4.83 1.49 -3.75 3.23 1.74 0.24 -4.80 116.66 119.65 2d9h n ARG 38 Ca 0.17 -0.01 -0.37 0.00 -0.77 0.00 0.00 57.85 56.87 2d9h n ARG 38 Cb 0.35 -1.05 -0.11 0.00 -1.02 0.00 0.00 32.46 30.62 2d9h n ARG 38 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2d9h s PHE 39 N -2.11 3.50 1.04 -1.55 0.40 -0.68 -4.97 117.98 113.60 2d9h s PHE 39 Ca -0.01 -2.17 -0.13 0.00 -0.60 0.00 0.00 56.93 54.02 2d9h s PHE 39 Cb 0.01 -3.06 0.21 0.00 0.51 0.00 0.00 43.02 40.69 2d9h s PHE 39 CO 0.09 -0.93 1.09 -1.25 0.70 0.00 0.00 175.22 174.92 2d9h s PRO 40 N 1.22 0.12 -0.43 0.24 0.04 -1.26 -1.94 135.00 132.98 2d9h s PRO 40 Ca 0.06 0.42 -0.12 0.00 0.04 0.00 0.00 61.00 61.39 2d9h s PRO 40 Cb -0.23 -1.71 0.06 0.00 0.04 0.00 0.00 34.50 32.67 2d9h s PRO 40 CO -0.03 -2.92 0.31 0.00 0.04 0.00 0.00 177.00 174.41 2d9h n GLU 42 N 5.07 0.37 -0.10 0.00 0.00 -1.26 0.12 120.64 124.83 2d9h n GLU 42 Ca -0.11 0.00 -0.18 0.00 0.00 0.00 0.00 57.16 56.87 2d9h n GLU 42 Cb 0.44 -1.50 -0.08 0.00 0.00 0.00 0.00 31.44 30.30 2d9h n GLU 42 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2d9h n PHE 43 N -1.00 0.68 -0.01 -1.84 3.72 -1.26 -4.80 117.46 112.95 2d9h n PHE 43 Ca 0.09 0.30 -0.01 0.00 -0.05 0.00 0.00 57.45 57.77 2d9h n PHE 43 Cb 0.04 -0.93 -0.02 0.00 -0.94 0.00 0.00 39.48 37.63 2d9h n PHE 43 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2d9h n GLY 45 N 2.99 0.94 3.04 0.00 0.00 0.31 -5.01 105.19 107.46 2d9h n GLY 45 Ca -0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.79 2d9h n GLY 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2d9h n LYS 46 N 0.00 -2.93 -3.73 1.61 5.02 -1.25 -4.03 118.16 112.85 2d9h n LYS 46 Ca 0.00 -0.87 -0.13 0.00 -2.02 0.00 0.00 58.31 55.29 2d9h n LYS 46 Cb 0.00 -1.56 -0.10 0.00 -0.02 0.00 0.00 35.03 33.35 2d9h n LYS 46 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2d9h s ARG 47 N -3.85 0.44 0.04 1.97 0.52 -1.26 0.17 118.95 116.99 2d9h s ARG 47 Ca 0.41 0.57 0.02 0.00 -0.52 0.00 0.00 55.73 56.22 2d9h s ARG 47 Cb -0.07 0.19 -0.02 0.00 0.52 0.00 0.00 34.95 35.56 2d9h s ARG 47 CO 0.35 -0.07 -0.08 -0.06 0.02 0.00 0.00 175.30 175.46 2d9h s PHE 48 N 0.36 0.71 -2.00 -0.53 0.40 -0.82 -4.82 117.98 111.29 2d9h s PHE 48 Ca -0.01 -0.45 0.15 0.00 -0.60 0.00 0.00 56.93 56.02 2d9h s PHE 48 Cb -0.03 -0.43 0.92 0.00 0.51 0.00 0.00 43.02 43.99 2d9h s PHE 48 CO -0.01 -0.06 1.33 -0.85 0.70 0.00 0.00 175.22 176.33 2d9h n GLU 49 N 1.61 0.52 -3.49 0.44 0.28 -1.26 -0.60 120.64 118.14 2d9h n GLU 49 Ca -0.22 0.00 -0.14 0.00 -0.16 0.00 0.00 57.16 56.65 2d9h n GLU 49 Cb 0.55 -1.46 -0.04 0.00 1.43 0.00 0.00 31.44 31.92 2d9h n GLU 49 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 2d9h s LYS 50 N -2.00 1.06 0.10 3.44 -2.85 -1.26 -4.61 119.74 113.62 2d9h s LYS 50 Ca 0.23 -0.10 -0.15 0.00 -1.00 0.00 0.00 55.97 54.95 2d9h s LYS 50 Cb 0.11 0.49 -0.09 0.00 -2.06 0.00 0.00 37.83 36.28 2d9h s LYS 50 CO 0.18 -0.40 1.42 -1.00 0.10 0.00 0.00 175.35 175.64 2d9h h PRO 51 N 2.45 0.70 -1.13 1.78 0.13 -1.91 -3.09 132.00 130.92 2d9h h PRO 51 Ca -0.28 -0.37 0.37 0.00 -0.87 0.00 0.00 66.00 64.85 2d9h h PRO 51 Cb 1.22 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 32.23 2d9h h PRO 51 CO 0.37 0.98 0.69 0.22 -0.23 0.00 0.00 178.00 180.03 2d9h h ASP 52 N 0.44 0.38 0.94 1.44 3.58 -1.99 1.17 116.42 122.38 2d9h h ASP 52 Ca 0.05 0.16 -0.22 0.00 0.42 0.00 0.00 57.03 57.44 2d9h h ASP 52 Cb 0.85 0.13 -0.03 0.00 1.72 0.00 0.00 39.33 42.01 2d9h h ASP 52 CO 0.07 -0.16 -1.06 0.28 -2.88 0.00 0.00 179.24 175.50 2d9h h SER 53 N 0.20 0.04 0.40 2.28 0.02 -1.97 -2.99 113.55 111.53 2d9h h SER 53 Ca 0.76 -0.05 -0.12 0.00 -0.84 0.00 0.00 61.79 61.54 2d9h h SER 53 Cb 2.07 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 64.58 2d9h h SER 53 CO -0.51 1.04 -0.53 0.58 -1.14 0.00 0.00 176.83 176.27 2d9h h VAL 54 N 0.01 1.37 0.05 2.27 2.07 0.13 -0.94 116.25 121.21 2d9h h VAL 54 Ca -0.03 -1.82 -0.25 0.00 0.82 0.00 0.00 66.70 65.42 2d9h h VAL 54 Cb 1.80 1.92 0.01 0.00 -1.52 0.00 0.00 31.29 33.50 2d9h h VAL 54 CO 0.13 0.53 -1.06 0.00 0.02 0.00 0.00 177.57 177.20 2d9h h ALA 55 N 1.34 0.24 -0.08 1.67 0.00 -0.74 -3.23 119.26 118.46 2d9h h ALA 55 Ca 0.00 -0.76 -0.23 0.00 0.00 0.00 0.00 54.91 53.92 2d9h h ALA 55 Cb 0.98 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.78 2d9h h ALA 55 CO 0.08 0.83 -0.86 0.00 0.00 0.00 0.00 179.25 179.30 2d9h h ALA 56 N 0.63 0.33 -0.90 0.00 0.00 -1.45 -3.21 119.26 114.66 2d9h h ALA 56 Ca -0.11 -0.64 0.10 0.00 0.00 0.00 0.00 54.91 54.26 2d9h h ALA 56 Cb 1.72 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 19.44 2d9h h ALA 56 CO 0.18 0.72 0.58 1.25 0.00 0.00 0.00 179.25 181.98 2d9h h HIS 57 N 0.41 0.96 0.00 0.00 -0.00 -1.24 0.20 115.15 115.48 2d9h h HIS 57 Ca -0.07 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.32 2d9h h HIS 57 Cb 1.48 -0.31 -0.00 0.00 -0.00 0.00 0.00 27.41 28.58 2d9h h HIS 57 CO 0.08 0.43 -0.01 0.00 -0.00 0.00 0.00 177.93 178.43 2d9h h ARG 58 N 0.88 0.00 -0.01 5.26 3.08 -1.57 0.61 114.38 122.63 2d9h h ARG 58 Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.47 2d9h h ARG 58 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2d9h h ARG 58 CO -0.19 0.01 -0.26 0.45 -1.07 0.00 0.00 179.97 178.91 2d9h n SER 59 N -3.10 1.34 -0.01 7.04 2.88 0.67 -0.16 113.62 122.27 2d9h n SER 59 Ca -0.01 -1.12 -0.01 0.00 -1.33 0.00 0.00 58.87 56.40 2d9h n SER 59 Cb 0.23 0.18 -0.02 0.00 -0.75 0.00 0.00 64.21 63.85 2d9h n SER 59 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2d9h n LYS 60 N -0.37 3.16 -0.04 -1.46 4.76 -0.51 -4.35 118.16 119.35 2d9h n LYS 60 Ca 0.12 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.53 2d9h n LYS 60 Cb 0.38 -1.05 -0.07 0.00 -1.84 0.00 0.00 35.03 32.45 2d9h n LYS 60 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2d9h n SER 61 N -2.15 2.88 -0.76 4.39 2.88 0.20 -4.62 113.62 116.44 2d9h n SER 61 Ca -0.04 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.53 2d9h n SER 61 Cb 0.57 0.79 0.21 0.00 -0.75 0.00 0.00 64.21 65.02 2d9h n SER 61 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2d9h n HIS 62 N -2.26 0.31 0.58 0.66 8.25 -0.54 -4.71 115.22 117.51 2d9h n HIS 62 Ca -0.13 -1.53 0.07 0.00 -0.26 0.00 0.00 57.72 55.88 2d9h n HIS 62 Cb 0.72 -0.32 0.33 0.00 1.12 0.00 0.00 29.99 31.85 2d9h n HIS 62 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2d9h n PRO 63 N -1.12 0.09 0.02 -0.41 -0.04 0.77 -1.98 135.00 132.32 2d9h n PRO 63 Ca 0.23 0.21 0.11 0.00 -0.04 0.00 0.00 63.50 64.01 2d9h n PRO 63 Cb 0.79 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.79 2d9h n PRO 63 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2d9h n ALA 64 N -1.40 3.59 -0.10 0.55 0.00 -1.26 -4.26 120.51 117.62 2d9h n ALA 64 Ca 0.05 -0.42 -0.18 0.00 0.00 0.00 0.00 53.44 52.89 2d9h n ALA 64 Cb 0.14 -0.97 -0.08 0.00 0.00 0.00 0.00 19.45 18.54 2d9h n ALA 64 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2d9h n LEU 65 N -1.83 1.88 -0.36 0.00 4.77 -0.84 -4.43 117.00 116.19 2d9h n LEU 65 Ca 0.03 0.44 0.05 0.00 -0.03 0.00 0.00 56.01 56.50 2d9h n LEU 65 Cb 0.41 -0.88 0.13 0.00 -2.33 0.00 0.00 43.42 40.75 2d9h n LEU 65 CO 0.40 0.12 0.65 -0.07 -1.33 0.00 0.00 177.39 177.16 2d9h h LEU 66 N -1.00 -0.97-10.53 2.23 3.38 -1.74 -3.40 115.31 103.29 2d9h h LEU 66 Ca -0.32 0.30 -0.44 0.00 0.09 0.00 0.00 57.88 57.52 2d9h h LEU 66 Cb 1.17 0.63 0.17 0.00 0.09 0.00 0.00 40.66 42.72 2d9h h LEU 66 CO -0.19 -0.33 0.25 -0.76 0.09 0.00 0.00 178.44 177.50 2d9h s LEU 67 N -11.23 1.58 0.52 1.67 1.43 -1.26 -4.98 118.68 106.40 2d9h s LEU 67 Ca -0.15 0.65 -0.22 0.00 -1.03 0.00 0.00 54.13 53.38 2d9h s LEU 67 Cb 0.26 -2.63 -0.06 0.00 0.03 0.00 0.00 46.19 43.80 2d9h s LEU 67 CO 0.77 -3.34 1.25 0.00 0.23 0.00 0.00 176.35 175.26 2d9h n ALA 68 N -4.24 1.19 -1.06 4.21 0.00 -1.26 -4.99 120.51 114.36 2d9h n ALA 68 Ca 0.12 0.14 -0.19 0.00 0.00 0.00 0.00 53.44 53.50 2d9h n ALA 68 Cb 0.59 -2.28 0.25 0.00 0.00 0.00 0.00 19.45 18.01 2d9h n ALA 68 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2d9h n PRO 69 N -0.72 -3.14 -4.09 0.00 -0.04 -1.26 -4.93 135.00 120.82 2d9h n PRO 69 Ca 0.10 -1.74 -0.33 0.00 -0.04 0.00 0.00 63.50 61.49 2d9h n PRO 69 Cb 0.44 -1.63 -0.15 0.00 -0.04 0.00 0.00 33.50 32.11 2d9h n PRO 69 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2d9h s GLN 70 N -5.47 2.74 0.30 0.54 -1.52 -1.26 -5.00 119.66 110.00 2d9h s GLN 70 Ca 0.71 -1.01 0.08 0.00 -1.95 0.00 0.00 55.36 53.19 2d9h s GLN 70 Cb -0.07 -2.72 0.89 0.00 -0.22 0.00 0.00 33.01 30.89 2d9h s GLN 70 CO 0.54 -0.34 1.44 -0.85 -0.25 0.00 0.00 175.29 175.83 2d9h n GLU 71 N 4.57 -0.07 -1.80 2.91 0.28 -1.26 -4.37 120.64 120.90 2d9h n GLU 71 Ca -0.18 1.34 -0.31 0.00 -0.16 0.00 0.00 57.16 57.84 2d9h n GLU 71 Cb 0.47 -2.22 0.03 0.00 1.43 0.00 0.00 31.44 31.15 2d9h n GLU 71 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 2d9h s SER 72 N -4.85 5.74 -0.16 -1.84 0.01 -1.26 -5.08 113.70 106.26 2d9h s SER 72 Ca -0.11 1.61 -0.13 0.00 1.31 0.00 0.00 55.95 58.63 2d9h s SER 72 Cb 0.28 -2.50 0.05 0.00 0.21 0.00 0.00 66.02 64.06 2d9h s SER 72 CO 0.72 -1.20 0.42 -0.55 0.41 0.00 0.00 173.24 173.05 2d9h s SER 73 N -3.62 -0.48 -0.01 2.44 0.15 -1.26 -5.15 113.70 105.77 2d9h s SER 73 Ca 0.58 0.88 -0.18 0.00 0.70 0.00 0.00 55.95 57.94 2d9h s SER 73 Cb -0.13 0.85 -0.06 0.00 -1.71 0.00 0.00 66.02 64.97 2d9h s SER 73 CO 0.49 -0.16 0.49 -0.83 1.20 0.00 0.00 173.24 174.43 2d9h s GLY 74 N 0.64 2.53 1.04 9.45 0.00 -1.26 -5.08 107.32 114.64 2d9h s GLY 74 Ca -0.03 -0.11 -0.13 0.00 0.00 0.00 0.00 44.72 44.44 2d9h s GLY 74 CO -0.04 0.47 1.10 2.56 0.00 0.00 0.00 173.10 177.18 2d9h s PRO 75 N -0.54 0.09 -0.12 2.90 0.04 -1.26 -5.08 135.00 131.03 2d9h s PRO 75 Ca 0.27 0.40 -0.05 0.00 0.04 0.00 0.00 61.00 61.66 2d9h s PRO 75 Cb -0.17 -1.71 0.05 0.00 0.04 0.00 0.00 34.50 32.72 2d9h s PRO 75 CO 0.15 -2.94 0.25 -1.54 0.04 0.00 0.00 177.00 172.96 2d9h s SER 76 N -3.51 0.05 0.13 6.66 1.04 -1.26 -5.03 113.70 111.78 2d9h s SER 76 Ca 0.66 0.55 -0.02 0.00 0.48 0.00 0.00 55.95 57.63 2d9h s SER 76 Cb -0.17 0.54 -0.09 0.00 0.10 0.00 0.00 66.02 66.40 2d9h s SER 76 CO 0.57 -0.20 1.31 0.77 0.98 0.00 0.00 173.24 176.67 2d9h h SER 77 N 7.74 0.42 0.00 7.02 4.64 -2.08 -3.58 113.55 127.70 2d9h h SER 77 Ca -0.28 -0.35 0.00 0.00 -0.47 0.00 0.00 61.79 60.70 2d9h h SER 77 Cb 1.14 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 2d9h h SER 77 CO 0.26 1.16 0.00 0.61 -0.87 0.00 0.00 176.83 177.99