#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dbd n SER 2 N 0.00 -1.04 0.00 1.61 7.64 -1.26 -5.03 113.62 115.54 2dbd n SER 2 Ca 0.00 0.40 0.00 0.00 1.01 0.00 0.00 58.87 60.28 2dbd n SER 2 Cb 0.00 1.22 0.00 0.00 -1.01 0.00 0.00 64.21 64.42 2dbd n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2dbd n SER 3 N -2.78 0.00 -1.31 6.43 3.41 -1.26 -5.11 113.62 113.00 2dbd n SER 3 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2dbd n SER 3 Cb 0.00 0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 2dbd n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dbd n GLY 4 N 0.66 -0.26 1.44 5.00 0.00 -1.26 -5.05 105.19 105.71 2dbd n GLY 4 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.74 0.00 -4.88 1.61 3.41 -1.26 -5.10 113.62 106.66 2dbd n SER 5 Ca 0.00 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.27 2dbd n SER 5 Cb 0.30 0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.23 2dbd n SER 5 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2dbd s SER 6 N -4.20 6.57 -0.52 4.04 0.15 -1.26 -5.05 113.70 113.44 2dbd s SER 6 Ca 0.00 0.68 0.07 0.00 0.70 0.00 0.00 55.95 57.41 2dbd s SER 6 Cb 0.00 -2.13 0.28 0.00 -1.71 0.00 0.00 66.02 62.45 2dbd s SER 6 CO 0.00 0.18 0.70 0.61 1.20 0.00 0.00 173.24 175.93 2dbd n GLY 7 N 0.85 4.17 3.06 9.45 0.00 -1.26 -5.03 105.19 116.43 2dbd n GLY 7 Ca -0.08 -2.27 -0.33 0.00 0.00 0.00 0.00 46.02 43.35 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 -2.21 3.65 0.60 1.61 4.02 -1.26 -4.97 115.29 116.73 2dbd s HIS 8 Ca 0.40 -2.74 0.28 0.00 1.02 0.00 0.00 55.06 54.02 2dbd s HIS 8 Cb 0.20 -2.87 1.40 0.00 -1.02 0.00 0.00 32.58 30.29 2dbd s HIS 8 CO -0.07 -0.94 1.81 -1.35 1.02 0.00 0.00 174.74 175.21 2dbd h PRO 9 N 7.75 0.00 0.00 8.40 0.11 -1.97 0.85 132.00 147.15 2dbd h PRO 9 Ca -0.08 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.99 2dbd h PRO 9 Cb 1.03 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2dbd h PRO 9 CO 0.56 0.00 -0.25 0.45 -0.21 0.00 0.00 178.00 178.55 2dbd h HIS 10 N 0.00 0.00 -0.12 0.65 3.86 -1.96 -3.13 115.15 114.44 2dbd h HIS 10 Ca 0.24 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.36 2dbd h HIS 10 Cb 1.40 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.86 2dbd h HIS 10 CO 0.00 0.60 -0.33 0.82 0.86 0.00 0.00 177.93 179.88 2dbd h ILE 11 N -1.00 1.27 -0.08 2.45 2.04 -1.69 -2.71 117.51 117.79 2dbd h ILE 11 Ca -0.05 -1.31 -0.09 0.00 1.00 0.00 0.00 64.86 64.41 2dbd h ILE 11 Cb 0.64 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 2dbd h ILE 11 CO -0.03 0.40 -0.34 1.56 0.00 0.00 0.00 178.15 179.73 2dbd h GLN 12 N 0.21 0.16 -0.16 2.37 1.08 0.55 -2.31 115.11 117.01 2dbd h GLN 12 Ca 0.03 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.13 2dbd h GLN 12 Cb 0.69 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.10 2dbd h GLN 12 CO 0.05 0.49 -0.03 -0.07 -0.95 0.00 0.00 178.83 178.32 2dbd h LEU 13 N 0.14 0.22 0.13 1.46 3.38 -1.42 0.99 115.31 120.21 2dbd h LEU 13 Ca 0.02 -0.03 -0.21 0.00 0.09 0.00 0.00 57.88 57.75 2dbd h LEU 13 Cb 0.68 -0.06 0.02 0.00 0.09 0.00 0.00 40.66 41.39 2dbd h LEU 13 CO 0.05 0.30 -0.95 -0.07 0.09 0.00 0.00 178.44 177.86 2dbd h LEU 14 N 0.24 0.44 -0.63 1.67 3.38 -1.52 -1.92 115.31 116.96 2dbd h LEU 14 Ca 0.05 -0.93 -0.03 0.00 0.09 0.00 0.00 57.88 57.06 2dbd h LEU 14 Cb 0.22 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2dbd h LEU 14 CO 0.01 1.44 0.26 0.11 0.09 0.00 0.00 178.44 180.35 2dbd h LYS 15 N -0.37 0.94 -0.13 1.13 1.57 -1.23 0.61 116.57 119.08 2dbd h LYS 15 Ca -0.18 -0.17 -0.20 0.00 -1.87 0.00 0.00 60.65 58.23 2dbd h LYS 15 Cb 1.66 -0.15 0.01 0.00 0.08 0.00 0.00 32.23 33.82 2dbd h LYS 15 CO 0.12 0.79 -0.71 0.77 -0.57 0.00 0.00 179.45 179.85 2dbd h SER 16 N 0.88 0.86 -0.89 0.86 0.02 -0.93 -3.25 113.55 111.09 2dbd h SER 16 Ca 0.21 -0.64 -0.59 0.00 -0.84 0.00 0.00 61.79 59.93 2dbd h SER 16 Cb 0.20 -0.25 -0.31 0.00 0.14 0.00 0.00 62.40 62.18 2dbd h SER 16 CO -0.02 1.36 0.42 0.59 -1.14 0.00 0.00 176.83 178.04 2dbd n ASN 17 N -4.02 6.20 -0.03 3.07 3.02 -0.72 -4.60 115.26 118.17 2dbd n ASN 17 Ca -0.08 -3.76 -0.15 0.00 -0.03 0.00 0.00 54.58 50.56 2dbd n ASN 17 Cb 0.71 -0.80 -0.04 0.00 -0.61 0.00 0.00 39.78 39.04 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 1.82 0.78 -0.01 3.52 2.43 0.20 -2.00 114.38 121.12 2dbd h ARG 18 Ca 0.53 -0.57 -0.17 0.00 -0.81 0.00 0.00 59.98 58.97 2dbd h ARG 18 Cb 1.30 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.93 2dbd h ARG 18 CO 1.26 1.19 -0.76 0.93 -1.51 0.00 0.00 179.97 181.08 2dbd h GLU 19 N 0.56 0.10 -0.19 0.20 4.39 -1.83 -3.09 114.58 114.70 2dbd h GLU 19 Ca -0.02 -0.09 -0.17 0.00 0.34 0.00 0.00 59.36 59.42 2dbd h GLU 19 Cb 1.29 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 2dbd h GLU 19 CO 0.14 0.81 -0.54 1.25 -1.16 0.00 0.00 179.01 179.51 2dbd h LEU 20 N 0.06 0.81 -1.35 1.33 5.85 -1.87 -3.16 115.31 116.97 2dbd h LEU 20 Ca -0.02 -0.58 0.00 0.00 0.84 0.00 0.00 57.88 58.12 2dbd h LEU 20 Cb 1.34 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 2dbd h LEU 20 CO 0.11 1.25 0.41 -0.07 -0.34 0.00 0.00 178.44 179.80 2dbd h LEU 21 N 0.41 0.74 -1.61 2.25 3.38 -1.39 0.79 115.31 119.88 2dbd h LEU 21 Ca -0.01 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 2dbd h LEU 21 Cb 1.16 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 2dbd h LEU 21 CO 0.12 0.54 -0.14 0.58 0.09 0.00 0.00 178.44 179.63 2dbd h VAL 22 N 0.87 1.13 0.01 1.22 2.07 -1.51 0.21 116.25 120.26 2dbd h VAL 22 Ca 0.23 -0.59 -0.28 0.00 0.82 0.00 0.00 66.70 66.88 2dbd h VAL 22 Cb -0.08 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 2dbd h VAL 22 CO -0.05 0.17 -1.60 0.74 0.02 0.00 0.00 177.57 176.86 2dbd h THR 23 N 0.07 1.00 0.13 2.57 2.02 -1.26 -3.40 112.91 114.04 2dbd h THR 23 Ca 0.01 -2.81 -0.01 0.00 0.77 0.00 0.00 66.41 64.38 2dbd h THR 23 Cb 0.29 2.51 0.00 0.00 -1.74 0.00 0.00 68.15 69.22 2dbd h THR 23 CO 0.02 0.61 -0.06 0.45 0.37 0.00 0.00 175.52 176.90 2dbd h HIS 24 N 0.01 -0.17 -4.21 3.16 -0.00 -0.51 -3.46 115.15 109.97 2dbd h HIS 24 Ca -0.24 -0.00 -0.50 0.00 -0.00 0.00 0.00 60.37 59.62 2dbd h HIS 24 Cb 1.97 0.06 0.09 0.00 -0.00 0.00 0.00 27.41 29.53 2dbd h HIS 24 CO 0.01 -0.10 0.37 0.42 -0.00 0.00 0.00 177.93 178.63 2dbd s ILE 25 N -2.12 3.49 0.00 2.45 1.01 0.72 -4.68 121.20 122.07 2dbd s ILE 25 Ca -0.03 0.67 0.00 0.00 0.00 0.00 0.00 60.65 61.29 2dbd s ILE 25 Cb 0.00 -3.20 0.00 0.00 0.01 0.00 0.00 42.46 39.27 2dbd s ILE 25 CO 0.08 -0.45 0.00 -1.14 0.00 0.00 0.00 174.94 173.43 2dbd n ARG 26 N -2.38 0.00 -2.72 2.79 0.63 -1.26 -4.75 116.66 108.96 2dbd n ARG 26 Ca 0.10 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.59 2dbd n ARG 26 Cb 0.52 -0.10 -0.00 0.00 0.45 0.00 0.00 32.46 33.33 2dbd n ARG 26 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 2dbd s ASN 27 N -4.09 6.88 0.32 6.15 3.04 -1.26 -4.76 114.94 121.22 2dbd s ASN 27 Ca 0.00 -2.53 0.14 0.00 0.04 0.00 0.00 52.86 50.51 2dbd s ASN 27 Cb 0.00 -2.51 0.52 0.00 -1.54 0.00 0.00 41.25 37.73 2dbd s ASN 27 CO 0.00 -1.05 1.68 0.71 -3.04 0.00 0.00 177.10 175.40 2dbd h THR 28 N 5.38 1.18 -0.37 -5.21 1.35 -1.96 -3.01 112.91 110.26 2dbd h THR 28 Ca 0.37 -1.80 0.10 0.00 -0.55 0.00 0.00 66.41 64.53 2dbd h THR 28 Cb 0.89 2.02 -0.02 0.00 -1.73 0.00 0.00 68.15 69.31 2dbd h THR 28 CO 1.37 0.48 0.27 -0.61 -0.25 0.00 0.00 175.52 176.78 2dbd h GLN 29 N 0.00 0.05 -0.12 4.72 -0.00 -2.00 -1.54 115.11 116.23 2dbd h GLN 29 Ca -0.00 -0.00 -0.08 0.00 -0.00 0.00 0.00 58.65 58.56 2dbd h GLN 29 Cb 0.98 -0.01 0.00 0.00 0.00 0.00 0.00 27.48 28.45 2dbd h GLN 29 CO 0.06 0.03 -0.25 0.00 0.00 0.00 0.00 178.83 178.68 2dbd h LEU 31 N -0.05 0.72 -0.86 0.00 3.38 -1.42 -2.32 115.31 114.76 2dbd h LEU 31 Ca 0.00 -0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 2dbd h LEU 31 Cb 0.85 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 2dbd h LEU 31 CO 0.06 0.57 -0.37 0.58 0.09 0.00 0.00 178.44 179.36 2dbd h VAL 32 N 0.80 1.30 0.26 1.22 2.07 -1.36 -1.98 116.25 118.57 2dbd h VAL 32 Ca 0.21 -1.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 2dbd h VAL 32 Cb -0.02 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2dbd h VAL 32 CO -0.04 0.46 -0.13 -0.78 0.02 0.00 0.00 177.57 177.10 2dbd h ASP 33 N 0.33 -0.30 -0.54 0.57 1.82 -0.81 0.24 116.42 117.74 2dbd h ASP 33 Ca 0.03 -0.01 -0.08 0.00 -0.39 0.00 0.00 57.03 56.58 2dbd h ASP 33 Cb 0.81 0.08 -0.02 0.00 0.68 0.00 0.00 39.33 40.88 2dbd h ASP 33 CO 0.07 -0.19 0.03 0.78 -1.61 0.00 0.00 179.24 178.32 2dbd h ASN 34 N -0.38 0.93 -0.34 2.28 2.35 -1.42 -2.01 115.58 116.99 2dbd h ASN 34 Ca -0.04 -0.24 -0.09 0.00 -0.55 0.00 0.00 56.30 55.39 2dbd h ASN 34 Cb 0.29 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 2dbd h ASN 34 CO 0.06 0.97 -0.08 -0.07 -1.65 0.00 0.00 177.43 176.66 2dbd h LEU 35 N 0.90 0.74 -0.26 1.61 3.38 -1.16 -2.30 115.31 118.22 2dbd h LEU 35 Ca 0.17 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 2dbd h LEU 35 Cb 0.48 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2dbd h LEU 35 CO 0.02 0.86 -0.08 -0.07 0.09 0.00 0.00 178.44 179.26 2dbd h LEU 36 N 0.70 0.52 -1.64 1.67 3.38 -0.25 -1.00 115.31 118.69 2dbd h LEU 36 Ca 0.12 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 2dbd h LEU 36 Cb 0.55 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2dbd h LEU 36 CO 0.03 0.78 0.00 0.50 0.09 0.00 0.00 178.44 179.85 2dbd h LYS 37 N 0.26 0.22 -0.00 1.13 3.64 -1.26 -0.43 116.57 120.12 2dbd h LYS 37 Ca 0.06 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2dbd h LYS 37 Cb 0.57 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 2dbd h LYS 37 CO 0.03 0.25 -0.00 0.09 -2.27 0.00 0.00 179.45 177.54 2dbd n ASN 38 N -4.41 0.34 -3.09 4.20 5.03 -0.88 -4.90 115.26 111.55 2dbd n ASN 38 Ca -0.01 -1.10 -0.21 0.00 0.87 0.00 0.00 54.58 54.13 2dbd n ASN 38 Cb 0.16 -0.00 0.06 0.00 -1.02 0.00 0.00 39.78 38.98 2dbd n ASN 38 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 2dbd n ASP 39 N -0.74 -5.78 -0.14 6.41 -0.08 -0.17 -4.93 116.55 111.12 2dbd n ASP 39 Ca 0.23 -0.43 -0.29 0.00 -1.51 0.00 0.00 54.79 52.79 2dbd n ASP 39 Cb 0.17 -4.44 -0.10 0.00 2.34 0.00 0.00 41.12 39.08 2dbd n ASP 39 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 2dbd n TYR 40 N -4.63 0.12 -2.88 -0.67 4.01 -0.40 -4.93 117.16 107.78 2dbd n TYR 40 Ca -0.01 0.05 -0.41 0.00 -0.16 0.00 0.00 57.90 57.37 2dbd n TYR 40 Cb 0.56 -1.01 -0.04 0.00 -0.31 0.00 0.00 39.34 38.54 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 -2.49 3.59 0.73 -0.72 0.40 -1.21 -5.03 117.98 113.24 2dbd s PHE 41 Ca -0.38 1.44 -0.11 0.00 -0.60 0.00 0.00 56.93 57.28 2dbd s PHE 41 Cb 0.14 -2.97 0.04 0.00 0.51 0.00 0.00 43.02 40.73 2dbd s PHE 41 CO 0.50 -0.00 1.08 -1.12 0.70 0.00 0.00 175.22 176.38 2dbd s SER 42 N 0.94 4.83 0.36 1.36 0.01 -1.26 -4.79 113.70 115.15 2dbd s SER 42 Ca 0.44 1.79 0.05 0.00 1.31 0.00 0.00 55.95 59.53 2dbd s SER 42 Cb -0.19 -2.52 0.67 0.00 0.21 0.00 0.00 66.02 64.20 2dbd s SER 42 CO 0.21 -1.81 1.94 0.00 0.41 0.00 0.00 173.24 174.00 2dbd h ALA 43 N -0.85 1.49 -0.01 1.44 0.00 -2.00 -2.08 119.26 117.25 2dbd h ALA 43 Ca -0.44 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.16 2dbd h ALA 43 Cb 1.23 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2dbd h ALA 43 CO 0.53 0.39 -0.80 1.05 0.00 0.00 0.00 179.25 180.42 2dbd h GLU 44 N 0.58 0.13 -0.30 0.00 4.11 -2.01 -3.20 114.58 113.89 2dbd h GLU 44 Ca 0.14 -0.13 -0.06 0.00 0.07 0.00 0.00 59.36 59.38 2dbd h GLU 44 Cb 0.15 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2dbd h GLU 44 CO -0.01 0.86 -0.03 -0.44 0.07 0.00 0.00 179.01 179.46 2dbd h ASP 45 N 0.08 0.55 -0.16 3.06 3.32 -1.76 -2.83 116.42 118.68 2dbd h ASP 45 Ca -0.03 -0.33 0.02 0.00 0.02 0.00 0.00 57.03 56.72 2dbd h ASP 45 Cb 1.40 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 2dbd h ASP 45 CO 0.12 0.75 0.11 0.00 -1.72 0.00 0.00 179.24 178.49 2dbd h ALA 46 N 0.82 2.01 -0.03 3.45 0.00 -1.44 -0.76 119.26 123.31 2dbd h ALA 46 Ca 0.08 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2dbd h ALA 46 Cb 0.48 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2dbd h ALA 46 CO 0.02 -0.04 -0.45 1.49 0.00 0.00 0.00 179.25 180.27 2dbd h GLU 47 N 0.11 0.06 -0.10 0.00 4.81 -1.50 -2.87 114.58 115.10 2dbd h GLU 47 Ca 0.07 -0.03 -0.22 0.00 -0.13 0.00 0.00 59.36 59.05 2dbd h GLU 47 Cb 0.13 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.52 2dbd h GLU 47 CO -0.01 0.51 -0.79 0.82 -0.73 0.00 0.00 179.01 178.81 2dbd h ILE 48 N 0.05 1.30 0.65 2.32 2.04 -1.04 -1.98 117.51 120.85 2dbd h ILE 48 Ca 0.00 -2.02 -0.03 0.00 1.00 0.00 0.00 64.86 63.81 2dbd h ILE 48 Cb 0.82 2.15 0.01 0.00 -0.74 0.00 0.00 36.82 39.06 2dbd h ILE 48 CO 0.06 0.63 -0.32 0.58 0.00 0.00 0.00 178.15 179.10 2dbd h VAL 49 N 0.40 0.00 -0.03 1.67 2.07 -1.37 -2.84 116.25 116.14 2dbd h VAL 49 Ca -0.07 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.46 2dbd h VAL 49 Cb 1.43 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.20 2dbd h VAL 49 CO 0.16 0.00 0.02 0.00 0.02 0.00 0.00 177.57 177.77 2dbd h ALA 51 N 1.98 1.38 -2.67 0.00 0.00 -1.11 -3.43 119.26 115.41 2dbd h ALA 51 Ca 0.02 -0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.35 2dbd h ALA 51 Cb 0.06 0.00 0.15 0.00 0.00 0.00 0.00 17.79 18.00 2dbd h ALA 51 CO -0.00 -0.16 0.19 0.00 0.00 0.00 0.00 179.25 179.28 2dbd h PRO 53 N 1.11 0.34 -5.28 0.00 0.13 -1.89 -3.47 132.00 122.94 2dbd h PRO 53 Ca -0.47 -0.39 -0.57 0.00 -0.87 0.00 0.00 66.00 63.70 2dbd h PRO 53 Cb 1.34 0.12 -0.13 0.00 0.13 0.00 0.00 31.00 32.46 2dbd h PRO 53 CO 0.54 1.08 -0.57 0.95 -0.23 0.00 0.00 178.00 179.78 2dbd s THR 54 N -3.17 1.24 -0.05 1.56 -4.23 -1.26 -5.08 115.64 104.65 2dbd s THR 54 Ca -0.05 -2.00 -0.24 0.00 -1.18 0.00 0.00 61.69 58.22 2dbd s THR 54 Cb 0.09 -2.60 -0.19 0.00 1.34 0.00 0.00 72.50 71.14 2dbd s THR 54 CO 0.86 0.00 1.04 -0.61 -0.54 0.00 0.00 174.62 175.37 2dbd h GLN 55 N 1.79 -0.12 -0.73 3.99 5.75 -1.97 -3.17 115.11 120.65 2dbd h GLN 55 Ca -0.41 0.01 0.21 0.00 -0.15 0.00 0.00 58.65 58.31 2dbd h GLN 55 Cb 1.27 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.81 2dbd h GLN 55 CO 0.70 0.39 0.66 -1.35 -2.65 0.00 0.00 178.83 176.58 2dbd h PRO 56 N -0.72 0.00 -0.01 -2.39 0.11 -1.96 0.29 132.00 127.32 2dbd h PRO 56 Ca -0.01 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.87 2dbd h PRO 56 Cb 0.56 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.68 2dbd h PRO 56 CO 0.02 0.00 -0.93 -0.44 -0.21 0.00 0.00 178.00 176.44 2dbd h ASP 57 N 0.00 0.58 -0.58 -2.05 3.32 -1.97 -3.20 116.42 112.53 2dbd h ASP 57 Ca 0.35 -0.46 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 2dbd h ASP 57 Cb 1.66 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 41.01 2dbd h ASP 57 CO -0.00 1.25 0.19 0.11 -1.72 0.00 0.00 179.24 179.07 2dbd h LYS 58 N 0.26 0.89 -0.79 3.56 1.57 -0.40 -1.76 116.57 119.90 2dbd h LYS 58 Ca -0.08 -0.19 0.03 0.00 -1.87 0.00 0.00 60.65 58.54 2dbd h LYS 58 Cb 1.57 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.70 2dbd h LYS 58 CO 0.16 0.80 0.52 0.28 -0.57 0.00 0.00 179.45 180.64 2dbd h VAL 59 N 0.81 1.14 -0.01 0.50 2.07 -1.53 -0.59 116.25 118.64 2dbd h VAL 59 Ca 0.19 -0.34 -0.15 0.00 0.82 0.00 0.00 66.70 67.22 2dbd h VAL 59 Cb 0.27 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.09 2dbd h VAL 59 CO -0.01 0.18 -0.71 -0.09 0.02 0.00 0.00 177.57 176.97 2dbd h ARG 60 N 0.99 0.04 -0.22 1.57 2.43 -1.47 -2.42 114.38 115.29 2dbd h ARG 60 Ca 0.31 -0.03 -0.19 0.00 -0.81 0.00 0.00 59.98 59.26 2dbd h ARG 60 Cb 0.01 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2dbd h ARG 60 CO -0.08 0.73 -0.59 -0.22 -1.51 0.00 0.00 179.97 178.29 2dbd h LYS 61 N 0.03 0.79 -0.40 0.20 1.63 -0.40 -1.67 116.57 116.75 2dbd h LYS 61 Ca -0.01 -0.55 -0.16 0.00 -0.85 0.00 0.00 60.65 59.08 2dbd h LYS 61 Cb 1.25 0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 32.96 2dbd h LYS 61 CO 0.09 1.18 -0.37 0.82 -3.45 0.00 0.00 179.45 177.72 2dbd h ILE 62 N 0.53 1.27 -0.44 2.00 2.04 -1.16 -1.68 117.51 120.07 2dbd h ILE 62 Ca -0.01 -1.54 -0.12 0.00 1.00 0.00 0.00 64.86 64.19 2dbd h ILE 62 Cb 1.21 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 2dbd h ILE 62 CO 0.13 0.52 -0.18 -0.07 0.00 0.00 0.00 178.15 178.54 2dbd h LEU 63 N 0.77 0.93 -0.95 1.44 3.38 -1.46 -1.60 115.31 117.83 2dbd h LEU 63 Ca 0.07 -0.39 -0.10 0.00 0.09 0.00 0.00 57.88 57.55 2dbd h LEU 63 Cb 0.96 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2dbd h LEU 63 CO 0.09 1.11 -0.28 -0.78 0.09 0.00 0.00 178.44 178.68 2dbd h ASP 64 N 0.74 0.44 -0.11 -0.43 1.82 -1.27 -2.44 116.42 115.17 2dbd h ASP 64 Ca 0.10 -0.15 -0.06 0.00 -0.39 0.00 0.00 57.03 56.53 2dbd h ASP 64 Cb 0.75 -0.12 -0.00 0.00 0.68 0.00 0.00 39.33 40.64 2dbd h ASP 64 CO 0.06 0.71 -0.16 -0.07 -1.61 0.00 0.00 179.24 178.17 2dbd h LEU 65 N 0.38 0.32 -1.79 2.28 3.38 -1.15 -2.90 115.31 115.83 2dbd h LEU 65 Ca 0.05 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.50 2dbd h LEU 65 Cb 0.69 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2dbd h LEU 65 CO 0.05 0.78 0.12 0.58 0.09 0.00 0.00 178.44 180.06 2dbd h VAL 66 N -0.13 1.06 -0.05 1.22 2.07 -1.23 -1.13 116.25 118.06 2dbd h VAL 66 Ca 0.01 -0.12 -0.12 0.00 0.82 0.00 0.00 66.70 67.29 2dbd h VAL 66 Cb 0.71 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 2dbd h VAL 66 CO 0.04 0.06 -0.50 1.56 0.02 0.00 0.00 177.57 178.74 2dbd h GLN 67 N 0.26 0.13 0.02 1.57 4.20 -1.37 -2.98 115.11 116.93 2dbd h GLN 67 Ca 0.07 -0.07 -0.21 0.00 0.06 0.00 0.00 58.65 58.50 2dbd h GLN 67 Cb -0.01 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 2dbd h GLN 67 CO -0.01 0.61 -0.93 1.03 -0.67 0.00 0.00 178.83 178.85 2dbd h SER 68 N 0.10 0.26 0.48 1.46 0.87 -1.03 -3.35 113.55 112.35 2dbd h SER 68 Ca 0.00 -0.23 -0.02 0.00 -1.23 0.00 0.00 61.79 60.31 2dbd h SER 68 Cb 0.93 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.81 2dbd h SER 68 CO 0.07 1.06 -0.23 0.11 -0.53 0.00 0.00 176.83 177.31 2dbd h LYS 69 N 0.10 -0.62 0.00 2.24 1.57 -1.21 -3.50 116.57 115.14 2dbd h LYS 69 Ca -0.05 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2dbd h LYS 69 Cb 1.58 0.14 0.00 0.00 0.08 0.00 0.00 32.23 34.03 2dbd h LYS 69 CO 0.14 -0.41 0.00 0.41 -0.57 0.00 0.00 179.45 179.02 2dbd n GLY 70 N -1.05 0.08 0.09 3.86 0.00 -1.14 -4.92 105.19 102.11 2dbd n GLY 70 Ca -0.08 -1.37 -0.03 0.00 0.00 0.00 0.00 46.02 44.54 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 0.00 0.00 -0.95 1.61 5.08 -1.92 -2.21 114.58 116.19 2dbd h GLU 71 Ca 0.00 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 2dbd h GLU 71 Cb 0.00 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 2dbd h GLU 71 CO 0.00 0.72 0.62 1.49 -1.00 0.00 0.00 179.01 180.83 2dbd h GLU 72 N 0.00 1.04 0.01 2.33 4.81 -1.95 -0.68 114.58 120.14 2dbd h GLU 72 Ca -0.05 -0.06 -0.33 0.00 -0.13 0.00 0.00 59.36 58.79 2dbd h GLU 72 Cb 1.65 -0.24 -0.06 0.00 0.63 0.00 0.00 28.75 30.74 2dbd h GLU 72 CO 0.10 0.69 -2.02 0.28 -0.73 0.00 0.00 179.01 177.32 2dbd n VAL 73 N -4.50 1.53 -0.27 0.32 0.31 -1.24 -3.78 118.33 110.70 2dbd n VAL 73 Ca 0.15 -0.80 -0.02 0.00 -0.01 0.00 0.00 64.34 63.66 2dbd n VAL 73 Cb 0.21 -0.87 0.17 0.00 -0.91 0.00 0.00 33.84 32.44 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 0.98 -0.05 4.52 0.87 -1.11 0.43 113.55 119.18 2dbd h SER 74 Ca -0.41 -0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.05 2dbd h SER 74 Cb 2.10 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 63.82 2dbd h SER 74 CO 0.05 0.76 -0.11 -0.08 -0.53 0.00 0.00 176.83 176.92 2dbd h GLU 75 N 1.12 0.17 -0.67 2.24 4.81 -1.30 -2.24 114.58 118.70 2dbd h GLU 75 Ca 0.29 -0.11 0.01 0.00 -0.13 0.00 0.00 59.36 59.42 2dbd h GLU 75 Cb -0.03 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 2dbd h GLU 75 CO -0.05 0.70 0.44 0.35 -0.73 0.00 0.00 179.01 179.71 2dbd h PHE 76 N -0.34 0.82 -0.67 0.92 3.57 -1.61 0.51 116.94 120.15 2dbd h PHE 76 Ca 0.00 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 2dbd h PHE 76 Cb 0.69 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 2dbd h PHE 76 CO 0.12 0.51 0.25 0.35 -2.23 0.00 0.00 178.31 177.31 2dbd h PHE 77 N 0.88 1.04 -0.07 0.41 3.57 -0.96 -1.83 116.94 119.98 2dbd h PHE 77 Ca 0.25 -0.09 -0.19 0.00 3.53 0.00 0.00 57.97 61.47 2dbd h PHE 77 Cb -0.07 -0.31 -0.00 0.00 2.79 0.00 0.00 35.95 38.36 2dbd h PHE 77 CO -0.03 0.82 -0.76 -0.07 -2.23 0.00 0.00 178.31 176.03 2dbd h LEU 78 N 0.96 0.53 -0.73 0.59 3.38 -0.94 -3.10 115.31 115.99 2dbd h LEU 78 Ca 0.22 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2dbd h LEU 78 Cb 0.23 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2dbd h LEU 78 CO -0.02 1.11 0.36 0.22 0.09 0.00 0.00 178.44 180.21 2dbd h TYR 79 N 0.29 1.05 -0.28 1.13 5.03 0.26 -2.47 116.97 121.98 2dbd h TYR 79 Ca -0.04 -0.05 -0.01 0.00 2.58 0.00 0.00 58.73 61.22 2dbd h TYR 79 Cb 1.35 -0.33 -0.01 0.00 1.55 0.00 0.00 36.73 39.29 2dbd h TYR 79 CO 0.05 0.76 0.15 -0.07 -1.32 0.00 0.00 178.16 177.73 2dbd h LEU 80 N 1.03 0.35 -2.04 2.82 3.38 -1.34 -1.81 115.31 117.69 2dbd h LEU 80 Ca 0.25 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.16 2dbd h LEU 80 Cb 0.10 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2dbd h LEU 80 CO -0.03 0.34 0.07 -0.07 0.09 0.00 0.00 178.44 178.84 2dbd h LEU 81 N 0.33 0.00 0.10 1.67 3.38 -1.43 0.52 115.31 119.88 2dbd h LEU 81 Ca 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 2dbd h LEU 81 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2dbd h LEU 81 CO -0.02 0.00 -0.05 -0.61 0.09 0.00 0.00 178.44 177.86 2dbd h GLN 82 N 0.00 -0.13 -0.00 1.13 -0.00 -0.94 0.33 115.11 115.49 2dbd h GLN 82 Ca 0.04 0.01 -0.10 0.00 -0.00 0.00 0.00 58.65 58.60 2dbd h GLN 82 Cb 0.17 0.03 -0.01 0.00 0.00 0.00 0.00 27.48 27.67 2dbd h GLN 82 CO -0.00 0.38 -0.47 -0.56 0.00 0.00 0.00 178.83 178.18 2dbd h GLN 83 N -0.82 0.00 -0.00 1.69 3.07 -1.04 -2.75 115.11 115.26 2dbd h GLN 83 Ca -0.01 -0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.72 2dbd h GLN 83 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.13 2dbd h GLN 83 CO 0.02 0.47 -0.56 1.28 0.09 0.00 0.00 178.83 180.14 2dbd n LEU 84 N -3.99 0.72 0.04 0.06 4.77 0.18 -4.13 117.00 114.65 2dbd n LEU 84 Ca -0.02 -0.16 0.18 0.00 -0.03 0.00 0.00 56.01 55.99 2dbd n LEU 84 Cb 0.49 -0.18 0.68 0.00 -2.33 0.00 0.00 43.42 42.08 2dbd n LEU 84 CO 0.40 0.17 1.17 0.00 -1.33 0.00 0.00 177.39 177.79 2dbd h ALA 85 N 3.13 2.41 -0.10 -1.18 0.00 -0.02 0.80 119.26 124.30 2dbd h ALA 85 Ca 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2dbd h ALA 85 Cb 0.51 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2dbd h ALA 85 CO 0.00 -0.53 -0.17 -0.44 0.00 0.00 0.00 179.25 178.11 2dbd h ASP 86 N 0.01 0.14 -0.03 0.00 5.19 -1.74 -3.00 116.42 116.99 2dbd h ASP 86 Ca 0.21 -0.03 -0.07 0.00 -0.62 0.00 0.00 57.03 56.52 2dbd h ASP 86 Cb 0.83 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.31 2dbd h ASP 86 CO -0.00 0.33 -0.25 0.00 -3.12 0.00 0.00 179.24 176.20 2dbd h ALA 87 N 1.69 0.07 -2.49 3.45 0.00 -1.12 -3.45 119.26 117.41 2dbd h ALA 87 Ca 0.03 -0.44 -0.52 0.00 0.00 0.00 0.00 54.91 53.98 2dbd h ALA 87 Cb 0.39 0.00 0.13 0.00 0.00 0.00 0.00 17.79 18.32 2dbd h ALA 87 CO 0.03 0.09 0.35 0.71 0.00 0.00 0.00 179.25 180.43 2dbd s TYR 88 N -3.44 2.32 -0.31 0.00 2.02 -1.10 -4.96 117.35 111.88 2dbd s TYR 88 Ca -0.15 1.60 0.09 0.00 -0.37 0.00 0.00 57.07 58.23 2dbd s TYR 88 Cb 0.02 -3.27 0.55 0.00 -0.40 0.00 0.00 41.96 38.86 2dbd s TYR 88 CO 0.75 -2.12 1.56 1.33 -1.57 0.00 0.00 175.55 175.50 2dbd n VAL 89 N -2.89 2.67 0.00 0.71 0.24 -1.26 -4.55 118.33 113.25 2dbd n VAL 89 Ca 0.11 -2.48 0.00 0.00 -2.04 0.00 0.00 64.34 59.93 2dbd n VAL 89 Cb 0.52 -0.35 0.00 0.00 -1.47 0.00 0.00 33.84 32.54 2dbd n VAL 89 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2dbd n ASP 90 N -1.04 0.86 -4.73 -1.34 8.00 -1.26 -5.06 116.55 111.97 2dbd n ASP 90 Ca 0.38 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.48 2dbd n ASP 90 Cb 1.16 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 42.22 2dbd n ASP 90 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2dbd s LEU 91 N -4.57 4.40 0.00 0.64 1.43 -1.26 -4.68 118.68 114.64 2dbd s LEU 91 Ca 0.00 1.39 0.00 0.00 -1.03 0.00 0.00 54.13 54.49 2dbd s LEU 91 Cb 0.00 -3.23 0.00 0.00 0.03 0.00 0.00 46.19 42.99 2dbd s LEU 91 CO 0.00 -0.06 0.00 0.54 0.23 0.00 0.00 176.35 177.06 2dbd n ARG 92 N 3.26 0.00 0.08 1.70 1.74 -1.26 -4.64 116.66 117.53 2dbd n ARG 92 Ca -0.01 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.20 2dbd n ARG 92 Cb 0.51 0.00 0.46 0.00 -1.02 0.00 0.00 32.46 32.41 2dbd n ARG 92 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2dbd n PRO 93 N 0.00 0.18 -0.06 5.56 -0.04 -1.26 -3.00 135.00 136.38 2dbd n PRO 93 Ca 0.00 0.19 -0.09 0.00 -0.04 0.00 0.00 63.50 63.57 2dbd n PRO 93 Cb 0.00 -1.73 -0.08 0.00 -0.04 0.00 0.00 33.50 31.65 2dbd n PRO 93 CO 0.00 0.00 0.00 2.35 -0.04 0.00 0.00 175.50 177.81 2dbd h TRP 94 N 0.00 -0.01 -0.23 0.54 7.01 -1.92 -2.91 115.95 118.43 2dbd h TRP 94 Ca 0.00 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.99 2dbd h TRP 94 Cb 0.60 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.66 2dbd h TRP 94 CO 0.00 0.59 0.12 -0.07 -2.79 0.00 0.00 178.44 176.30 2dbd h LEU 95 N -0.99 0.29 -1.83 0.65 3.38 -1.96 -2.05 115.31 112.80 2dbd h LEU 95 Ca -0.00 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.88 2dbd h LEU 95 Cb 0.61 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2dbd h LEU 95 CO 0.00 0.30 0.13 -0.07 0.09 0.00 0.00 178.44 178.88 2dbd h LEU 96 N 0.26 0.20 0.37 1.67 3.38 -1.70 0.39 115.31 119.88 2dbd h LEU 96 Ca 0.08 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 2dbd h LEU 96 Cb 0.07 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2dbd h LEU 96 CO -0.01 0.15 -0.18 -0.33 0.09 0.00 0.00 178.44 178.16 2dbd h GLU 97 N 0.24 -0.48 0.00 1.13 4.39 -1.22 -3.25 114.58 115.39 2dbd h GLU 97 Ca 0.07 0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 2dbd h GLU 97 Cb -0.00 0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 2dbd h GLU 97 CO -0.01 -0.32 -0.12 -0.84 -1.16 0.00 0.00 179.01 176.55 2dbd h ILE 98 N -0.77 0.98 -4.47 3.13 3.07 -1.31 -3.48 117.51 114.66 2dbd h ILE 98 Ca -0.05 -0.44 0.00 0.00 1.55 0.00 0.00 64.86 65.92 2dbd h ILE 98 Cb 0.38 1.24 0.00 0.00 -0.27 0.00 0.00 36.82 38.17 2dbd h ILE 98 CO 0.08 0.12 -0.35 0.61 -1.05 0.00 0.00 178.15 177.56 2dbd n GLY 99 N -1.10 -1.32 3.47 0.16 0.00 0.14 -4.83 105.19 101.70 2dbd n GLY 99 Ca -0.03 0.74 -0.35 0.00 0.00 0.00 0.00 46.02 46.38 2dbd n GLY 99 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2dbd n PHE 100 N -0.30 3.21 -1.94 1.61 7.35 -1.23 -4.55 117.46 121.61 2dbd n PHE 100 Ca 0.07 -1.98 0.02 0.00 -0.76 0.00 0.00 57.45 54.80 2dbd n PHE 100 Cb 0.27 -2.51 0.13 0.00 0.35 0.00 0.00 39.48 37.73 2dbd n PHE 100 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 2dbd n SER 101 N 11.35 1.88 -4.95 -2.13 7.64 -1.26 -5.07 113.62 121.08 2dbd n SER 101 Ca 0.47 -3.31 -0.23 0.00 1.01 0.00 0.00 58.87 56.81 2dbd n SER 101 Cb 0.45 -0.45 -0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2dbd n SER 101 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dbd s SER 102 N -2.99 6.11 0.00 6.43 0.15 -1.26 -4.82 113.70 117.32 2dbd s SER 102 Ca 0.38 0.33 0.00 0.00 0.70 0.00 0.00 55.95 57.35 2dbd s SER 102 Cb 0.38 -1.78 0.00 0.00 -1.71 0.00 0.00 66.02 62.90 2dbd s SER 102 CO -0.08 -0.44 0.00 0.61 1.20 0.00 0.00 173.24 174.53 2dbd n GLY 103 N -1.86 0.87 0.18 9.45 0.00 -1.26 -5.01 105.19 107.56 2dbd n GLY 103 Ca -0.02 -0.73 0.03 0.00 0.00 0.00 0.00 46.02 45.30 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 -4.78 1.61 0.13 -2.05 -3.40 132.00 123.51 2dbd h PRO 104 Ca 0.00 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.45 2dbd h PRO 104 Cb 0.16 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 30.94 2dbd h PRO 104 CO 0.00 0.41 -0.72 -1.12 -0.23 0.00 0.00 178.00 176.34 2dbd s SER 105 N -6.69 4.80 -0.33 1.44 0.01 -1.26 -5.08 113.70 106.58 2dbd s SER 105 Ca -0.02 -1.39 -0.08 0.00 1.31 0.00 0.00 55.95 55.78 2dbd s SER 105 Cb 0.13 -1.68 0.03 0.00 0.21 0.00 0.00 66.02 64.71 2dbd s SER 105 CO 0.71 -0.26 0.12 -0.55 0.41 0.00 0.00 173.24 173.67 2dbd s SER 106 N 1.23 5.36 0.00 2.44 0.15 -1.26 -5.26 113.70 116.36 2dbd s SER 106 Ca -0.05 -0.96 0.28 0.00 0.70 0.00 0.00 55.95 55.92 2dbd s SER 106 Cb -0.20 -1.91 1.00 0.00 -1.71 0.00 0.00 66.02 63.20 2dbd s SER 106 CO -0.03 -0.30 1.72 0.61 1.20 0.00 0.00 173.24 176.45