#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 -1.56 -3.88 1.61 7.64 -1.26 -5.10 113.62 111.08 2dbd n SER 2 Ca 0.00 -2.64 -0.29 0.00 1.01 0.00 0.00 58.87 56.95 2dbd n SER 2 Cb 0.00 0.35 -0.16 0.00 -1.01 0.00 0.00 64.21 63.39 2dbd n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dbd s SER 3 N 0.09 3.09 0.00 6.43 0.15 -1.26 -5.10 113.70 117.11 2dbd s SER 3 Ca 0.32 -0.82 0.00 0.00 0.70 0.00 0.00 55.95 56.15 2dbd s SER 3 Cb 0.05 -0.92 0.00 0.00 -1.71 0.00 0.00 66.02 63.44 2dbd s SER 3 CO -0.15 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.69 2dbd n GLY 4 N 4.85 1.93 3.34 9.45 0.00 -1.26 -5.15 105.19 118.35 2dbd n GLY 4 Ca -0.11 -1.04 -0.08 0.00 0.00 0.00 0.00 46.02 44.78 2dbd n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dbd s SER 5 N 0.00 -0.51 -0.12 1.61 0.15 -1.26 -5.06 113.70 108.51 2dbd s SER 5 Ca 0.00 1.06 -0.09 0.00 0.70 0.00 0.00 55.95 57.63 2dbd s SER 5 Cb 0.00 1.20 0.03 0.00 -1.71 0.00 0.00 66.02 65.55 2dbd s SER 5 CO 0.00 -0.22 0.17 -0.24 1.20 0.00 0.00 173.24 174.15 2dbd n SER 6 N 4.83 -3.34 0.00 5.45 2.88 -1.26 -4.99 113.62 117.19 2dbd n SER 6 Ca -0.16 1.52 0.00 0.00 -1.33 0.00 0.00 58.87 58.90 2dbd n SER 6 Cb 0.53 -5.26 0.00 0.00 -0.75 0.00 0.00 64.21 58.73 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 1.75 -1.84 2.89 0.46 0.00 -1.26 -5.08 105.19 102.11 2dbd n GLY 7 Ca -0.29 0.63 -0.06 0.00 0.00 0.00 0.00 46.02 46.30 2dbd n GLY 7 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dbd n HIS 8 N 0.00 -3.35 0.16 1.61 -0.00 -1.26 -4.08 115.22 108.31 2dbd n HIS 8 Ca 0.00 1.33 0.19 0.00 -0.00 0.00 0.00 57.72 59.24 2dbd n HIS 8 Cb 0.00 -4.09 0.74 0.00 -0.00 0.00 0.00 29.99 26.64 2dbd n HIS 8 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2dbd h PRO 9 N 1.60 0.00 0.08 -0.41 0.11 -1.98 0.77 132.00 132.17 2dbd h PRO 9 Ca 0.00 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.79 2dbd h PRO 9 Cb 1.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 2dbd h PRO 9 CO 0.22 0.00 -1.72 0.72 -0.21 0.00 0.00 178.00 177.01 2dbd n HIS 10 N -3.41 1.16 0.02 0.65 8.25 -1.26 -3.63 115.22 117.01 2dbd n HIS 10 Ca 0.05 0.33 -0.11 0.00 -0.26 0.00 0.00 57.72 57.73 2dbd n HIS 10 Cb 0.58 -1.14 0.02 0.00 1.12 0.00 0.00 29.99 30.58 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 -0.35 1.34 -0.58 1.59 2.04 -1.56 -3.17 117.51 116.83 2dbd h ILE 11 Ca -0.40 -1.99 -0.06 0.00 1.00 0.00 0.00 64.86 63.41 2dbd h ILE 11 Cb 1.75 1.97 -0.03 0.00 -0.74 0.00 0.00 36.82 39.78 2dbd h ILE 11 CO -0.03 0.61 0.12 -0.61 0.00 0.00 0.00 178.15 178.24 2dbd h GLN 12 N 0.37 0.91 -0.11 2.37 -0.00 0.37 -1.63 115.11 117.39 2dbd h GLN 12 Ca -0.02 -0.20 -0.01 0.00 -0.00 0.00 0.00 58.65 58.42 2dbd h GLN 12 Cb 1.25 -0.13 -0.01 0.00 0.00 0.00 0.00 27.48 28.59 2dbd h GLN 12 CO 0.12 0.82 0.02 -0.07 0.00 0.00 0.00 178.83 179.72 2dbd h LEU 13 N 0.87 0.13 0.12 -2.39 3.38 -1.61 -0.39 115.31 115.42 2dbd h LEU 13 Ca 0.18 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.98 2dbd h LEU 13 Cb 0.34 -0.03 0.02 0.00 0.09 0.00 0.00 40.66 41.07 2dbd h LEU 13 CO 0.00 0.15 -0.75 -0.07 0.09 0.00 0.00 178.44 177.86 2dbd h LEU 14 N 0.15 0.41 -0.17 1.67 3.38 -1.45 -2.03 115.31 117.27 2dbd h LEU 14 Ca 0.04 -0.95 0.00 0.00 0.09 0.00 0.00 57.88 57.06 2dbd h LEU 14 Cb 0.08 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2dbd h LEU 14 CO -0.00 1.36 0.11 0.11 0.09 0.00 0.00 178.44 180.11 2dbd h LYS 15 N -0.45 0.22 -0.37 1.13 1.57 -1.03 0.81 116.57 118.46 2dbd h LYS 15 Ca -0.13 -0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.50 2dbd h LYS 15 Cb 1.57 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.83 2dbd h LYS 15 CO 0.13 0.15 -0.30 1.03 -0.57 0.00 0.00 179.45 179.89 2dbd h SER 16 N 0.22 0.89 -0.96 0.86 0.87 -1.21 -3.17 113.55 111.06 2dbd h SER 16 Ca 0.06 -0.45 -0.65 0.00 -1.23 0.00 0.00 61.79 59.53 2dbd h SER 16 Cb -0.02 -0.25 -0.33 0.00 -0.44 0.00 0.00 62.40 61.36 2dbd h SER 16 CO -0.01 1.16 0.43 0.59 -0.53 0.00 0.00 176.83 178.46 2dbd n ASN 17 N -4.17 6.96 0.16 6.23 3.02 -0.76 -4.69 115.26 122.01 2dbd n ASN 17 Ca -0.02 -3.78 -0.08 0.00 -0.03 0.00 0.00 54.58 50.66 2dbd n ASN 17 Cb 0.49 -0.81 -0.04 0.00 -0.61 0.00 0.00 39.78 38.81 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 2.07 -0.47 -0.14 3.52 2.43 0.69 -2.70 114.38 119.78 2dbd h ARG 18 Ca 0.54 0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.74 2dbd h ARG 18 Cb 0.98 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.63 2dbd h ARG 18 CO 1.37 -0.28 0.07 0.93 -1.51 0.00 0.00 179.97 180.55 2dbd h GLU 19 N -1.11 0.18 -0.16 0.20 5.08 -1.83 -1.20 114.58 115.75 2dbd h GLU 19 Ca -0.05 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 2dbd h GLU 19 Cb 0.41 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2dbd h GLU 19 CO 0.08 0.15 -0.27 1.25 -1.00 0.00 0.00 179.01 179.22 2dbd h LEU 20 N 0.19 0.29 -0.11 1.33 5.85 -1.88 -2.77 115.31 118.20 2dbd h LEU 20 Ca 0.05 -0.09 -0.21 0.00 0.84 0.00 0.00 57.88 58.47 2dbd h LEU 20 Cb 0.02 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2dbd h LEU 20 CO -0.01 0.56 -0.97 -0.07 -0.34 0.00 0.00 178.44 177.61 2dbd h LEU 21 N 0.26 0.11 -1.67 2.25 3.38 -0.90 -1.83 115.31 116.92 2dbd h LEU 21 Ca 0.04 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 2dbd h LEU 21 Cb 0.62 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2dbd h LEU 21 CO 0.04 1.02 -0.15 0.58 0.09 0.00 0.00 178.44 180.02 2dbd h VAL 22 N 0.03 1.12 0.05 1.22 2.07 -1.10 0.10 116.25 119.74 2dbd h VAL 22 Ca -0.04 -0.55 -0.35 0.00 0.82 0.00 0.00 66.70 66.58 2dbd h VAL 22 Cb 1.68 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 32.69 2dbd h VAL 22 CO 0.14 0.16 -2.05 0.41 0.02 0.00 0.00 177.57 176.25 2dbd n THR 23 N -4.35 1.62 0.20 2.57 -1.04 -1.15 -4.50 114.28 107.64 2dbd n THR 23 Ca -0.02 -0.72 -0.11 0.00 -2.04 0.00 0.00 64.05 61.16 2dbd n THR 23 Cb 0.23 -1.27 -0.06 0.00 -1.82 0.00 0.00 70.33 67.41 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 0.03 -0.52 -2.96 -1.42 -0.00 -1.15 -3.43 115.15 105.70 2dbd h HIS 24 Ca -0.43 -0.01 -0.55 0.00 -0.00 0.00 0.00 60.37 59.38 2dbd h HIS 24 Cb 2.04 0.17 -0.02 0.00 -0.00 0.00 0.00 27.41 29.60 2dbd h HIS 24 CO 0.03 -0.22 0.82 0.42 -0.00 0.00 0.00 177.93 178.98 2dbd s ILE 25 N -3.93 4.11 -0.13 2.45 1.01 0.35 -4.70 121.20 120.35 2dbd s ILE 25 Ca -0.11 1.41 0.08 0.00 0.00 0.00 0.00 60.65 62.02 2dbd s ILE 25 Cb 0.01 -3.91 -0.13 0.00 0.01 0.00 0.00 42.46 38.44 2dbd s ILE 25 CO 0.39 -0.05 -0.02 -1.14 0.00 0.00 0.00 174.94 174.12 2dbd n ARG 26 N 5.81 1.44 -3.42 2.79 0.63 -1.26 -4.75 116.66 117.90 2dbd n ARG 26 Ca 0.13 0.03 -0.43 0.00 -0.92 0.00 0.00 57.85 56.66 2dbd n ARG 26 Cb 0.45 -1.31 -0.10 0.00 0.45 0.00 0.00 32.46 31.95 2dbd n ARG 26 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 2dbd s ASN 27 N -4.86 6.13 -0.18 6.15 0.02 -1.26 -4.90 114.94 116.04 2dbd s ASN 27 Ca -0.11 -0.75 0.16 0.00 -1.02 0.00 0.00 52.86 51.13 2dbd s ASN 27 Cb 0.04 -2.18 -0.24 0.00 0.02 0.00 0.00 41.25 38.89 2dbd s ASN 27 CO 0.45 -0.46 0.14 0.35 0.02 0.00 0.00 177.10 177.60 2dbd n THR 28 N 5.24 1.43 -0.31 1.60 -2.24 -1.26 -4.35 114.28 114.39 2dbd n THR 28 Ca -0.10 -0.83 0.03 0.00 -2.27 0.00 0.00 64.05 60.88 2dbd n THR 28 Cb 0.47 -0.61 0.22 0.00 -2.10 0.00 0.00 70.33 68.31 2dbd n THR 28 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2dbd h GLN 29 N 0.00 1.05 -0.87 -0.78 1.08 -1.99 -1.43 115.11 112.16 2dbd h GLN 29 Ca -0.51 -0.06 0.01 0.00 -1.45 0.00 0.00 58.65 56.64 2dbd h GLN 29 Cb 2.19 -0.24 -0.04 0.00 -0.05 0.00 0.00 27.48 29.34 2dbd h GLN 29 CO 0.03 0.69 0.58 0.00 -0.95 0.00 0.00 178.83 179.18 2dbd h LEU 31 N 1.17 -0.02 -1.06 0.00 3.38 -1.50 -2.56 115.31 114.73 2dbd h LEU 31 Ca 0.32 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2dbd h LEU 31 Cb -0.12 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 2dbd h LEU 31 CO -0.07 0.41 0.46 0.58 0.09 0.00 0.00 178.44 179.91 2dbd h VAL 32 N -0.45 1.23 -0.14 1.22 2.07 -1.15 0.17 116.25 119.21 2dbd h VAL 32 Ca -0.00 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.96 2dbd h VAL 32 Cb 0.43 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2dbd h VAL 32 CO 0.00 0.26 0.09 -0.78 0.02 0.00 0.00 177.57 177.16 2dbd h ASP 33 N 1.12 0.17 -0.39 0.57 3.58 -0.80 0.12 116.42 120.79 2dbd h ASP 33 Ca 0.29 -0.02 -0.09 0.00 0.42 0.00 0.00 57.03 57.62 2dbd h ASP 33 Cb 0.00 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 2dbd h ASP 33 CO -0.05 0.14 -0.12 0.78 -2.88 0.00 0.00 179.24 177.11 2dbd h ASN 34 N 0.18 0.79 -0.58 2.28 2.35 -1.18 -1.36 115.58 118.05 2dbd h ASN 34 Ca 0.05 -0.38 -0.03 0.00 -0.55 0.00 0.00 56.30 55.40 2dbd h ASN 34 Cb -0.00 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.12 2dbd h ASN 34 CO -0.01 0.98 0.28 -0.07 -1.65 0.00 0.00 177.43 176.96 2dbd h LEU 35 N 0.58 0.79 -0.12 1.61 3.38 -0.78 -0.71 115.31 120.06 2dbd h LEU 35 Ca 0.10 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 2dbd h LEU 35 Cb 0.65 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2dbd h LEU 35 CO 0.04 0.68 -0.26 -0.07 0.09 0.00 0.00 178.44 178.93 2dbd h LEU 36 N 0.87 0.44 -1.13 1.67 3.38 -0.62 0.57 115.31 120.48 2dbd h LEU 36 Ca 0.21 -0.57 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 2dbd h LEU 36 Cb 0.12 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2dbd h LEU 36 CO -0.03 0.92 0.39 0.50 0.09 0.00 0.00 178.44 180.31 2dbd h LYS 37 N -0.03 0.99 -0.01 1.13 3.64 -1.02 -0.77 116.57 120.51 2dbd h LYS 37 Ca 0.00 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2dbd h LYS 37 Cb 0.85 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 2dbd h LYS 37 CO 0.06 0.73 0.00 0.09 -2.27 0.00 0.00 179.45 178.06 2dbd n ASN 38 N -4.36 0.37 -2.87 4.20 3.02 -0.29 -4.93 115.26 110.40 2dbd n ASN 38 Ca 0.07 -1.14 -0.11 0.00 -0.03 0.00 0.00 54.58 53.38 2dbd n ASN 38 Cb 0.10 -0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.32 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 -0.70 -5.78 -0.00 6.41 8.00 -0.30 -4.98 116.55 119.20 2dbd n ASP 39 Ca 0.22 -0.51 -0.01 0.00 0.71 0.00 0.00 54.79 55.21 2dbd n ASP 39 Cb 0.17 -4.25 -0.00 0.00 -0.02 0.00 0.00 41.12 37.02 2dbd n ASP 39 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2dbd n TYR 40 N -2.74 0.00 -2.60 1.24 4.01 0.19 -5.01 117.16 112.25 2dbd n TYR 40 Ca -0.05 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.51 2dbd n TYR 40 Cb 0.59 -0.03 0.09 0.00 -0.31 0.00 0.00 39.34 39.68 2dbd n TYR 40 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2dbd n PHE 41 N -2.95 -2.95 -4.29 -0.72 3.01 -1.18 -5.01 117.46 103.37 2dbd n PHE 41 Ca -0.02 -1.47 -0.15 0.00 1.01 0.00 0.00 57.45 56.82 2dbd n PHE 41 Cb 0.51 -0.58 -0.10 0.00 -0.01 0.00 0.00 39.48 39.30 2dbd n PHE 41 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2dbd s SER 42 N -4.28 1.30 0.36 4.37 0.01 -1.26 -4.84 113.70 109.36 2dbd s SER 42 Ca 0.54 -1.28 0.03 0.00 1.31 0.00 0.00 55.95 56.55 2dbd s SER 42 Cb -0.03 0.12 0.67 0.00 0.21 0.00 0.00 66.02 66.99 2dbd s SER 42 CO 0.35 -0.64 2.01 0.00 0.41 0.00 0.00 173.24 175.37 2dbd h ALA 43 N 2.52 1.58 -0.43 1.44 0.00 -2.00 -1.51 119.26 120.86 2dbd h ALA 43 Ca -0.38 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 2dbd h ALA 43 Cb 1.23 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2dbd h ALA 43 CO 0.62 0.37 -0.15 0.93 0.00 0.00 0.00 179.25 181.02 2dbd h GLU 44 N 0.82 0.86 0.09 0.00 3.07 -1.99 -1.29 114.58 116.15 2dbd h GLU 44 Ca 0.24 -0.35 -0.00 0.00 -0.50 0.00 0.00 59.36 58.74 2dbd h GLU 44 Cb -0.04 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.84 2dbd h GLU 44 CO -0.06 0.99 -0.05 -0.44 -1.40 0.00 0.00 179.01 178.06 2dbd h ASP 45 N 0.69 -0.11 0.07 1.42 5.19 -1.81 -2.31 116.42 119.55 2dbd h ASP 45 Ca 0.10 -0.15 -0.03 0.00 -0.62 0.00 0.00 57.03 56.33 2dbd h ASP 45 Cb 0.71 0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.24 2dbd h ASP 45 CO 0.05 0.09 -0.10 0.00 -3.12 0.00 0.00 179.24 176.16 2dbd h ALA 46 N 0.58 1.72 -0.57 3.45 0.00 -1.31 -2.40 119.26 120.73 2dbd h ALA 46 Ca -0.01 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 2dbd h ALA 46 Cb 0.25 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2dbd h ALA 46 CO 0.02 0.21 0.04 0.93 0.00 0.00 0.00 179.25 180.46 2dbd h GLU 47 N 0.09 0.97 -0.43 0.00 4.39 -0.96 -2.68 114.58 115.96 2dbd h GLU 47 Ca 0.02 -0.29 -0.10 0.00 0.34 0.00 0.00 59.36 59.33 2dbd h GLU 47 Cb 0.24 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2dbd h GLU 47 CO 0.01 0.95 -0.14 0.82 -1.16 0.00 0.00 179.01 179.50 2dbd h ILE 48 N 0.86 1.26 0.48 3.13 2.04 -0.94 -1.91 117.51 122.44 2dbd h ILE 48 Ca 0.17 -1.22 -0.02 0.00 1.00 0.00 0.00 64.86 64.78 2dbd h ILE 48 Cb 0.49 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 2dbd h ILE 48 CO 0.02 0.42 -0.25 0.58 0.00 0.00 0.00 178.15 178.92 2dbd h VAL 49 N 0.71 0.49 0.00 1.67 2.07 -1.29 -2.54 116.25 117.36 2dbd h VAL 49 Ca 0.11 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.60 2dbd h VAL 49 Cb 0.64 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 2dbd h VAL 49 CO 0.04 0.00 -0.15 0.00 0.02 0.00 0.00 177.57 177.48 2dbd h ALA 51 N 1.85 1.48 -2.74 0.00 0.00 -0.90 -3.43 119.26 115.53 2dbd h ALA 51 Ca -0.00 -0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.33 2dbd h ALA 51 Cb 0.27 0.01 0.15 0.00 0.00 0.00 0.00 17.79 18.22 2dbd h ALA 51 CO 0.02 -0.19 0.16 0.00 0.00 0.00 0.00 179.25 179.24 2dbd h PRO 53 N 0.84 0.44 0.00 0.00 0.13 -1.90 -3.48 132.00 128.04 2dbd h PRO 53 Ca -0.48 -0.47 -0.44 0.00 -0.87 0.00 0.00 66.00 63.75 2dbd h PRO 53 Cb 1.35 0.13 -0.06 0.00 0.13 0.00 0.00 31.00 32.55 2dbd h PRO 53 CO 0.53 1.12 -0.27 0.25 -0.23 0.00 0.00 178.00 179.39 2dbd n THR 54 N -4.19 0.00 -0.03 1.56 -2.24 -1.26 -5.08 114.28 103.05 2dbd n THR 54 Ca -0.10 -1.61 -0.10 0.00 -2.27 0.00 0.00 64.05 59.96 2dbd n THR 54 Cb 0.69 0.12 -0.09 0.00 -2.10 0.00 0.00 70.33 68.96 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 -0.06 -0.96 -0.78 5.75 -1.99 -3.27 115.11 113.81 2dbd h GLN 55 Ca -0.27 0.00 0.28 0.00 -0.15 0.00 0.00 58.65 58.51 2dbd h GLN 55 Cb 0.89 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.42 2dbd h GLN 55 CO 0.44 0.54 0.69 -1.35 -2.65 0.00 0.00 178.83 176.50 2dbd h PRO 56 N -0.93 0.01 -0.17 -2.39 0.11 -1.95 0.27 132.00 126.94 2dbd h PRO 56 Ca -0.01 -0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.96 2dbd h PRO 56 Cb 0.63 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.73 2dbd h PRO 56 CO 0.01 0.01 -0.51 -0.44 -0.21 0.00 0.00 178.00 176.85 2dbd h ASP 57 N 0.01 0.53 -0.41 -2.05 5.19 -1.95 -3.00 116.42 114.74 2dbd h ASP 57 Ca 0.46 -0.27 -0.04 0.00 -0.62 0.00 0.00 57.03 56.56 2dbd h ASP 57 Cb 1.81 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 41.16 2dbd h ASP 57 CO -0.01 0.95 0.11 0.11 -3.12 0.00 0.00 179.24 177.28 2dbd h LYS 58 N 0.38 0.64 -0.08 3.56 1.57 -0.51 -1.51 116.57 120.63 2dbd h LYS 58 Ca 0.01 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 2dbd h LYS 58 Cb 1.03 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 2dbd h LYS 58 CO 0.09 0.65 -0.01 0.28 -0.57 0.00 0.00 179.45 179.89 2dbd h VAL 59 N 0.52 1.06 0.04 0.50 2.07 -1.48 -1.80 116.25 117.16 2dbd h VAL 59 Ca 0.13 -0.25 -0.23 0.00 0.82 0.00 0.00 66.70 67.17 2dbd h VAL 59 Cb 0.29 1.02 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 2dbd h VAL 59 CO -0.00 0.08 -1.00 -0.09 0.02 0.00 0.00 177.57 176.58 2dbd h ARG 60 N 0.11 0.26 -0.46 1.57 2.43 -1.32 -3.03 114.38 113.94 2dbd h ARG 60 Ca 0.03 -0.33 -0.13 0.00 -0.81 0.00 0.00 59.98 58.74 2dbd h ARG 60 Cb 0.10 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 2dbd h ARG 60 CO 0.00 1.07 -0.21 -0.22 -1.51 0.00 0.00 179.97 179.10 2dbd h LYS 61 N 0.13 0.94 -0.20 0.20 1.63 -0.52 -2.61 116.57 116.14 2dbd h LYS 61 Ca -0.08 -0.39 -0.02 0.00 -0.85 0.00 0.00 60.65 59.31 2dbd h LYS 61 Cb 1.67 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 33.25 2dbd h LYS 61 CO 0.16 1.06 0.04 0.82 -3.45 0.00 0.00 179.45 178.07 2dbd h ILE 62 N 0.81 1.22 -0.77 2.00 2.04 -1.41 -1.98 117.51 119.42 2dbd h ILE 62 Ca 0.11 -0.72 0.05 0.00 1.00 0.00 0.00 64.86 65.29 2dbd h ILE 62 Cb 0.78 1.31 -0.05 0.00 -0.74 0.00 0.00 36.82 38.12 2dbd h ILE 62 CO 0.06 0.22 0.51 -0.07 0.00 0.00 0.00 178.15 178.88 2dbd h LEU 63 N 0.13 0.78 -0.71 1.44 3.38 -1.50 -0.88 115.31 117.95 2dbd h LEU 63 Ca 0.06 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 2dbd h LEU 63 Cb 0.30 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2dbd h LEU 63 CO 0.00 0.53 -0.38 -0.78 0.09 0.00 0.00 178.44 177.90 2dbd h ASP 64 N 0.90 0.59 0.29 -0.43 3.58 -1.26 -1.62 116.42 118.47 2dbd h ASP 64 Ca 0.32 -0.25 -0.01 0.00 0.42 0.00 0.00 57.03 57.50 2dbd h ASP 64 Cb 0.12 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.01 2dbd h ASP 64 CO -0.10 0.91 -0.14 -0.07 -2.88 0.00 0.00 179.24 176.96 2dbd h LEU 65 N 0.47 -0.33 -1.12 2.28 3.38 -0.50 -2.58 115.31 116.91 2dbd h LEU 65 Ca 0.04 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.85 2dbd h LEU 65 Cb 0.87 0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.65 2dbd h LEU 65 CO 0.07 0.08 0.60 0.58 0.09 0.00 0.00 178.44 179.87 2dbd h VAL 66 N -0.82 1.14 -0.01 1.22 2.07 -1.25 0.19 116.25 118.78 2dbd h VAL 66 Ca -0.04 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 2dbd h VAL 66 Cb 0.51 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 2dbd h VAL 66 CO 0.07 0.21 -0.15 1.56 0.02 0.00 0.00 177.57 179.27 2dbd h GLN 67 N 1.13 0.02 0.01 1.57 4.20 -1.30 -2.47 115.11 118.27 2dbd h GLN 67 Ca 0.37 -0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.80 2dbd h GLN 67 Cb 0.05 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.79 2dbd h GLN 67 CO -0.12 0.17 -1.53 0.77 -0.67 0.00 0.00 178.83 177.45 2dbd h SER 68 N 0.02 0.05 -0.06 1.46 0.02 -0.76 -3.36 113.55 110.91 2dbd h SER 68 Ca 0.00 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2dbd h SER 68 Cb 0.28 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2dbd h SER 68 CO 0.02 1.07 0.03 0.11 -1.14 0.00 0.00 176.83 176.92 2dbd h LYS 69 N 0.01 0.07 0.00 3.45 1.57 -0.24 -3.49 116.57 117.94 2dbd h LYS 69 Ca -0.22 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 2dbd h LYS 69 Cb 1.96 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 34.25 2dbd h LYS 69 CO 0.10 0.04 0.00 0.41 -0.57 0.00 0.00 179.45 179.43 2dbd n GLY 70 N -1.11 1.41 0.21 3.86 0.00 -1.02 -4.90 105.19 103.65 2dbd n GLY 70 Ca -0.06 -1.72 0.05 0.00 0.00 0.00 0.00 46.02 44.29 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 0.52 1.61 5.08 -1.90 -2.40 114.58 117.50 2dbd h GLU 71 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2dbd h GLU 71 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2dbd h GLU 71 CO 0.00 0.25 -0.36 1.49 -1.00 0.00 0.00 179.01 179.39 2dbd h GLU 72 N 0.00 -0.82 -0.05 2.33 4.81 -1.94 -1.22 114.58 117.69 2dbd h GLU 72 Ca -0.00 0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 2dbd h GLU 72 Cb 0.46 0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 2dbd h GLU 72 CO 0.03 -0.55 -0.30 0.28 -0.73 0.00 0.00 179.01 177.75 2dbd h VAL 73 N -0.85 1.23 -0.20 0.32 2.07 -1.86 -2.83 116.25 114.13 2dbd h VAL 73 Ca -0.06 -1.10 -0.00 0.00 0.82 0.00 0.00 66.70 66.36 2dbd h VAL 73 Cb 0.71 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.00 2dbd h VAL 73 CO 0.04 0.32 0.12 -1.28 0.02 0.00 0.00 177.57 176.79 2dbd h SER 74 N 0.08 0.24 -0.57 0.57 0.87 -1.06 0.89 113.55 114.57 2dbd h SER 74 Ca 0.01 -0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.49 2dbd h SER 74 Cb 0.57 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.44 2dbd h SER 74 CO 0.04 0.22 0.24 -0.08 -0.53 0.00 0.00 176.83 176.73 2dbd h GLU 75 N 0.24 0.84 -0.48 2.24 4.81 -1.08 -1.36 114.58 119.79 2dbd h GLU 75 Ca 0.07 -0.14 -0.07 0.00 -0.13 0.00 0.00 59.36 59.09 2dbd h GLU 75 Cb 0.03 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 2dbd h GLU 75 CO -0.01 0.72 0.01 0.35 -0.73 0.00 0.00 179.01 179.34 2dbd h PHE 76 N 0.78 0.84 -0.07 0.92 3.57 -1.29 0.37 116.94 122.06 2dbd h PHE 76 Ca 0.19 -0.11 -0.11 0.00 3.53 0.00 0.00 57.97 61.47 2dbd h PHE 76 Cb 0.18 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 2dbd h PHE 76 CO 0.01 0.77 -0.44 0.35 -2.23 0.00 0.00 178.31 176.77 2dbd h PHE 77 N 0.74 0.19 0.01 0.41 3.57 -0.49 -2.81 116.94 118.56 2dbd h PHE 77 Ca 0.15 -0.05 -0.26 0.00 3.53 0.00 0.00 57.97 61.33 2dbd h PHE 77 Cb 0.44 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.10 2dbd h PHE 77 CO 0.02 0.57 -1.43 -0.07 -2.23 0.00 0.00 178.31 175.18 2dbd h LEU 78 N 0.13 0.02 -0.86 0.59 3.38 -0.83 -3.30 115.31 114.45 2dbd h LEU 78 Ca 0.01 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 2dbd h LEU 78 Cb 0.83 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 2dbd h LEU 78 CO 0.06 1.03 0.30 0.22 0.09 0.00 0.00 178.44 180.15 2dbd h TYR 79 N 0.00 1.16 -0.04 1.13 5.03 -0.16 -2.40 116.97 121.69 2dbd h TYR 79 Ca -0.18 -0.09 -0.09 0.00 2.58 0.00 0.00 58.73 60.96 2dbd h TYR 79 Cb 1.92 -0.35 -0.01 0.00 1.55 0.00 0.00 36.73 39.84 2dbd h TYR 79 CO 0.00 0.88 -0.39 -0.07 -1.32 0.00 0.00 178.16 177.27 2dbd h LEU 80 N 1.11 0.09 -2.05 2.82 3.38 -1.62 -2.70 115.31 116.34 2dbd h LEU 80 Ca 0.26 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.21 2dbd h LEU 80 Cb 0.21 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2dbd h LEU 80 CO -0.02 0.47 0.05 -0.07 0.09 0.00 0.00 178.44 178.97 2dbd h LEU 81 N 0.08 0.00 0.07 1.67 3.38 -1.51 0.24 115.31 119.24 2dbd h LEU 81 Ca 0.01 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 2dbd h LEU 81 Cb 0.72 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.49 2dbd h LEU 81 CO 0.05 0.00 -0.54 -0.61 0.09 0.00 0.00 178.44 177.44 2dbd h GLN 82 N 0.00 0.25 -0.04 1.13 4.15 -1.48 -1.18 115.11 117.93 2dbd h GLN 82 Ca 0.03 -0.36 -0.01 0.00 0.77 0.00 0.00 58.65 59.09 2dbd h GLN 82 Cb 0.14 0.12 -0.00 0.00 0.21 0.00 0.00 27.48 27.95 2dbd h GLN 82 CO -0.00 1.12 -0.01 1.96 -1.93 0.00 0.00 178.83 179.97 2dbd h GLN 83 N -0.45 0.07 0.00 1.69 7.50 -1.40 -2.95 115.11 119.58 2dbd h GLN 83 Ca -0.09 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.04 2dbd h GLN 83 Cb 1.36 -0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.89 2dbd h GLN 83 CO 0.10 0.40 0.00 -0.07 -1.50 0.00 0.00 178.83 177.76 2dbd h LEU 84 N -0.26 0.00 -1.90 1.46 3.38 -0.68 -3.21 115.31 114.10 2dbd h LEU 84 Ca 0.01 0.00 0.21 0.00 0.09 0.00 0.00 57.88 58.19 2dbd h LEU 84 Cb 0.37 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2dbd h LEU 84 CO 0.00 0.00 0.63 0.00 0.09 0.00 0.00 178.44 179.16 2dbd h ALA 85 N 2.33 2.56 -0.23 1.53 0.00 -1.02 0.32 119.26 124.75 2dbd h ALA 85 Ca 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.90 2dbd h ALA 85 Cb 0.56 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2dbd h ALA 85 CO 0.00 -1.00 0.16 0.22 0.00 0.00 0.00 179.25 178.63 2dbd h ASP 86 N 0.00 0.22 0.48 0.00 1.82 -1.72 -2.22 116.42 115.00 2dbd h ASP 86 Ca 0.34 -0.00 -0.30 0.00 -0.39 0.00 0.00 57.03 56.68 2dbd h ASP 86 Cb 1.60 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 41.55 2dbd h ASP 86 CO -0.00 0.16 -1.50 0.00 -1.61 0.00 0.00 179.24 176.29 2dbd h ALA 87 N 1.86 0.27 -2.38 -0.78 0.00 -0.63 -3.46 119.26 114.13 2dbd h ALA 87 Ca 0.09 -1.09 -0.51 0.00 0.00 0.00 0.00 54.91 53.40 2dbd h ALA 87 Cb 0.05 0.25 0.07 0.00 0.00 0.00 0.00 17.79 18.16 2dbd h ALA 87 CO -0.02 1.14 0.41 0.71 0.00 0.00 0.00 179.25 181.49 2dbd s TYR 88 N -2.62 3.47 -0.07 0.00 1.51 -0.83 -5.01 117.35 113.80 2dbd s TYR 88 Ca -0.08 1.26 0.17 0.00 -1.01 0.00 0.00 57.07 57.40 2dbd s TYR 88 Cb 0.07 -2.83 0.33 0.00 -0.11 0.00 0.00 41.96 39.43 2dbd s TYR 88 CO 0.85 -0.90 1.15 1.33 -1.11 0.00 0.00 175.55 176.87 2dbd n VAL 89 N -2.88 0.76 0.00 0.71 0.24 -1.26 -4.80 118.33 111.09 2dbd n VAL 89 Ca 0.06 -1.52 0.00 0.00 -2.04 0.00 0.00 64.34 60.85 2dbd n VAL 89 Cb 0.55 0.46 0.00 0.00 -1.47 0.00 0.00 33.84 33.38 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 -0.20 3.63 -2.03 -1.34 8.00 -1.26 -4.73 116.55 118.61 2dbd n ASP 90 Ca 0.09 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.38 2dbd n ASP 90 Cb 0.90 0.06 0.14 0.00 -0.02 0.00 0.00 41.12 42.19 2dbd n ASP 90 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2dbd n LEU 91 N -2.31 6.23 0.00 0.64 4.77 -1.26 -4.49 117.00 120.59 2dbd n LEU 91 Ca 0.00 -3.32 -0.12 0.00 -0.03 0.00 0.00 56.01 52.54 2dbd n LEU 91 Cb 0.44 -0.81 -0.09 0.00 -2.33 0.00 0.00 43.42 40.63 2dbd n LEU 91 CO 0.00 1.01 0.47 -0.09 -1.33 0.00 0.00 177.39 177.45 2dbd h ARG 92 N 0.95 -0.09 0.00 3.23 1.12 -1.87 -3.24 114.38 114.47 2dbd h ARG 92 Ca 0.52 0.01 -0.11 0.00 -1.11 0.00 0.00 59.98 59.28 2dbd h ARG 92 Cb 2.32 0.02 -0.02 0.00 -0.01 0.00 0.00 29.97 32.28 2dbd h ARG 92 CO 0.96 0.46 -0.56 -1.00 -3.11 0.00 0.00 179.97 176.73 2dbd h PRO 93 N -0.76 0.00 0.64 0.20 0.13 -1.96 -3.29 132.00 126.95 2dbd h PRO 93 Ca -0.01 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 2dbd h PRO 93 Cb 0.60 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 2dbd h PRO 93 CO 0.02 0.52 -0.42 2.35 -0.23 0.00 0.00 178.00 180.23 2dbd h TRP 94 N 0.00 -1.14 -0.62 1.56 7.01 -1.82 0.19 115.95 121.13 2dbd h TRP 94 Ca -0.01 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.06 2dbd h TRP 94 Cb 1.41 0.41 -0.04 0.00 -2.10 0.00 0.00 29.16 28.85 2dbd h TRP 94 CO 0.00 -0.62 0.41 -0.07 -2.79 0.00 0.00 178.44 175.37 2dbd h LEU 95 N -1.00 0.46 -0.92 0.65 3.38 -1.70 0.13 115.31 116.30 2dbd h LEU 95 Ca -0.08 0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 2dbd h LEU 95 Cb 0.81 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2dbd h LEU 95 CO 0.06 0.28 -0.51 -0.07 0.09 0.00 0.00 178.44 178.29 2dbd h LEU 96 N 0.51 0.06 0.03 1.67 3.38 -1.54 0.44 115.31 119.86 2dbd h LEU 96 Ca 0.28 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 2dbd h LEU 96 Cb 0.42 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2dbd h LEU 96 CO -0.08 0.57 -0.01 -0.33 0.09 0.00 0.00 178.44 178.67 2dbd h GLU 97 N 0.05 -0.04 -0.07 1.13 4.39 0.13 -3.34 114.58 116.84 2dbd h GLU 97 Ca -0.00 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.72 2dbd h GLU 97 Cb 0.93 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.58 2dbd h GLU 97 CO 0.07 -0.02 0.05 -0.84 -1.16 0.00 0.00 179.01 177.11 2dbd h ILE 98 N -0.14 0.89 -5.15 3.13 3.07 -1.42 -3.48 117.51 114.41 2dbd h ILE 98 Ca -0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 2dbd h ILE 98 Cb 0.03 0.96 -0.02 0.00 -0.27 0.00 0.00 36.82 37.52 2dbd h ILE 98 CO 0.01 0.00 -1.08 0.61 -1.05 0.00 0.00 178.15 176.64 2dbd n GLY 99 N -1.52 -4.37 0.13 0.16 0.00 0.14 -4.96 105.19 94.78 2dbd n GLY 99 Ca -0.01 0.64 -0.21 0.00 0.00 0.00 0.00 46.02 46.44 2dbd n GLY 99 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2dbd h PHE 100 N 3.23 0.66 -2.05 1.61 3.04 -1.93 -3.50 116.94 118.02 2dbd h PHE 100 Ca -0.08 -0.48 0.07 0.00 3.98 0.00 0.00 57.97 61.46 2dbd h PHE 100 Cb 0.20 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 38.67 2dbd h PHE 100 CO 0.01 1.53 0.27 0.45 -2.02 0.00 0.00 178.31 178.55 2dbd n SER 101 N -3.56 -0.82 -3.93 0.41 2.88 -1.26 -5.15 113.62 102.19 2dbd n SER 101 Ca -0.19 -1.43 -0.27 0.00 -1.33 0.00 0.00 58.87 55.65 2dbd n SER 101 Cb 1.07 1.33 -0.17 0.00 -0.75 0.00 0.00 64.21 65.69 2dbd n SER 101 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dbd s SER 102 N -2.14 2.16 -0.43 -3.46 0.01 -1.26 -5.08 113.70 103.50 2dbd s SER 102 Ca 0.11 -0.31 0.04 0.00 1.31 0.00 0.00 55.95 57.09 2dbd s SER 102 Cb -0.01 -0.86 0.12 0.00 0.21 0.00 0.00 66.02 65.47 2dbd s SER 102 CO 0.03 -0.10 0.16 -0.83 0.41 0.00 0.00 173.24 172.91 2dbd s GLY 103 N 1.58 2.14 0.06 3.44 0.00 -1.26 -4.97 107.32 108.30 2dbd s GLY 103 Ca 0.03 -2.86 -0.20 0.00 0.00 0.00 0.00 44.72 41.69 2dbd s GLY 103 CO -0.07 1.02 1.42 -0.56 0.00 0.00 0.00 173.10 174.91 2dbd h PRO 104 N 7.06 0.39 -0.08 2.90 0.13 -2.05 -3.33 132.00 137.02 2dbd h PRO 104 Ca -0.06 -0.17 -0.10 0.00 -0.87 0.00 0.00 66.00 64.80 2dbd h PRO 104 Cb 0.95 -0.01 -0.14 0.00 0.13 0.00 0.00 31.00 31.93 2dbd h PRO 104 CO 0.60 0.69 -0.67 0.43 -0.23 0.00 0.00 178.00 178.82 2dbd n SER 105 N -4.59 1.83 -3.59 1.44 7.64 -1.26 -4.92 113.62 110.18 2dbd n SER 105 Ca -0.05 -3.41 -0.29 0.00 1.01 0.00 0.00 58.87 56.13 2dbd n SER 105 Cb 0.31 -0.46 -0.12 0.00 -1.01 0.00 0.00 64.21 62.93 2dbd n SER 105 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dbd s SER 106 N -3.01 3.11 0.00 6.43 0.15 -1.25 -5.32 113.70 113.81 2dbd s SER 106 Ca 0.38 -2.67 0.15 0.00 0.70 0.00 0.00 55.95 54.51 2dbd s SER 106 Cb 0.38 -0.77 0.92 0.00 -1.71 0.00 0.00 66.02 64.83 2dbd s SER 106 CO -0.08 -0.25 1.33 0.61 1.20 0.00 0.00 173.24 176.05