#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fbn s SER 17 N 0.00 6.12 0.43 3.42 0.01 -1.26 -5.05 113.70 117.37 3fbn s SER 17 Ca 0.00 0.21 -0.25 0.00 1.31 0.00 0.00 55.95 57.22 3fbn s SER 17 Cb 0.00 -1.72 -0.09 0.00 0.21 0.00 0.00 66.02 64.41 3fbn s SER 17 CO 0.00 -0.38 1.30 -2.65 0.41 0.00 0.00 173.24 171.92 3fbn n PRO 18 N -1.76 1.97 -0.18 12.44 -0.02 -1.26 -4.86 135.00 141.33 3fbn n PRO 18 Ca -0.03 0.70 0.27 0.00 -2.02 0.00 0.00 63.50 62.42 3fbn n PRO 18 Cb 0.57 -2.42 0.69 0.00 -0.02 0.00 0.00 33.50 32.32 3fbn n PRO 18 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3fbn h SER 19 N 2.09 0.06 0.00 2.55 4.64 -2.06 -2.38 113.55 118.45 3fbn h SER 19 Ca -0.48 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3fbn h SER 19 Cb 1.29 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3fbn h SER 19 CO 0.60 0.02 0.01 -1.22 -0.87 0.00 0.00 176.83 175.37 3fbn n TYR 20 N -4.31 0.27 0.18 4.77 4.02 -1.26 -2.63 117.16 118.21 3fbn n TYR 20 Ca 0.18 0.14 0.05 0.00 -0.01 0.00 0.00 57.90 58.27 3fbn n TYR 20 Cb 0.92 -0.72 0.51 0.00 -0.02 0.00 0.00 39.34 40.02 3fbn n TYR 20 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 3fbn h VAL 21 N 0.00 1.10 -0.03 -0.72 2.07 -1.79 -2.91 116.25 113.97 3fbn h VAL 21 Ca 0.00 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 67.12 3fbn h VAL 21 Cb 0.01 1.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.88 3fbn h VAL 21 CO 0.00 0.13 0.05 0.07 0.02 0.00 0.00 177.57 177.83 3fbn h LYS 22 N 0.12 0.00 -0.00 1.57 2.10 -1.78 -0.65 116.57 117.93 3fbn h LYS 22 Ca 0.03 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.68 3fbn h LYS 22 Cb 0.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.51 3fbn h LYS 22 CO 0.01 0.00 -0.14 1.19 -2.00 0.00 0.00 179.45 178.51 3fbn n PHE 23 N -3.57 0.00 -2.37 0.07 3.01 -1.10 -4.56 117.46 108.94 3fbn n PHE 23 Ca -0.02 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.02 3fbn n PHE 23 Cb 0.13 -0.27 0.00 0.00 -0.01 0.00 0.00 39.48 39.33 3fbn n PHE 23 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 3fbn n PHE 24 N -1.18 2.68 -4.00 1.38 3.01 -0.25 -4.80 117.46 114.29 3fbn n PHE 24 Ca 0.11 -2.74 -0.23 0.00 1.01 0.00 0.00 57.45 55.61 3fbn n PHE 24 Cb 0.30 -1.72 -0.03 0.00 -0.01 0.00 0.00 39.48 38.02 3fbn n PHE 24 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 3fbn s THR 25 N -1.12 5.05 0.34 4.37 -4.23 -1.26 -5.01 115.64 113.79 3fbn s THR 25 Ca 0.43 -1.00 0.22 0.00 -1.18 0.00 0.00 61.69 60.16 3fbn s THR 25 Cb 0.13 -3.69 0.21 0.00 1.34 0.00 0.00 72.50 70.49 3fbn s THR 25 CO -0.02 -0.25 1.94 1.56 -0.54 0.00 0.00 174.62 177.31 3fbn h GLN 26 N 1.60 0.00 0.67 3.99 7.50 -1.99 -2.04 115.11 124.84 3fbn h GLN 26 Ca -0.50 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 58.62 3fbn h GLN 26 Cb 1.22 0.00 0.01 0.00 0.05 0.00 0.00 27.48 28.76 3fbn h GLN 26 CO 0.63 0.23 -0.32 1.03 -1.50 0.00 0.00 178.83 178.90 3fbn h SER 27 N 0.00 -0.76 -0.78 1.46 0.87 -1.96 -2.30 113.55 110.09 3fbn h SER 27 Ca -0.00 -0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.59 3fbn h SER 27 Cb 0.53 0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.64 3fbn h SER 27 CO 0.03 -0.48 0.51 0.78 -0.53 0.00 0.00 176.83 177.14 3fbn h ASN 28 N -0.99 0.82 -0.91 6.23 2.35 -1.83 -1.56 115.58 119.69 3fbn h ASN 28 Ca -0.09 -0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.67 3fbn h ASN 28 Cb 0.71 -0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.85 3fbn h ASN 28 CO 0.15 0.56 0.60 -0.07 -1.65 0.00 0.00 177.43 177.02 3fbn h LEU 29 N 0.95 1.03 -0.65 1.61 3.38 -1.31 -1.41 115.31 118.91 3fbn h LEU 29 Ca 0.31 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 58.12 3fbn h LEU 29 Cb 0.05 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3fbn h LEU 29 CO -0.09 0.73 -0.37 -0.33 0.09 0.00 0.00 178.44 178.48 3fbn h GLU 30 N 1.21 0.64 0.00 1.13 5.08 -0.71 -2.89 114.58 119.04 3fbn h GLU 30 Ca 0.34 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3fbn h GLU 30 Cb -0.10 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.15 3fbn h GLU 30 CO -0.08 0.91 0.00 1.63 -1.00 0.00 0.00 179.01 180.47 3fbn n LYS 31 N -4.05 0.20 -0.09 2.33 5.02 -0.83 -4.13 118.16 116.60 3fbn n LYS 31 Ca -0.01 0.23 -0.09 0.00 -2.02 0.00 0.00 58.31 56.42 3fbn n LYS 31 Cb 0.50 -1.76 -0.02 0.00 -0.02 0.00 0.00 35.03 33.74 3fbn n LYS 31 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3fbn h LEU 32 N 0.00 0.35 -0.66 -0.35 5.85 -1.05 -2.61 115.31 116.84 3fbn h LEU 32 Ca 0.00 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.77 3fbn h LEU 32 Cb 0.60 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.48 3fbn h LEU 32 CO 0.00 0.25 0.36 -0.65 -0.34 0.00 0.00 178.44 178.06 3fbn h PRO 33 N 0.42 0.64 -0.32 5.25 0.11 -1.76 -0.82 132.00 135.52 3fbn h PRO 33 Ca 0.11 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.13 3fbn h PRO 33 Cb -0.05 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 30.91 3fbn h PRO 33 CO -0.02 0.42 -0.03 0.87 -0.21 0.00 0.00 178.00 179.03 3fbn h LYS 34 N 0.66 0.58 -0.94 1.05 1.57 -1.81 -2.92 116.57 114.76 3fbn h LYS 34 Ca 0.30 -0.20 0.12 0.00 -1.87 0.00 0.00 60.65 59.00 3fbn h LYS 34 Cb 0.20 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.38 3fbn h LYS 34 CO -0.19 0.74 0.57 -0.92 -0.57 0.00 0.00 179.45 179.08 3fbn h TYR 35 N 0.37 1.03 -0.48 -1.35 3.20 -1.05 -1.91 116.97 116.79 3fbn h TYR 35 Ca 0.09 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 3fbn h TYR 35 Cb 0.49 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 3fbn h TYR 35 CO 0.04 0.38 0.24 0.87 -1.64 0.00 0.00 178.16 178.05 3fbn h LYS 36 N 0.89 0.66 -0.02 1.82 1.57 -0.97 -2.14 116.57 118.38 3fbn h LYS 36 Ca 0.48 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 59.17 3fbn h LYS 36 Cb 0.51 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.69 3fbn h LYS 36 CO -0.28 0.51 -0.06 0.93 -0.57 0.00 0.00 179.45 179.98 3fbn h GLU 37 N 0.67 0.07 -0.74 3.15 5.08 -1.32 -3.14 114.58 118.36 3fbn h GLU 37 Ca 0.17 -0.06 0.14 0.00 -1.00 0.00 0.00 59.36 58.62 3fbn h GLU 37 Cb 0.06 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.27 3fbn h GLU 37 CO -0.02 0.69 0.49 -0.22 -1.00 0.00 0.00 179.01 178.95 3fbn h LYS 38 N -0.53 0.41 0.00 2.33 3.64 -1.24 -0.26 116.57 120.92 3fbn h LYS 38 Ca -0.00 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.25 3fbn h LYS 38 Cb 0.70 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 3fbn h LYS 38 CO 0.01 0.27 -0.50 -0.22 -2.27 0.00 0.00 179.45 176.75 3fbn h LYS 39 N 0.42 0.00 0.00 1.90 3.64 -1.39 -2.14 116.57 119.00 3fbn h LYS 39 Ca 0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 3fbn h LYS 39 Cb 0.81 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 3fbn h LYS 39 CO -0.11 0.50 0.00 0.00 -2.27 0.00 0.00 179.45 177.56 3fbn n ALA 40 N -2.44 1.47 1.11 5.00 0.00 -0.11 -5.13 120.51 120.41 3fbn n ALA 40 Ca -0.01 -0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.52 3fbn n ALA 40 Cb 0.51 -1.13 0.34 0.00 0.00 0.00 0.00 19.45 19.18 3fbn n ALA 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fbn n ALA 41 N -1.38 3.26 -1.52 0.00 0.00 -0.81 -5.13 120.51 114.93 3fbn n ALA 41 Ca 0.03 -0.34 -0.60 0.00 0.00 0.00 0.00 53.44 52.53 3fbn n ALA 41 Cb 0.08 -1.16 -0.08 0.00 0.00 0.00 0.00 19.45 18.28 3fbn n ALA 41 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3fbn n GLU 57 N -1.18 0.02 -2.70 0.00 2.13 -1.26 -5.13 120.64 112.52 3fbn n GLU 57 Ca 0.08 0.01 -0.07 0.00 0.66 0.00 0.00 57.16 57.85 3fbn n GLU 57 Cb 0.33 -1.51 0.11 0.00 0.27 0.00 0.00 31.44 30.65 3fbn n GLU 57 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 3fbn n GLU 58 N 1.72 1.21 -2.98 5.31 2.13 -1.26 -5.12 120.64 121.65 3fbn n GLU 58 Ca 0.21 -1.91 -0.40 0.00 0.66 0.00 0.00 57.16 55.71 3fbn n GLU 58 Cb 0.07 -0.12 -0.04 0.00 0.27 0.00 0.00 31.44 31.61 3fbn n GLU 58 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3fbn s ILE 59 N -0.13 5.00 0.00 6.31 -1.09 -1.26 -4.90 121.20 125.13 3fbn s ILE 59 Ca 0.22 1.54 0.00 0.00 -2.23 0.00 0.00 60.65 60.18 3fbn s ILE 59 Cb 0.41 -4.09 0.00 0.00 -1.58 0.00 0.00 42.46 37.20 3fbn s ILE 59 CO -0.08 0.20 0.00 0.35 -1.23 0.00 0.00 174.94 174.18 3fbn n THR 60 N 3.98 0.00 -3.88 2.92 -2.24 -1.26 -5.11 114.28 108.69 3fbn n THR 60 Ca 0.01 -0.11 -0.09 0.00 -2.27 0.00 0.00 64.05 61.58 3fbn n THR 60 Cb 0.51 0.63 -0.00 0.00 -2.10 0.00 0.00 70.33 69.37 3fbn n THR 60 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fbn h ALA 62 N 2.04 1.45 0.00 0.00 0.00 -2.00 -2.82 119.26 117.94 3fbn h ALA 62 Ca -0.28 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3fbn h ALA 62 Cb 1.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3fbn h ALA 62 CO 0.35 0.40 0.00 -0.07 0.00 0.00 0.00 179.25 179.93 3fbn h LEU 63 N 0.10 0.00 -1.76 0.00 4.07 -1.96 -2.61 115.31 113.15 3fbn h LEU 63 Ca 0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.98 3fbn h LEU 63 Cb 0.52 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.26 3fbn h LEU 63 CO 0.04 0.00 0.00 0.44 -1.08 0.00 0.00 178.44 177.84 3fbn h ASP 64 N 0.00 0.00 0.93 -0.43 3.32 -1.89 -2.45 116.42 115.91 3fbn h ASP 64 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3fbn h ASP 64 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 3fbn h ASP 64 CO 0.00 0.00 -0.23 -1.22 -1.72 0.00 0.00 179.24 176.07 3fbn n TYR 65 N -2.85 0.25 -0.45 4.55 4.02 -0.98 -3.41 117.16 118.28 3fbn n TYR 65 Ca -0.00 0.07 0.02 0.00 -0.01 0.00 0.00 57.90 57.98 3fbn n TYR 65 Cb 0.20 -0.54 0.28 0.00 -0.02 0.00 0.00 39.34 39.26 3fbn n TYR 65 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3fbn n LEU 66 N -1.73 4.74 -3.67 7.72 4.77 -0.92 -4.78 117.00 123.13 3fbn n LEU 66 Ca 0.06 -2.43 -0.19 0.00 -0.03 0.00 0.00 56.01 53.42 3fbn n LEU 66 Cb 0.37 -0.66 -0.17 0.00 -2.33 0.00 0.00 43.42 40.63 3fbn n LEU 66 CO 0.31 0.59 -0.31 -0.63 -1.33 0.00 0.00 177.39 176.02 3fbn s ILE 67 N -2.34 -0.15 0.40 -0.08 1.01 -1.22 -5.12 121.20 113.71 3fbn s ILE 67 Ca 0.41 0.40 -0.25 0.00 0.00 0.00 0.00 60.65 61.21 3fbn s ILE 67 Cb 0.32 -0.20 -0.11 0.00 0.01 0.00 0.00 42.46 42.49 3fbn s ILE 67 CO 0.11 0.16 1.12 -2.65 0.00 0.00 0.00 174.94 173.69 3fbn n PRO 68 N 5.31 1.61 -0.71 2.79 -0.02 -1.26 -4.95 135.00 137.76 3fbn n PRO 68 Ca -0.03 0.57 -0.30 0.00 -2.02 0.00 0.00 63.50 61.72 3fbn n PRO 68 Cb 0.50 -2.17 0.19 0.00 -0.02 0.00 0.00 33.50 32.00 3fbn n PRO 68 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3fbn s PRO 69 N -2.04 0.45 0.24 0.52 0.04 -1.26 -5.01 135.00 127.94 3fbn s PRO 69 Ca 0.62 1.25 -0.13 0.00 0.04 0.00 0.00 61.00 62.77 3fbn s PRO 69 Cb -0.55 -1.68 -0.08 0.00 0.04 0.00 0.00 34.50 32.23 3fbn s PRO 69 CO 0.58 -2.92 0.62 -2.14 0.04 0.00 0.00 177.00 173.18 3fbn s PRO 70 N -4.62 3.94 0.13 0.56 0.02 -1.26 -5.03 135.00 128.74 3fbn s PRO 70 Ca 0.67 0.50 -0.31 0.00 0.02 0.00 0.00 61.00 61.87 3fbn s PRO 70 Cb -0.23 -2.66 -0.09 0.00 0.02 0.00 0.00 34.50 31.54 3fbn s PRO 70 CO 0.60 0.31 1.54 -1.64 -0.33 0.00 0.00 177.00 177.48 3fbn s MET 71 N -2.62 4.24 0.96 5.54 -1.94 -1.26 -5.01 119.30 119.21 3fbn s MET 71 Ca 0.47 2.28 -0.10 0.00 -1.71 0.00 0.00 55.69 56.62 3fbn s MET 71 Cb -0.12 -3.28 0.17 0.00 2.01 0.00 0.00 34.83 33.61 3fbn s MET 71 CO 0.20 -0.60 1.13 -2.14 -0.01 0.00 0.00 175.02 173.60 3fbn s PRO 72 N 1.50 0.65 0.05 2.03 0.02 -1.26 -4.97 135.00 133.02 3fbn s PRO 72 Ca 0.69 1.45 -0.06 0.00 0.02 0.00 0.00 61.00 63.10 3fbn s PRO 72 Cb -0.41 -1.69 -0.29 0.00 0.02 0.00 0.00 34.50 32.12 3fbn s PRO 72 CO 0.31 -2.85 1.05 0.87 -0.33 0.00 0.00 177.00 176.05 3fbn h LYS 73 N -2.03 0.31 -6.36 5.54 1.79 -2.05 -3.44 116.57 110.34 3fbn h LYS 73 Ca -0.46 -0.54 -0.57 0.00 -2.18 0.00 0.00 60.65 56.90 3fbn h LYS 73 Cb 1.28 0.20 -0.04 0.00 -1.58 0.00 0.00 32.23 32.09 3fbn h LYS 73 CO 0.43 1.24 1.16 0.54 -1.08 0.00 0.00 179.45 181.73 3fbn s ASN 74 N -7.18 6.19 0.00 0.86 4.22 -1.26 -4.86 114.94 112.90 3fbn s ASN 74 Ca -0.06 1.24 0.00 0.00 -2.14 0.00 0.00 52.86 51.90 3fbn s ASN 74 Cb 0.06 -2.53 0.00 0.00 1.28 0.00 0.00 41.25 40.06 3fbn s ASN 74 CO 0.89 -1.48 0.75 1.67 -2.04 0.00 0.00 177.10 176.89 3fbn n GLN 75 N 8.07 0.81 0.19 3.55 7.27 -1.26 -2.05 117.38 133.96 3fbn n GLN 75 Ca 0.20 0.00 0.14 0.00 0.07 0.00 0.00 57.00 57.41 3fbn n GLN 75 Cb 0.47 -1.06 0.61 0.00 2.41 0.00 0.00 30.24 32.67 3fbn n GLN 75 CO 0.00 0.00 0.00 -0.56 0.07 0.00 0.00 177.06 176.57 3fbn h GLN 76 N 0.03 0.00 0.00 3.69 3.07 -1.98 -1.33 115.11 118.59 3fbn h GLN 76 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3fbn h GLN 76 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.62 3fbn h GLN 76 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 178.83 179.58 3fbn n TYR 77 N -2.56 0.00 -3.34 0.06 4.01 -0.87 -4.78 117.16 109.68 3fbn n TYR 77 Ca 0.01 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.37 3fbn n TYR 77 Cb 0.22 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.19 3fbn n TYR 77 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 3fbn s ARG 78 N -2.00 4.16 0.32 -0.72 3.52 -0.50 -5.01 118.95 118.71 3fbn s ARG 78 Ca 0.38 0.59 -0.29 0.00 -0.13 0.00 0.00 55.73 56.28 3fbn s ARG 78 Cb 0.17 -3.28 -0.11 0.00 -1.56 0.00 0.00 34.95 30.17 3fbn s ARG 78 CO 0.29 0.53 1.51 0.00 -0.81 0.00 0.00 175.30 176.83 3fbn s ALA 79 N -0.66 3.65 -0.31 6.12 0.00 -1.26 -4.89 121.76 124.40 3fbn s ALA 79 Ca 0.27 1.52 0.21 0.00 0.00 0.00 0.00 51.96 53.97 3fbn s ALA 79 Cb -0.18 -3.61 0.16 0.00 0.00 0.00 0.00 23.12 19.50 3fbn s ALA 79 CO 0.15 -0.96 1.36 0.27 0.00 0.00 0.00 175.76 176.58 3fbn h PHE 80 N 4.02 0.00 -0.25 0.00 -0.00 -1.95 -3.49 116.94 115.27 3fbn h PHE 80 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.48 3fbn h PHE 80 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.18 3fbn h PHE 80 CO 0.56 0.12 0.00 0.41 -0.00 0.00 0.00 178.31 179.40 3fbn n GLY 81 N 1.16 1.30 3.14 6.09 0.00 -1.26 -5.16 105.19 110.46 3fbn n GLY 81 Ca 0.02 -0.63 -0.22 0.00 0.00 0.00 0.00 46.02 45.19 3fbn n GLY 81 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fbn s SER 82 N 2.00 1.77 -0.18 1.61 0.01 -1.26 -5.12 113.70 112.53 3fbn s SER 82 Ca 0.00 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 56.91 3fbn s SER 82 Cb 0.00 -0.16 0.04 0.00 0.21 0.00 0.00 66.02 66.11 3fbn s SER 82 CO 0.00 0.13 -0.09 -0.63 0.41 0.00 0.00 173.24 173.06 3fbn s ILE 83 N -0.55 1.43 -1.30 1.44 1.01 -1.26 -5.30 121.20 116.68 3fbn s ILE 83 Ca 0.05 -0.83 0.10 0.00 0.00 0.00 0.00 60.65 59.96 3fbn s ILE 83 Cb -0.07 -1.53 0.08 0.00 0.01 0.00 0.00 42.46 40.95 3fbn s ILE 83 CO 0.00 0.18 0.83 0.79 0.00 0.00 0.00 174.94 176.74