#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dbd s SER 2 N 0.00 6.22 0.39 1.61 1.04 -1.26 -5.00 113.70 116.69 2dbd s SER 2 Ca 0.00 -2.57 0.00 0.00 0.48 0.00 0.00 55.95 53.86 2dbd s SER 2 Cb 0.00 -2.10 0.00 0.00 0.10 0.00 0.00 66.02 64.02 2dbd s SER 2 CO 0.00 -0.56 0.00 -1.20 0.98 0.00 0.00 173.24 172.46 2dbd n SER 3 N 4.07 -8.64 -1.31 7.02 7.64 -1.26 -5.04 113.62 116.10 2dbd n SER 3 Ca 0.07 0.72 0.00 0.00 1.01 0.00 0.00 58.87 60.68 2dbd n SER 3 Cb 0.43 -4.48 0.00 0.00 -1.01 0.00 0.00 64.21 59.15 2dbd n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dbd n GLY 4 N -4.28 -3.87 1.88 0.23 0.00 -1.26 -5.05 105.19 92.85 2dbd n GLY 4 Ca -0.01 -0.43 -0.04 0.00 0.00 0.00 0.00 46.02 45.54 2dbd n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dbd n SER 5 N 0.58 -1.07 0.10 1.61 3.41 -1.26 -4.83 113.62 112.16 2dbd n SER 5 Ca 0.00 -2.11 0.00 0.00 -0.26 0.00 0.00 58.87 56.50 2dbd n SER 5 Cb 0.00 0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 2dbd n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2dbd n SER 6 N -0.75 -0.05 0.00 4.04 2.88 -1.26 -5.06 113.62 113.41 2dbd n SER 6 Ca -0.21 0.32 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 2dbd n SER 6 Cb 0.80 0.25 0.00 0.00 -0.75 0.00 0.00 64.21 64.51 2dbd n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dbd n GLY 7 N 1.66 3.10 3.00 0.46 0.00 -1.26 -4.97 105.19 107.18 2dbd n GLY 7 Ca 0.00 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 44.76 2dbd n GLY 7 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2dbd s HIS 8 N -0.67 3.29 0.22 1.61 4.02 -1.26 -4.94 115.29 117.56 2dbd s HIS 8 Ca 0.00 -3.02 0.28 0.00 1.02 0.00 0.00 55.06 53.34 2dbd s HIS 8 Cb 0.00 -2.95 1.22 0.00 -1.02 0.00 0.00 32.58 29.83 2dbd s HIS 8 CO 0.00 -0.79 1.95 -1.00 1.02 0.00 0.00 174.74 175.92 2dbd h PRO 9 N 6.74 0.00 0.06 8.40 0.13 -1.99 -1.20 132.00 144.13 2dbd h PRO 9 Ca -0.06 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.72 2dbd h PRO 9 Cb 0.92 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.01 2dbd h PRO 9 CO 0.69 0.14 -2.05 0.72 -0.23 0.00 0.00 178.00 177.26 2dbd n HIS 10 N -3.36 0.83 0.12 1.56 8.25 -1.26 -3.86 115.22 117.49 2dbd n HIS 10 Ca -0.00 0.22 -0.03 0.00 -0.26 0.00 0.00 57.72 57.64 2dbd n HIS 10 Cb 0.34 -1.12 0.11 0.00 1.12 0.00 0.00 29.99 30.44 2dbd n HIS 10 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2dbd h ILE 11 N 0.03 1.48 -0.05 1.59 2.04 -1.88 -3.10 117.51 117.62 2dbd h ILE 11 Ca -0.43 -2.34 -0.12 0.00 1.00 0.00 0.00 64.86 62.97 2dbd h ILE 11 Cb 2.03 2.26 -0.01 0.00 -0.74 0.00 0.00 36.82 40.36 2dbd h ILE 11 CO 0.05 0.67 -0.50 1.56 0.00 0.00 0.00 178.15 179.93 2dbd h GLN 12 N 0.02 0.13 -0.10 2.37 1.08 -1.39 -2.86 115.11 114.37 2dbd h GLN 12 Ca -0.01 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.12 2dbd h GLN 12 Cb 1.23 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.65 2dbd h GLN 12 CO 0.09 0.61 0.07 -0.07 -0.95 0.00 0.00 178.83 178.58 2dbd h LEU 13 N 0.11 0.12 0.14 1.46 3.38 -1.65 0.71 115.31 119.59 2dbd h LEU 13 Ca 0.00 -0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.72 2dbd h LEU 13 Cb 0.92 -0.03 0.03 0.00 0.09 0.00 0.00 40.66 41.67 2dbd h LEU 13 CO 0.07 0.09 -1.06 -0.07 0.09 0.00 0.00 178.44 177.56 2dbd h LEU 14 N 0.14 0.68 0.05 1.67 3.38 -1.61 -2.48 115.31 117.14 2dbd h LEU 14 Ca 0.04 -0.88 -0.00 0.00 0.09 0.00 0.00 57.88 57.12 2dbd h LEU 14 Cb -0.02 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.52 2dbd h LEU 14 CO -0.01 1.51 -0.03 0.11 0.09 0.00 0.00 178.44 180.11 2dbd h LYS 15 N -0.04 -0.07 -0.58 1.13 1.57 -1.31 0.93 116.57 118.21 2dbd h LYS 15 Ca -0.17 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.63 2dbd h LYS 15 Cb 1.80 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 34.09 2dbd h LYS 15 CO 0.20 0.51 0.38 1.03 -0.57 0.00 0.00 179.45 181.01 2dbd h SER 16 N -0.75 0.63 -0.79 0.86 0.87 0.27 -2.50 113.55 112.15 2dbd h SER 16 Ca -0.01 -0.01 -0.56 0.00 -1.23 0.00 0.00 61.79 59.98 2dbd h SER 16 Cb 0.62 -0.15 -0.38 0.00 -0.44 0.00 0.00 62.40 62.04 2dbd h SER 16 CO 0.01 0.45 -0.39 0.59 -0.53 0.00 0.00 176.83 176.96 2dbd n ASN 17 N -4.46 5.46 0.28 6.23 3.02 -0.93 -4.79 115.26 120.07 2dbd n ASN 17 Ca 0.06 -3.76 -0.12 0.00 -0.03 0.00 0.00 54.58 50.73 2dbd n ASN 17 Cb 0.08 -0.50 -0.06 0.00 -0.61 0.00 0.00 39.78 38.69 2dbd n ASN 17 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 2dbd h ARG 18 N 2.08 -0.74 -0.18 3.52 2.43 -0.33 -1.22 114.38 119.94 2dbd h ARG 18 Ca 0.42 0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.66 2dbd h ARG 18 Cb 1.36 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 31.07 2dbd h ARG 18 CO 0.94 -0.49 0.12 1.05 -1.51 0.00 0.00 179.97 180.08 2dbd h GLU 19 N -1.15 0.13 -0.16 0.20 4.11 -1.84 -1.21 114.58 114.65 2dbd h GLU 19 Ca -0.08 -0.01 -0.16 0.00 0.07 0.00 0.00 59.36 59.18 2dbd h GLU 19 Cb 0.59 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2dbd h GLU 19 CO 0.13 0.09 -0.58 1.25 0.07 0.00 0.00 179.01 179.96 2dbd h LEU 20 N 0.13 0.58 -0.54 3.06 5.85 -1.89 -3.10 115.31 119.41 2dbd h LEU 20 Ca 0.08 -0.32 -0.16 0.00 0.84 0.00 0.00 57.88 58.31 2dbd h LEU 20 Cb 0.14 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 2dbd h LEU 20 CO -0.01 1.03 -0.71 -0.07 -0.34 0.00 0.00 178.44 178.34 2dbd h LEU 21 N 0.39 0.18 -1.60 2.25 3.38 -0.10 -0.03 115.31 119.78 2dbd h LEU 21 Ca 0.00 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 2dbd h LEU 21 Cb 1.13 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2dbd h LEU 21 CO 0.11 0.83 -0.21 0.58 0.09 0.00 0.00 178.44 179.84 2dbd h VAL 22 N 0.10 1.08 0.04 1.22 2.07 -1.22 -0.80 116.25 118.74 2dbd h VAL 22 Ca -0.02 -0.74 -0.36 0.00 0.82 0.00 0.00 66.70 66.40 2dbd h VAL 22 Cb 1.26 1.41 -0.05 0.00 -1.52 0.00 0.00 31.29 32.39 2dbd h VAL 22 CO 0.10 0.21 -2.09 0.41 0.02 0.00 0.00 177.57 176.23 2dbd n THR 23 N -4.18 1.60 0.25 2.57 -1.04 -1.16 -4.51 114.28 107.81 2dbd n THR 23 Ca -0.02 -0.44 -0.16 0.00 -2.04 0.00 0.00 64.05 61.38 2dbd n THR 23 Cb 0.28 -1.74 -0.08 0.00 -1.82 0.00 0.00 70.33 66.96 2dbd n THR 23 CO 0.00 0.00 0.00 0.45 -0.64 0.00 0.00 175.07 174.88 2dbd h HIS 24 N -0.39 -0.58 -3.18 -1.42 -0.00 -0.98 -3.41 115.15 105.18 2dbd h HIS 24 Ca -0.51 -0.01 -0.53 0.00 -0.00 0.00 0.00 60.37 59.32 2dbd h HIS 24 Cb 1.76 0.20 0.02 0.00 -0.00 0.00 0.00 27.41 29.39 2dbd h HIS 24 CO 0.04 -0.36 0.66 0.42 -0.00 0.00 0.00 177.93 178.69 2dbd s ILE 25 N -6.10 3.41 0.00 2.45 1.01 -0.31 -4.69 121.20 116.97 2dbd s ILE 25 Ca -0.16 1.06 0.00 0.00 0.00 0.00 0.00 60.65 61.55 2dbd s ILE 25 Cb 0.04 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.83 2dbd s ILE 25 CO 0.63 0.11 0.00 0.54 0.00 0.00 0.00 174.94 176.23 2dbd n ARG 26 N 3.43 0.00 -2.80 2.79 1.74 -1.26 -4.81 116.66 115.75 2dbd n ARG 26 Ca 0.09 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.74 2dbd n ARG 26 Cb 0.43 -0.86 -0.02 0.00 -1.02 0.00 0.00 32.46 30.99 2dbd n ARG 26 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2dbd s ASN 27 N -4.24 6.70 0.18 0.55 0.01 -1.26 -4.80 114.94 112.08 2dbd s ASN 27 Ca 0.00 -2.10 -0.01 0.00 -0.71 0.00 0.00 52.86 50.04 2dbd s ASN 27 Cb 0.00 -2.46 0.07 0.00 0.41 0.00 0.00 41.25 39.27 2dbd s ASN 27 CO 0.00 -1.13 1.44 0.71 -1.51 0.00 0.00 177.10 176.61 2dbd h THR 28 N 5.84 1.38 -0.10 1.60 1.35 -1.99 -3.09 112.91 117.91 2dbd h THR 28 Ca 0.23 -2.14 -0.05 0.00 -0.55 0.00 0.00 66.41 63.90 2dbd h THR 28 Cb 0.98 2.11 -0.01 0.00 -1.73 0.00 0.00 68.15 69.50 2dbd h THR 28 CO 1.25 0.64 -0.17 1.56 -0.25 0.00 0.00 175.52 178.55 2dbd h GLN 29 N 0.26 0.16 0.15 4.72 1.08 -1.99 -2.16 115.11 117.33 2dbd h GLN 29 Ca -0.03 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.13 2dbd h GLN 29 Cb 1.29 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.70 2dbd h GLN 29 CO 0.12 0.33 -0.07 0.00 -0.95 0.00 0.00 178.83 178.26 2dbd h LEU 31 N -0.49 0.99 -0.75 0.00 3.38 -1.53 -1.56 115.31 115.35 2dbd h LEU 31 Ca -0.02 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 2dbd h LEU 31 Cb 0.38 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2dbd h LEU 31 CO 0.03 0.73 -0.52 0.58 0.09 0.00 0.00 178.44 179.36 2dbd h VAL 32 N 1.17 1.35 0.08 1.22 2.07 -1.35 -1.94 116.25 118.85 2dbd h VAL 32 Ca 0.31 -1.77 -0.00 0.00 0.82 0.00 0.00 66.70 66.06 2dbd h VAL 32 Cb -0.12 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 2dbd h VAL 32 CO -0.07 0.53 -0.04 0.44 0.02 0.00 0.00 177.57 178.46 2dbd h ASP 33 N 0.22 -0.09 -0.49 0.57 3.32 -0.01 -1.01 116.42 118.92 2dbd h ASP 33 Ca 0.01 -0.23 -0.05 0.00 0.02 0.00 0.00 57.03 56.78 2dbd h ASP 33 Cb 0.98 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.54 2dbd h ASP 33 CO 0.08 0.19 0.13 0.78 -1.72 0.00 0.00 179.24 178.70 2dbd h ASN 34 N -0.37 0.74 -0.00 6.45 2.35 -1.32 -1.21 115.58 122.22 2dbd h ASN 34 Ca -0.01 -0.23 -0.03 0.00 -0.55 0.00 0.00 56.30 55.49 2dbd h ASN 34 Cb 0.32 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 2dbd h ASN 34 CO 0.02 0.77 -0.06 -0.07 -1.65 0.00 0.00 177.43 176.44 2dbd h LEU 35 N 0.67 0.15 -0.04 1.61 3.38 -1.33 -1.24 115.31 118.51 2dbd h LEU 35 Ca 0.16 -0.02 -0.25 0.00 0.09 0.00 0.00 57.88 57.85 2dbd h LEU 35 Cb 0.32 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.04 2dbd h LEU 35 CO 0.00 0.24 -1.08 -0.07 0.09 0.00 0.00 178.44 177.62 2dbd h LEU 36 N 0.16 0.59 -0.73 1.67 3.38 -0.79 0.26 115.31 119.85 2dbd h LEU 36 Ca 0.04 -0.52 -0.12 0.00 0.09 0.00 0.00 57.88 57.36 2dbd h LEU 36 Cb 0.21 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2dbd h LEU 36 CO 0.01 1.35 -0.35 0.50 0.09 0.00 0.00 178.44 180.03 2dbd h LYS 37 N 0.21 0.57 -0.01 1.13 3.11 -0.72 -2.51 116.57 118.35 2dbd h LYS 37 Ca -0.12 -0.27 0.00 0.00 -2.81 0.00 0.00 60.65 57.46 2dbd h LYS 37 Cb 1.74 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 32.96 2dbd h LYS 37 CO 0.19 0.84 0.00 0.09 -2.81 0.00 0.00 179.45 177.76 2dbd n ASN 38 N -4.06 0.38 -2.75 4.20 3.02 -0.51 -4.92 115.26 110.62 2dbd n ASN 38 Ca -0.01 -1.15 -0.11 0.00 -0.03 0.00 0.00 54.58 53.28 2dbd n ASN 38 Cb 0.48 -0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.71 2dbd n ASN 38 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2dbd n ASP 39 N -0.69 -4.04 -0.03 6.41 9.92 -0.95 -4.98 116.55 122.20 2dbd n ASP 39 Ca 0.22 -0.48 -0.04 0.00 -0.53 0.00 0.00 54.79 53.96 2dbd n ASP 39 Cb 0.17 -3.85 -0.02 0.00 -0.64 0.00 0.00 41.12 36.78 2dbd n ASP 39 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2dbd n TYR 40 N -2.93 0.00 -3.92 1.24 4.01 0.91 -5.03 117.16 111.44 2dbd n TYR 40 Ca -0.11 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.29 2dbd n TYR 40 Cb 0.60 -0.19 -0.05 0.00 -0.31 0.00 0.00 39.34 39.38 2dbd n TYR 40 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2dbd s PHE 41 N -2.10 3.54 0.32 -0.72 0.40 -1.10 -5.01 117.98 113.31 2dbd s PHE 41 Ca -0.07 0.39 0.07 0.00 -0.60 0.00 0.00 56.93 56.72 2dbd s PHE 41 Cb 0.02 -1.85 -0.02 0.00 0.51 0.00 0.00 43.02 41.68 2dbd s PHE 41 CO 0.11 0.66 0.37 -1.12 0.70 0.00 0.00 175.22 175.95 2dbd s SER 42 N -1.68 5.70 0.26 1.36 0.01 -1.26 -4.70 113.70 113.40 2dbd s SER 42 Ca 0.24 -0.29 -0.04 0.00 1.31 0.00 0.00 55.95 57.17 2dbd s SER 42 Cb -0.12 -1.19 0.35 0.00 0.21 0.00 0.00 66.02 65.27 2dbd s SER 42 CO 0.14 -0.35 1.92 0.00 0.41 0.00 0.00 173.24 175.36 2dbd h ALA 43 N 1.09 1.35 0.00 1.44 0.00 -1.99 -0.76 119.26 120.39 2dbd h ALA 43 Ca -0.46 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 2dbd h ALA 43 Cb 1.25 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 2dbd h ALA 43 CO 0.56 0.56 -0.04 0.93 0.00 0.00 0.00 179.25 181.26 2dbd h GLU 44 N 1.26 0.00 0.00 0.00 5.08 -1.99 -0.62 114.58 118.30 2dbd h GLU 44 Ca 0.39 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.71 2dbd h GLU 44 Cb -0.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2dbd h GLU 44 CO -0.11 0.04 -0.22 -0.44 -1.00 0.00 0.00 179.01 177.28 2dbd h ASP 45 N 0.00 0.00 -0.11 1.42 3.32 -1.58 -3.28 116.42 116.18 2dbd h ASP 45 Ca -0.00 -0.83 0.03 0.00 0.02 0.00 0.00 57.03 56.25 2dbd h ASP 45 Cb 0.08 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 2dbd h ASP 45 CO 0.01 1.04 0.08 0.00 -1.72 0.00 0.00 179.24 178.65 2dbd h ALA 46 N -0.17 2.10 -0.25 3.45 0.00 -1.05 -1.05 119.26 122.29 2dbd h ALA 46 Ca -0.06 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 2dbd h ALA 46 Cb 0.97 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2dbd h ALA 46 CO -0.04 -0.13 -0.22 1.49 0.00 0.00 0.00 179.25 180.35 2dbd h GLU 47 N 0.00 0.45 -0.14 0.00 4.81 -1.23 -2.55 114.58 115.92 2dbd h GLU 47 Ca 0.05 -0.16 -0.18 0.00 -0.13 0.00 0.00 59.36 58.95 2dbd h GLU 47 Cb 0.21 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.56 2dbd h GLU 47 CO -0.00 0.65 -0.61 0.82 -0.73 0.00 0.00 179.01 179.14 2dbd h ILE 48 N 0.41 1.32 0.55 2.32 2.04 -1.26 -2.59 117.51 120.29 2dbd h ILE 48 Ca 0.06 -1.86 -0.02 0.00 1.00 0.00 0.00 64.86 64.04 2dbd h ILE 48 Cb 0.61 2.06 -0.00 0.00 -0.74 0.00 0.00 36.82 38.75 2dbd h ILE 48 CO 0.04 0.58 -0.32 0.58 0.00 0.00 0.00 178.15 179.03 2dbd h VAL 49 N 0.33 0.35 -0.03 1.67 2.07 -1.35 -2.39 116.25 116.90 2dbd h VAL 49 Ca -0.04 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.49 2dbd h VAL 49 Cb 1.24 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2dbd h VAL 49 CO 0.13 0.00 0.02 0.00 0.02 0.00 0.00 177.57 177.73 2dbd h ALA 51 N 1.99 1.51 -2.70 0.00 0.00 -1.01 -3.43 119.26 115.62 2dbd h ALA 51 Ca 0.01 -0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.35 2dbd h ALA 51 Cb 0.05 0.01 0.15 0.00 0.00 0.00 0.00 17.79 17.99 2dbd h ALA 51 CO -0.00 -0.18 0.23 0.00 0.00 0.00 0.00 179.25 179.30 2dbd h PRO 53 N 1.14 0.40 0.00 0.00 0.13 -1.89 -3.48 132.00 128.30 2dbd h PRO 53 Ca -0.47 -0.44 -0.42 0.00 -0.87 0.00 0.00 66.00 63.79 2dbd h PRO 53 Cb 1.34 0.13 -0.05 0.00 0.13 0.00 0.00 31.00 32.55 2dbd h PRO 53 CO 0.55 1.11 -0.24 0.25 -0.23 0.00 0.00 178.00 179.44 2dbd n THR 54 N -4.22 0.00 -0.05 1.56 -2.24 -1.26 -5.08 114.28 102.99 2dbd n THR 54 Ca -0.11 -1.58 -0.10 0.00 -2.27 0.00 0.00 64.05 59.99 2dbd n THR 54 Cb 0.68 -0.01 -0.09 0.00 -2.10 0.00 0.00 70.33 68.81 2dbd n THR 54 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2dbd h GLN 55 N 0.00 -0.02 -0.78 -0.78 5.75 -2.00 -3.23 115.11 114.05 2dbd h GLN 55 Ca -0.26 0.00 0.23 0.00 -0.15 0.00 0.00 58.65 58.47 2dbd h GLN 55 Cb 0.90 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.42 2dbd h GLN 55 CO 0.42 0.66 0.64 -1.35 -2.65 0.00 0.00 178.83 176.55 2dbd h PRO 56 N -0.97 0.00 -0.01 -2.39 0.11 -1.96 0.31 132.00 127.08 2dbd h PRO 56 Ca -0.00 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.90 2dbd h PRO 56 Cb 0.69 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.80 2dbd h PRO 56 CO 0.00 0.00 -0.89 0.22 -0.21 0.00 0.00 178.00 177.12 2dbd h ASP 57 N 0.00 0.46 -0.06 -2.05 3.58 -1.95 -3.14 116.42 113.25 2dbd h ASP 57 Ca 0.37 -0.36 -0.00 0.00 0.42 0.00 0.00 57.03 57.46 2dbd h ASP 57 Cb 1.66 -0.14 -0.00 0.00 1.72 0.00 0.00 39.33 42.56 2dbd h ASP 57 CO -0.00 1.15 0.02 0.11 -2.88 0.00 0.00 179.24 177.63 2dbd h LYS 58 N 0.21 0.10 -0.65 0.28 1.57 -0.42 -2.22 116.57 115.44 2dbd h LYS 58 Ca -0.06 -0.02 0.08 0.00 -1.87 0.00 0.00 60.65 58.78 2dbd h LYS 58 Cb 1.52 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.77 2dbd h LYS 58 CO 0.15 0.25 0.43 0.28 -0.57 0.00 0.00 179.45 179.99 2dbd h VAL 59 N -0.08 0.96 -0.04 0.50 2.07 -1.56 -0.29 116.25 117.81 2dbd h VAL 59 Ca 0.02 -0.20 -0.12 0.00 0.82 0.00 0.00 66.70 67.22 2dbd h VAL 59 Cb 0.19 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 2dbd h VAL 59 CO -0.00 0.10 -0.55 -0.09 0.02 0.00 0.00 177.57 177.05 2dbd h ARG 60 N 0.58 0.11 -0.27 1.57 2.43 -1.45 -2.92 114.38 114.42 2dbd h ARG 60 Ca 0.29 -0.07 -0.16 0.00 -0.81 0.00 0.00 59.98 59.23 2dbd h ARG 60 Cb 0.39 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 2dbd h ARG 60 CO -0.09 0.63 -0.48 -0.22 -1.51 0.00 0.00 179.97 178.30 2dbd h LYS 61 N 0.08 0.74 -0.59 0.20 1.63 -0.46 -2.78 116.57 115.39 2dbd h LYS 61 Ca -0.00 -0.42 -0.06 0.00 -0.85 0.00 0.00 60.65 59.32 2dbd h LYS 61 Cb 1.00 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.64 2dbd h LYS 61 CO 0.08 1.05 0.14 0.82 -3.45 0.00 0.00 179.45 178.09 2dbd h ILE 62 N 0.58 1.25 -0.41 2.00 2.04 -1.30 -2.22 117.51 119.45 2dbd h ILE 62 Ca 0.03 -0.90 -0.01 0.00 1.00 0.00 0.00 64.86 64.98 2dbd h ILE 62 Cb 1.04 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 2dbd h ILE 62 CO 0.10 0.33 0.22 -0.07 0.00 0.00 0.00 178.15 178.74 2dbd h LEU 63 N 0.85 0.52 -1.53 1.44 3.38 -1.48 -0.81 115.31 117.68 2dbd h LEU 63 Ca 0.18 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2dbd h LEU 63 Cb 0.35 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 2dbd h LEU 63 CO 0.00 0.46 0.09 -0.78 0.09 0.00 0.00 178.44 178.30 2dbd h ASP 64 N 0.53 0.36 0.17 -0.43 1.82 -1.35 -0.02 116.42 117.49 2dbd h ASP 64 Ca 0.14 -0.03 -0.01 0.00 -0.39 0.00 0.00 57.03 56.74 2dbd h ASP 64 Cb 0.06 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 39.98 2dbd h ASP 64 CO -0.02 0.35 -0.08 -0.07 -1.61 0.00 0.00 179.24 177.81 2dbd h LEU 65 N 0.40 -0.19 -0.38 2.28 3.38 -0.86 -2.46 115.31 117.48 2dbd h LEU 65 Ca 0.10 -0.35 0.02 0.00 0.09 0.00 0.00 57.88 57.74 2dbd h LEU 65 Cb 0.12 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2dbd h LEU 65 CO -0.01 0.33 0.22 0.58 0.09 0.00 0.00 178.44 179.66 2dbd h VAL 66 N -0.80 1.04 -0.10 1.22 2.07 -1.02 0.66 116.25 119.32 2dbd h VAL 66 Ca -0.02 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.35 2dbd h VAL 66 Cb 0.53 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2dbd h VAL 66 CO 0.04 0.08 0.06 1.56 0.02 0.00 0.00 177.57 179.33 2dbd h GLN 67 N 0.45 0.11 0.09 1.57 4.20 -1.09 -1.73 115.11 118.72 2dbd h GLN 67 Ca 0.15 -0.01 -0.26 0.00 0.06 0.00 0.00 58.65 58.60 2dbd h GLN 67 Cb 0.01 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 2dbd h GLN 67 CO -0.07 0.07 -1.19 0.77 -0.67 0.00 0.00 178.83 177.75 2dbd h SER 68 N 0.12 0.31 0.22 1.46 0.02 -0.82 -3.37 113.55 111.48 2dbd h SER 68 Ca 0.04 -0.33 -0.01 0.00 -0.84 0.00 0.00 61.79 60.64 2dbd h SER 68 Cb 0.01 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.45 2dbd h SER 68 CO -0.01 1.26 -0.11 0.11 -1.14 0.00 0.00 176.83 176.95 2dbd h LYS 69 N 0.05 -0.28 0.00 3.45 1.57 0.01 -3.50 116.57 117.87 2dbd h LYS 69 Ca -0.10 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2dbd h LYS 69 Cb 1.92 0.06 0.00 0.00 0.08 0.00 0.00 32.23 34.29 2dbd h LYS 69 CO 0.18 -0.19 0.00 0.41 -0.57 0.00 0.00 179.45 179.28 2dbd n GLY 70 N -1.11 -2.45 0.18 3.86 0.00 -1.02 -4.95 105.19 99.69 2dbd n GLY 70 Ca -0.04 -1.35 0.03 0.00 0.00 0.00 0.00 46.02 44.67 2dbd n GLY 70 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dbd h GLU 71 N 0.38 0.00 -0.70 1.61 5.08 -1.91 -1.19 114.58 117.84 2dbd h GLU 71 Ca 0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 2dbd h GLU 71 Cb 0.00 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 2dbd h GLU 71 CO 0.00 0.39 0.46 1.49 -1.00 0.00 0.00 179.01 180.36 2dbd h GLU 72 N 0.00 0.73 0.01 2.33 4.81 -1.96 -1.90 114.58 118.60 2dbd h GLU 72 Ca -0.00 -0.04 -0.33 0.00 -0.13 0.00 0.00 59.36 58.86 2dbd h GLU 72 Cb 0.75 -0.16 -0.06 0.00 0.63 0.00 0.00 28.75 29.91 2dbd h GLU 72 CO 0.05 0.48 -1.98 0.28 -0.73 0.00 0.00 179.01 177.11 2dbd n VAL 73 N -4.48 1.54 0.18 0.32 0.31 -1.09 -3.90 118.33 111.21 2dbd n VAL 73 Ca 0.10 -0.80 0.08 0.00 -0.01 0.00 0.00 64.34 63.71 2dbd n VAL 73 Cb 0.21 -0.90 0.59 0.00 -0.91 0.00 0.00 33.84 32.83 2dbd n VAL 73 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 2dbd h SER 74 N 0.00 0.11 0.01 4.52 0.87 -0.84 0.55 113.55 118.77 2dbd h SER 74 Ca -0.39 -0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.13 2dbd h SER 74 Cb 2.09 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 64.03 2dbd h SER 74 CO 0.06 0.08 -0.13 -0.08 -0.53 0.00 0.00 176.83 176.23 2dbd h GLU 75 N 0.13 0.08 -0.62 2.24 4.81 -1.51 -2.96 114.58 116.74 2dbd h GLU 75 Ca 0.06 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 2dbd h GLU 75 Cb 0.07 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 2dbd h GLU 75 CO -0.01 0.89 0.36 0.35 -0.73 0.00 0.00 179.01 179.87 2dbd h PHE 76 N -0.69 0.84 -1.00 0.92 3.57 -1.59 0.45 116.94 119.44 2dbd h PHE 76 Ca -0.02 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.50 2dbd h PHE 76 Cb 0.94 -0.27 -0.06 0.00 2.79 0.00 0.00 35.95 39.35 2dbd h PHE 76 CO 0.21 0.59 0.66 0.35 -2.23 0.00 0.00 178.31 177.88 2dbd h PHE 77 N 0.85 1.23 0.01 0.41 3.57 -1.00 -1.49 116.94 120.52 2dbd h PHE 77 Ca 0.22 0.03 -0.22 0.00 3.53 0.00 0.00 57.97 61.54 2dbd h PHE 77 Cb 0.01 -0.41 -0.03 0.00 2.79 0.00 0.00 35.95 38.31 2dbd h PHE 77 CO -0.01 0.73 -1.02 -0.07 -2.23 0.00 0.00 178.31 175.71 2dbd h LEU 78 N 1.29 0.04 -1.38 0.59 3.38 -1.28 -3.25 115.31 114.71 2dbd h LEU 78 Ca 0.39 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 58.26 2dbd h LEU 78 Cb -0.05 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2dbd h LEU 78 CO -0.11 1.03 -0.20 0.22 0.09 0.00 0.00 178.44 179.47 2dbd h TYR 79 N 0.01 0.17 -0.28 1.13 5.03 0.53 -2.51 116.97 121.05 2dbd h TYR 79 Ca -0.02 -0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.17 2dbd h TYR 79 Cb 1.79 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 40.01 2dbd h TYR 79 CO 0.01 0.36 -0.21 -0.07 -1.32 0.00 0.00 178.16 176.92 2dbd h LEU 80 N 0.15 0.51 -1.89 2.82 3.38 -1.33 -2.63 115.31 116.32 2dbd h LEU 80 Ca 0.03 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.85 2dbd h LEU 80 Cb 0.45 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2dbd h LEU 80 CO 0.03 0.73 0.11 -0.07 0.09 0.00 0.00 178.44 179.33 2dbd h LEU 81 N 0.46 0.13 -0.14 1.67 3.38 -1.55 0.16 115.31 119.43 2dbd h LEU 81 Ca 0.07 -0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.81 2dbd h LEU 81 Cb 0.63 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.36 2dbd h LEU 81 CO 0.04 0.09 -0.87 -0.61 0.09 0.00 0.00 178.44 177.18 2dbd h GLN 82 N 0.15 0.69 0.10 1.13 -0.00 -1.52 -0.66 115.11 115.01 2dbd h GLN 82 Ca 0.06 -0.63 -0.01 0.00 -0.00 0.00 0.00 58.65 58.08 2dbd h GLN 82 Cb 0.08 0.15 0.00 0.00 0.00 0.00 0.00 27.48 27.71 2dbd h GLN 82 CO -0.01 1.24 -0.05 1.96 0.00 0.00 0.00 178.83 181.97 2dbd h GLN 83 N 0.44 -0.13 0.00 1.69 1.08 -1.25 -3.22 115.11 113.72 2dbd h GLN 83 Ca -0.08 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 2dbd h GLN 83 Cb 1.50 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.96 2dbd h GLN 83 CO 0.17 0.37 0.00 -0.07 -0.95 0.00 0.00 178.83 178.36 2dbd h LEU 84 N -0.81 0.00 -1.90 1.46 3.38 -0.83 -2.98 115.31 113.63 2dbd h LEU 84 Ca -0.01 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.12 2dbd h LEU 84 Cb 0.57 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 2dbd h LEU 84 CO 0.02 0.00 0.56 0.00 0.09 0.00 0.00 178.44 179.12 2dbd h ALA 85 N 2.02 2.37 -0.32 1.53 0.00 -1.12 0.18 119.26 123.92 2dbd h ALA 85 Ca 0.00 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.97 2dbd h ALA 85 Cb 0.41 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2dbd h ALA 85 CO 0.00 -0.86 0.23 -0.44 0.00 0.00 0.00 179.25 178.17 2dbd h ASP 86 N 0.00 0.05 -0.62 0.00 5.19 -1.70 -1.00 116.42 118.34 2dbd h ASP 86 Ca 0.28 0.00 -0.39 0.00 -0.62 0.00 0.00 57.03 56.30 2dbd h ASP 86 Cb 1.40 -0.01 -0.24 0.00 0.18 0.00 0.00 39.33 40.66 2dbd h ASP 86 CO -0.00 0.03 -0.03 0.00 -3.12 0.00 0.00 179.24 176.12 2dbd n ALA 87 N -2.58 4.98 -2.38 3.45 0.00 0.63 -4.99 120.51 119.61 2dbd n ALA 87 Ca 0.04 -3.36 -0.15 0.00 0.00 0.00 0.00 53.44 49.97 2dbd n ALA 87 Cb 0.36 -0.88 -0.10 0.00 0.00 0.00 0.00 19.45 18.82 2dbd n ALA 87 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2dbd s TYR 88 N -3.45 1.27 -0.03 0.00 1.51 -0.38 -5.08 117.35 111.18 2dbd s TYR 88 Ca 0.51 -0.67 -0.03 0.00 -1.01 0.00 0.00 57.07 55.87 2dbd s TYR 88 Cb 0.43 -0.66 -0.02 0.00 -0.11 0.00 0.00 41.96 41.60 2dbd s TYR 88 CO 0.01 0.09 -0.08 0.28 -1.11 0.00 0.00 175.55 174.75 2dbd n VAL 89 N 0.18 0.55 -0.21 0.71 0.31 -1.26 -4.76 118.33 113.86 2dbd n VAL 89 Ca -0.13 0.02 -0.07 0.00 -0.01 0.00 0.00 64.34 64.16 2dbd n VAL 89 Cb 0.59 -1.62 0.03 0.00 -0.91 0.00 0.00 33.84 31.93 2dbd n VAL 89 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2dbd h ASP 90 N -0.21 0.74 -3.52 4.52 3.32 -1.98 -3.40 116.42 115.89 2dbd h ASP 90 Ca -0.11 -0.09 -0.60 0.00 0.02 0.00 0.00 57.03 56.26 2dbd h ASP 90 Cb 0.91 -0.19 -0.10 0.00 0.22 0.00 0.00 39.33 40.18 2dbd h ASP 90 CO -0.07 0.61 0.58 -0.76 -1.72 0.00 0.00 179.24 177.88 2dbd s LEU 91 N -9.98 4.01 0.00 1.55 1.43 -1.26 -4.46 118.68 109.98 2dbd s LEU 91 Ca -0.13 0.49 0.00 0.00 -1.03 0.00 0.00 54.13 53.46 2dbd s LEU 91 Cb 0.13 -3.23 0.00 0.00 0.03 0.00 0.00 46.19 43.12 2dbd s LEU 91 CO 0.77 -0.87 0.00 -1.14 0.23 0.00 0.00 176.35 175.34 2dbd n ARG 92 N 6.80 0.00 0.02 1.70 0.63 -1.26 -4.80 116.66 119.74 2dbd n ARG 92 Ca 0.07 0.00 -0.02 0.00 -0.92 0.00 0.00 57.85 56.98 2dbd n ARG 92 Cb 0.48 0.00 0.25 0.00 0.45 0.00 0.00 32.46 33.64 2dbd n ARG 92 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 2dbd h PRO 93 N 0.00 0.48 0.00 -0.14 0.11 -1.89 -3.10 132.00 127.45 2dbd h PRO 93 Ca 0.00 -0.15 0.01 0.00 0.11 0.00 0.00 66.00 65.97 2dbd h PRO 93 Cb 0.00 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.06 2dbd h PRO 93 CO 0.00 0.63 -0.03 2.35 -0.21 0.00 0.00 178.00 180.74 2dbd h TRP 94 N 0.44 -0.07 -0.78 0.65 7.01 -1.93 -1.53 115.95 119.74 2dbd h TRP 94 Ca 0.08 0.00 0.08 0.00 2.11 0.00 0.00 58.89 61.16 2dbd h TRP 94 Cb 0.53 0.03 -0.05 0.00 -2.10 0.00 0.00 29.16 27.57 2dbd h TRP 94 CO 0.02 -0.05 0.51 -0.07 -2.79 0.00 0.00 178.44 176.06 2dbd h LEU 95 N -0.06 0.69 -0.99 0.65 3.38 -1.94 -0.07 115.31 116.98 2dbd h LEU 95 Ca 0.01 0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 2dbd h LEU 95 Cb 0.07 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2dbd h LEU 95 CO -0.03 0.43 -0.50 -0.07 0.09 0.00 0.00 178.44 178.36 2dbd h LEU 96 N 0.77 0.03 0.06 1.67 3.38 -1.37 0.38 115.31 120.23 2dbd h LEU 96 Ca 0.35 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.30 2dbd h LEU 96 Cb 0.35 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2dbd h LEU 96 CO -0.13 0.52 -0.03 -0.33 0.09 0.00 0.00 178.44 178.57 2dbd h GLU 97 N 0.02 -0.07 -0.00 1.13 5.08 -0.06 -3.31 114.58 117.37 2dbd h GLU 97 Ca -0.00 0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 2dbd h GLU 97 Cb 0.89 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 2dbd h GLU 97 CO 0.07 0.53 -0.67 -0.84 -1.00 0.00 0.00 179.01 177.09 2dbd h ILE 98 N -0.80 1.48 -3.31 3.13 3.07 -1.22 -3.48 117.51 116.39 2dbd h ILE 98 Ca -0.01 -2.29 -0.12 0.00 1.55 0.00 0.00 64.86 63.99 2dbd h ILE 98 Cb 0.63 2.23 0.06 0.00 -0.27 0.00 0.00 36.82 39.48 2dbd h ILE 98 CO 0.01 0.65 -0.28 0.61 -1.05 0.00 0.00 178.15 178.10 2dbd n GLY 99 N 0.39 0.16 3.57 0.16 0.00 0.13 -4.92 105.19 104.68 2dbd n GLY 99 Ca -0.01 -0.27 -0.39 0.00 0.00 0.00 0.00 46.02 45.34 2dbd n GLY 99 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2dbd s PHE 100 N -3.13 1.53 0.42 1.61 2.19 -1.14 -4.94 117.98 114.50 2dbd s PHE 100 Ca 0.01 0.91 -0.26 0.00 0.33 0.00 0.00 56.93 57.92 2dbd s PHE 100 Cb -0.00 -3.97 -0.09 0.00 -1.31 0.00 0.00 43.02 37.65 2dbd s PHE 100 CO 0.27 -2.65 1.36 0.45 1.83 0.00 0.00 175.22 176.47 2dbd s SER 101 N 8.56 6.18 0.21 6.13 0.15 -1.26 -5.01 113.70 128.66 2dbd s SER 101 Ca 0.80 2.77 -0.01 0.00 0.70 0.00 0.00 55.95 60.21 2dbd s SER 101 Cb -0.18 -2.65 0.01 0.00 -1.71 0.00 0.00 66.02 61.49 2dbd s SER 101 CO 0.26 -0.95 0.30 -1.54 1.20 0.00 0.00 173.24 172.51 2dbd n SER 102 N 0.06 -0.84 0.00 5.45 3.41 -1.26 -5.10 113.62 115.34 2dbd n SER 102 Ca 0.04 -2.14 0.00 0.00 -0.26 0.00 0.00 58.87 56.50 2dbd n SER 102 Cb 0.43 1.57 0.00 0.00 -0.26 0.00 0.00 64.21 65.94 2dbd n SER 102 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dbd n GLY 103 N -0.35 3.78 0.18 5.00 0.00 -1.26 -4.84 105.19 107.71 2dbd n GLY 103 Ca 0.00 -1.76 0.04 0.00 0.00 0.00 0.00 46.02 44.30 2dbd n GLY 103 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dbd h PRO 104 N 0.00 0.00 -2.58 1.61 0.13 -2.05 -3.39 132.00 125.72 2dbd h PRO 104 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 2dbd h PRO 104 Cb 0.00 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 30.75 2dbd h PRO 104 CO 0.00 0.40 -0.77 -1.12 -0.23 0.00 0.00 178.00 176.27 2dbd s SER 105 N -6.68 2.93 -0.54 1.44 0.01 -1.26 -5.00 113.70 104.61 2dbd s SER 105 Ca -0.02 -1.47 -0.00 0.00 1.31 0.00 0.00 55.95 55.77 2dbd s SER 105 Cb 0.13 -0.17 0.45 0.00 0.21 0.00 0.00 66.02 66.65 2dbd s SER 105 CO 0.71 -0.38 1.97 -1.54 0.41 0.00 0.00 173.24 174.40 2dbd n SER 106 N 4.86 6.36 0.00 2.44 3.41 -1.26 -5.15 113.62 124.28 2dbd n SER 106 Ca 0.01 -3.57 0.00 0.00 -0.26 0.00 0.00 58.87 55.05 2dbd n SER 106 Cb 0.42 -0.94 0.00 0.00 -0.26 0.00 0.00 64.21 63.42 2dbd n SER 106 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49