#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fnc s ASP 2 N 0.00 6.56 0.13 0.00 1.01 -1.26 -5.25 116.67 117.86 3fnc s ASP 2 Ca 0.00 0.99 -0.10 0.00 0.71 0.00 0.00 52.55 54.14 3fnc s ASP 2 Cb 0.00 -2.26 0.00 0.00 1.01 0.00 0.00 42.92 41.68 3fnc s ASP 2 CO 0.00 -0.24 0.27 0.72 0.21 0.00 0.00 175.17 176.13 3fnc s PHE 3 N -2.11 0.17 0.07 4.23 -0.71 -1.26 -4.41 117.98 113.96 3fnc s PHE 3 Ca 0.49 -0.55 0.07 0.00 -1.04 0.00 0.00 56.93 55.89 3fnc s PHE 3 Cb -0.11 0.02 -0.03 0.00 -1.21 0.00 0.00 43.02 41.69 3fnc s PHE 3 CO 0.27 -0.65 -0.18 -1.01 -1.34 0.00 0.00 175.22 172.31 3fnc s HIS 4 N -3.89 1.53 -0.12 3.49 3.76 -0.05 -4.98 115.29 115.03 3fnc s HIS 4 Ca 0.09 -0.40 0.01 0.00 -0.15 0.00 0.00 55.06 54.61 3fnc s HIS 4 Cb 0.04 -0.88 -0.02 0.00 1.11 0.00 0.00 32.58 32.83 3fnc s HIS 4 CO -0.07 0.11 -0.13 0.42 -0.85 0.00 0.00 174.74 174.22 3fnc s ILE 5 N -1.03 3.05 0.20 0.60 -1.09 -1.26 -0.88 121.20 120.79 3fnc s ILE 5 Ca 0.04 -0.67 -0.12 0.00 -2.23 0.00 0.00 60.65 57.66 3fnc s ILE 5 Cb -0.09 -2.27 0.00 0.00 -1.58 0.00 0.00 42.46 38.52 3fnc s ILE 5 CO 0.03 0.54 0.41 0.00 -1.23 0.00 0.00 174.94 174.68 3fnc s ARG 6 N 0.15 1.35 0.41 2.79 1.70 -0.79 -5.00 118.95 119.55 3fnc s ARG 6 Ca -0.07 -1.12 -0.26 0.00 -0.47 0.00 0.00 55.73 53.81 3fnc s ARG 6 Cb -0.15 0.45 -0.09 0.00 -0.57 0.00 0.00 34.95 34.59 3fnc s ARG 6 CO 0.05 -0.54 1.34 0.15 -1.08 0.00 0.00 175.30 175.22 3fnc s LYS 7 N -3.96 3.95 0.63 3.89 1.02 -1.26 -0.42 119.74 123.59 3fnc s LYS 7 Ca 0.17 2.24 -0.17 0.00 0.02 0.00 0.00 55.97 58.23 3fnc s LYS 7 Cb 0.01 -2.78 -0.02 0.00 -0.52 0.00 0.00 37.83 34.53 3fnc s LYS 7 CO 0.02 -0.54 1.16 0.00 -0.92 0.00 0.00 175.35 175.07 3fnc s ALA 8 N -1.23 2.48 0.35 5.17 0.00 0.15 -4.68 121.76 124.00 3fnc s ALA 8 Ca 0.57 0.79 0.08 0.00 0.00 0.00 0.00 51.96 53.40 3fnc s ALA 8 Cb -0.40 -3.39 -0.07 0.00 0.00 0.00 0.00 23.12 19.26 3fnc s ALA 8 CO 0.52 -1.23 -0.06 0.95 0.00 0.00 0.00 175.76 175.94 3fnc s THR 9 N -1.95 2.07 0.38 0.00 -4.23 -1.26 -4.97 115.64 105.68 3fnc s THR 9 Ca 0.72 -2.15 0.12 0.00 -1.18 0.00 0.00 61.69 59.21 3fnc s THR 9 Cb -0.25 -2.69 0.34 0.00 1.34 0.00 0.00 72.50 71.24 3fnc s THR 9 CO 0.36 -0.17 1.85 0.78 -0.54 0.00 0.00 174.62 176.90 3fnc h ASN 10 N 2.02 0.56 0.12 3.99 4.21 -1.95 -0.90 115.58 123.63 3fnc h ASN 10 Ca -0.42 0.05 0.00 0.00 1.21 0.00 0.00 56.30 57.14 3fnc h ASN 10 Cb 1.25 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 38.39 3fnc h ASN 10 CO 0.72 0.25 0.00 -1.54 -1.29 0.00 0.00 177.43 175.57 3fnc n SER 11 N -4.56 0.00 -0.18 5.81 3.41 -1.26 -1.83 113.62 115.00 3fnc n SER 11 Ca 0.19 -0.46 0.13 0.00 -0.26 0.00 0.00 58.87 58.47 3fnc n SER 11 Cb 0.58 -0.09 0.46 0.00 -0.26 0.00 0.00 64.21 64.90 3fnc n SER 11 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3fnc n ASP 12 N -1.09 0.76 -0.10 4.04 8.00 -0.34 -4.51 116.55 123.30 3fnc n ASP 12 Ca 0.14 -0.70 -0.06 0.00 0.71 0.00 0.00 54.79 54.88 3fnc n ASP 12 Cb 0.10 0.05 0.01 0.00 -0.02 0.00 0.00 41.12 41.26 3fnc n ASP 12 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fnc h ALA 13 N 3.60 0.38 -0.78 2.24 0.00 -1.51 -0.54 119.26 122.64 3fnc h ALA 13 Ca 0.00 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.01 3fnc h ALA 13 Cb 0.45 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 3fnc h ALA 13 CO 0.00 -0.32 0.49 0.93 0.00 0.00 0.00 179.25 180.35 3fnc h GLU 14 N 0.21 0.92 -0.32 0.00 3.07 -1.84 -0.35 114.58 116.26 3fnc h GLU 14 Ca 0.16 -0.06 -0.13 0.00 -0.50 0.00 0.00 59.36 58.83 3fnc h GLU 14 Cb 0.18 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 27.87 3fnc h GLU 14 CO -0.21 0.61 -0.34 0.00 -1.40 0.00 0.00 179.01 177.67 3fnc h ALA 15 N 1.34 0.79 -0.37 3.43 0.00 -1.66 -1.34 119.26 121.44 3fnc h ALA 15 Ca 0.32 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 3fnc h ALA 15 Cb 0.04 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3fnc h ALA 15 CO -0.12 0.65 -0.01 0.82 0.00 0.00 0.00 179.25 180.59 3fnc h ILE 16 N 0.61 1.26 -0.58 0.00 2.04 -0.86 -1.17 117.51 118.81 3fnc h ILE 16 Ca 0.06 -1.01 0.10 0.00 1.00 0.00 0.00 64.86 65.01 3fnc h ILE 16 Cb 0.87 1.17 -0.07 0.00 -0.74 0.00 0.00 36.82 38.05 3fnc h ILE 16 CO 0.08 0.34 0.18 -0.61 0.00 0.00 0.00 178.15 178.13 3fnc h GLN 17 N 0.48 0.33 -0.35 2.37 4.15 -0.90 -0.68 115.11 120.51 3fnc h GLN 17 Ca 0.10 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.52 3fnc h GLN 17 Cb 0.48 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.07 3fnc h GLN 17 CO 0.02 0.22 0.22 1.25 -1.93 0.00 0.00 178.83 178.61 3fnc h HIS 18 N 0.34 0.41 -0.29 3.99 2.76 -0.93 -0.06 115.15 121.36 3fnc h HIS 18 Ca 0.30 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.47 3fnc h HIS 18 Cb 0.39 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.20 3fnc h HIS 18 CO -0.19 0.24 0.14 0.28 -1.30 0.00 0.00 177.93 177.10 3fnc h VAL 19 N 0.44 1.15 -0.42 5.26 2.07 -0.85 -0.56 116.25 123.34 3fnc h VAL 19 Ca 0.13 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 3fnc h VAL 19 Cb -0.02 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 3fnc h VAL 19 CO -0.05 0.15 0.26 0.00 0.02 0.00 0.00 177.57 177.96 3fnc h ALA 20 N 1.00 0.54 -0.22 1.67 0.00 -0.98 -0.00 119.26 121.26 3fnc h ALA 20 Ca 0.10 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3fnc h ALA 20 Cb 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3fnc h ALA 20 CO -0.01 0.02 0.02 1.15 0.00 0.00 0.00 179.25 180.43 3fnc h THR 21 N 0.56 1.24 -0.33 0.00 2.02 -0.86 0.56 112.91 116.10 3fnc h THR 21 Ca 0.15 -0.81 -0.02 0.00 0.77 0.00 0.00 66.41 66.50 3fnc h THR 21 Cb -0.02 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 3fnc h THR 21 CO -0.03 0.25 0.15 0.74 0.37 0.00 0.00 175.52 177.00 3fnc h THR 22 N 0.17 1.17 -0.24 3.16 2.02 -0.97 -1.45 112.91 116.77 3fnc h THR 22 Ca 0.07 -0.52 -0.01 0.00 0.77 0.00 0.00 66.41 66.72 3fnc h THR 22 Cb 0.36 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 3fnc h THR 22 CO 0.01 0.18 0.09 -1.28 0.37 0.00 0.00 175.52 174.89 3fnc h SER 23 N 0.39 0.33 -0.18 4.18 0.87 -0.91 -1.92 113.55 116.31 3fnc h SER 23 Ca 0.11 -0.17 0.03 0.00 -1.23 0.00 0.00 61.79 60.54 3fnc h SER 23 Cb 0.15 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 61.99 3fnc h SER 23 CO -0.01 0.41 -0.03 -0.50 -0.53 0.00 0.00 176.83 176.17 3fnc h TRP 24 N 0.23 -0.07 -0.56 2.24 4.06 -0.78 0.29 115.95 121.36 3fnc h TRP 24 Ca 0.08 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 61.03 3fnc h TRP 24 Cb 0.18 0.06 -0.03 0.00 -1.00 0.00 0.00 29.16 28.38 3fnc h TRP 24 CO -0.01 -0.07 0.29 0.45 -3.56 0.00 0.00 178.44 175.55 3fnc h HIS 25 N 0.01 0.75 0.24 0.49 3.86 -1.14 -0.70 115.15 118.67 3fnc h HIS 25 Ca 0.09 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.27 3fnc h HIS 25 Cb 0.13 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.36 3fnc h HIS 25 CO -0.20 0.54 -0.11 1.25 0.86 0.00 0.00 177.93 180.27 3fnc h HIS 26 N 0.78 -0.30 0.00 2.45 -0.00 -0.94 -3.20 115.15 113.95 3fnc h HIS 26 Ca 0.20 -0.01 -0.10 0.00 -0.00 0.00 0.00 60.37 60.46 3fnc h HIS 26 Cb 0.04 0.10 -0.01 0.00 -0.00 0.00 0.00 27.41 27.53 3fnc h HIS 26 CO 0.01 0.08 -0.48 1.79 -0.00 0.00 0.00 177.93 179.32 3fnc h THR 27 N -0.86 0.85 -0.57 6.26 1.35 -0.68 -3.16 112.91 116.09 3fnc h THR 27 Ca -0.03 -2.15 0.00 0.00 -0.55 0.00 0.00 66.41 63.67 3fnc h THR 27 Cb 0.51 2.39 0.00 0.00 -1.73 0.00 0.00 68.15 69.32 3fnc h THR 27 CO 0.05 0.47 0.00 -1.22 -0.25 0.00 0.00 175.52 174.58 3fnc n TYR 28 N -3.24 0.75 -0.08 4.73 4.01 -0.29 -4.67 117.16 118.37 3fnc n TYR 28 Ca 0.02 -0.41 0.19 0.00 -0.16 0.00 0.00 57.90 57.54 3fnc n TYR 28 Cb 0.72 -0.00 0.62 0.00 -0.31 0.00 0.00 39.34 40.37 3fnc n TYR 28 CO 0.00 0.00 0.00 -0.56 -0.46 0.00 0.00 176.86 175.84 3fnc h GLN 29 N 4.03 0.15 -0.45 -0.72 3.07 -1.53 0.04 115.11 119.70 3fnc h GLN 29 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.73 3fnc h GLN 29 Cb 0.95 -0.03 0.00 0.00 0.08 0.00 0.00 27.48 28.47 3fnc h GLN 29 CO 0.00 0.10 0.00 -0.25 0.09 0.00 0.00 178.83 178.77 3fnc n ASP 30 N -4.41 3.51 -0.05 0.06 8.00 -1.26 -4.63 116.55 117.78 3fnc n ASP 30 Ca 0.12 -1.98 -0.08 0.00 0.71 0.00 0.00 54.79 53.56 3fnc n ASP 30 Cb 0.61 -0.29 -0.04 0.00 -0.02 0.00 0.00 41.12 41.38 3fnc n ASP 30 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3fnc n LEU 31 N 1.47 2.02 -4.00 0.64 4.77 -0.07 -5.04 117.00 116.79 3fnc n LEU 31 Ca 0.20 0.02 -0.20 0.00 -0.03 0.00 0.00 56.01 56.00 3fnc n LEU 31 Cb 0.60 -0.31 -0.15 0.00 -2.33 0.00 0.00 43.42 41.22 3fnc n LEU 31 CO 0.15 0.47 -0.44 -0.63 -1.33 0.00 0.00 177.39 175.61 3fnc s ILE 32 N -2.19 0.78 0.55 -0.08 -1.09 -0.80 -5.00 121.20 113.36 3fnc s ILE 32 Ca -0.13 -0.35 -0.21 0.00 -2.23 0.00 0.00 60.65 57.72 3fnc s ILE 32 Cb 0.04 -0.70 -0.06 0.00 -1.58 0.00 0.00 42.46 40.17 3fnc s ILE 32 CO 0.20 0.25 1.16 -2.65 -1.23 0.00 0.00 174.94 172.66 3fnc n PRO 33 N 3.32 1.33 0.10 2.79 -0.02 -1.26 -4.64 135.00 136.62 3fnc n PRO 33 Ca -0.18 0.50 -0.00 0.00 -2.02 0.00 0.00 63.50 61.79 3fnc n PRO 33 Cb 0.54 -2.34 0.28 0.00 -0.02 0.00 0.00 33.50 31.96 3fnc n PRO 33 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3fnc h SER 34 N 1.09 0.24 -0.19 2.55 4.64 -1.94 -2.14 113.55 117.79 3fnc h SER 34 Ca -0.49 -0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 60.73 3fnc h SER 34 Cb 1.33 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 3fnc h SER 34 CO 0.55 0.55 0.06 -2.24 -0.87 0.00 0.00 176.83 174.88 3fnc h ASP 35 N 0.21 0.33 0.01 4.97 2.03 -1.98 0.37 116.42 122.36 3fnc h ASP 35 Ca 0.03 -0.03 -0.12 0.00 -0.73 0.00 0.00 57.03 56.18 3fnc h ASP 35 Cb 0.66 -0.08 0.01 0.00 -0.83 0.00 0.00 39.33 39.09 3fnc h ASP 35 CO 0.05 0.33 -0.47 0.58 -1.03 0.00 0.00 179.24 178.71 3fnc h VAL 36 N 0.36 1.50 -0.76 4.15 2.07 -1.82 -2.47 116.25 119.27 3fnc h VAL 36 Ca 0.09 -2.08 0.13 0.00 0.82 0.00 0.00 66.70 65.66 3fnc h VAL 36 Cb 0.14 2.75 -0.09 0.00 -1.52 0.00 0.00 31.29 32.57 3fnc h VAL 36 CO -0.00 0.59 0.34 1.56 0.02 0.00 0.00 177.57 180.07 3fnc h GLN 37 N -0.32 0.49 -0.13 1.57 4.20 -1.01 -2.16 115.11 117.75 3fnc h GLN 37 Ca -0.06 -0.03 -0.07 0.00 0.06 0.00 0.00 58.65 58.55 3fnc h GLN 37 Cb 1.22 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.88 3fnc h GLN 37 CO 0.09 0.32 -0.24 -0.44 -0.67 0.00 0.00 178.83 177.89 3fnc h ASP 38 N 0.50 0.22 -0.49 1.46 3.32 -0.24 -1.20 116.42 120.00 3fnc h ASP 38 Ca 0.41 -0.06 -0.05 0.00 0.02 0.00 0.00 57.03 57.34 3fnc h ASP 38 Cb 0.59 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.06 3fnc h ASP 38 CO -0.37 0.48 0.10 -0.78 -1.72 0.00 0.00 179.24 176.94 3fnc h ASP 39 N 0.21 0.77 -0.31 6.45 3.58 -0.91 0.19 116.42 126.39 3fnc h ASP 39 Ca 0.03 -0.25 0.00 0.00 0.42 0.00 0.00 57.03 57.24 3fnc h ASP 39 Cb 0.55 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.38 3fnc h ASP 39 CO 0.04 0.82 0.20 0.15 -2.88 0.00 0.00 179.24 177.57 3fnc h PHE 40 N 0.68 0.39 -0.72 0.28 3.57 -1.12 -1.87 116.94 118.15 3fnc h PHE 40 Ca 0.15 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 3fnc h PHE 40 Cb 0.37 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.94 3fnc h PHE 40 CO 0.03 0.25 0.37 -0.07 -2.23 0.00 0.00 178.31 176.65 3fnc h LEU 41 N 0.42 0.90 -0.81 0.59 3.38 -0.97 -1.11 115.31 117.71 3fnc h LEU 41 Ca 0.11 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 3fnc h LEU 41 Cb -0.05 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 3fnc h LEU 41 CO -0.02 0.74 0.29 0.50 0.09 0.00 0.00 178.44 180.04 3fnc h LYS 42 N 1.01 1.17 -0.23 1.13 3.64 -0.45 0.10 116.57 122.94 3fnc h LYS 42 Ca 0.25 -0.22 -0.12 0.00 -1.27 0.00 0.00 60.65 59.28 3fnc h LYS 42 Cb 0.06 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 3fnc h LYS 42 CO -0.04 0.96 -0.34 0.00 -2.27 0.00 0.00 179.45 177.77 3fnc h ARG 43 N 1.14 0.64 0.00 1.90 3.08 -0.73 -3.26 114.38 117.15 3fnc h ARG 43 Ca 0.26 -0.38 0.00 0.00 0.07 0.00 0.00 59.98 59.93 3fnc h ARG 43 Cb 0.25 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.33 3fnc h ARG 43 CO -0.02 0.99 -1.09 1.19 -1.07 0.00 0.00 179.97 179.97 3fnc n PHE 44 N -4.27 0.00 -1.03 3.04 3.72 -0.48 -4.58 117.46 113.86 3fnc n PHE 44 Ca -0.05 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.41 3fnc n PHE 44 Cb 0.50 -0.15 0.08 0.00 -0.94 0.00 0.00 39.48 38.97 3fnc n PHE 44 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3fnc n TYR 45 N -1.62 0.00 -1.48 1.38 4.01 0.34 -4.58 117.16 115.21 3fnc n TYR 45 Ca -0.00 -0.65 -0.32 0.00 -0.16 0.00 0.00 57.90 56.77 3fnc n TYR 45 Cb 0.25 -0.10 0.07 0.00 -0.31 0.00 0.00 39.34 39.25 3fnc n TYR 45 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3fnc s ASN 46 N -1.99 4.82 0.19 7.72 2.20 -1.16 -4.63 114.94 122.10 3fnc s ASN 46 Ca 0.18 1.86 -0.11 0.00 -0.94 0.00 0.00 52.86 53.85 3fnc s ASN 46 Cb 0.16 -2.53 0.11 0.00 -2.00 0.00 0.00 41.25 36.98 3fnc s ASN 46 CO 0.02 -1.82 1.78 0.58 -2.94 0.00 0.00 177.10 174.71 3fnc h VAL 47 N -0.66 1.22 -0.15 3.54 2.07 -1.92 -1.45 116.25 118.90 3fnc h VAL 47 Ca -0.45 -0.63 -0.00 0.00 0.82 0.00 0.00 66.70 66.44 3fnc h VAL 47 Cb 1.23 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3fnc h VAL 47 CO 0.53 0.26 0.09 -0.08 0.02 0.00 0.00 177.57 178.39 3fnc h GLU 48 N 0.92 0.21 -0.90 1.57 4.81 -1.99 0.40 114.58 119.60 3fnc h GLU 48 Ca 0.23 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 3fnc h GLU 48 Cb 0.12 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.41 3fnc h GLU 48 CO -0.03 0.19 0.56 1.15 -0.73 0.00 0.00 179.01 180.15 3fnc h THR 49 N 0.17 1.24 -0.57 0.32 2.02 -1.88 -2.16 112.91 112.05 3fnc h THR 49 Ca 0.05 -0.48 -0.09 0.00 0.77 0.00 0.00 66.41 66.66 3fnc h THR 49 Cb 0.04 -0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.38 3fnc h THR 49 CO -0.01 0.24 -0.00 -0.07 0.37 0.00 0.00 175.52 176.05 3fnc h LEU 50 N 1.23 1.00 -0.57 2.58 3.38 -0.88 -0.33 115.31 121.71 3fnc h LEU 50 Ca 0.32 -0.31 0.08 0.00 0.09 0.00 0.00 57.88 58.07 3fnc h LEU 50 Cb -0.09 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.32 3fnc h LEU 50 CO -0.07 1.06 0.22 0.45 0.09 0.00 0.00 178.44 180.20 3fnc h HIS 51 N 0.90 0.39 -0.39 1.13 3.86 -0.51 0.11 115.15 120.65 3fnc h HIS 51 Ca 0.16 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.38 3fnc h HIS 51 Cb 0.55 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 28.92 3fnc h HIS 51 CO 0.04 0.12 0.17 -0.91 0.86 0.00 0.00 177.93 178.20 3fnc h ASN 52 N 0.41 0.52 -0.58 2.45 2.35 -1.04 -1.36 115.58 118.33 3fnc h ASN 52 Ca 0.28 -0.15 -0.04 0.00 -0.55 0.00 0.00 56.30 55.84 3fnc h ASN 52 Cb 0.32 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 3fnc h ASN 52 CO -0.28 0.53 0.20 0.03 -1.65 0.00 0.00 177.43 176.26 3fnc h ARG 53 N 0.48 0.90 -0.75 0.81 3.08 -0.63 -1.67 114.38 116.60 3fnc h ARG 53 Ca 0.13 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 3fnc h ARG 53 Cb 0.16 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 3fnc h ARG 53 CO -0.01 0.80 0.27 0.82 -1.07 0.00 0.00 179.97 180.77 3fnc h ILE 54 N 0.82 1.26 -0.29 2.04 2.04 -0.69 0.38 117.51 123.06 3fnc h ILE 54 Ca 0.19 -0.85 -0.07 0.00 1.00 0.00 0.00 64.86 65.13 3fnc h ILE 54 Cb 0.26 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 3fnc h ILE 54 CO -0.01 0.34 -0.10 0.28 0.00 0.00 0.00 178.15 178.66 3fnc h SER 55 N 1.10 0.47 0.00 1.72 0.02 -0.96 -3.35 113.55 112.55 3fnc h SER 55 Ca 0.25 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3fnc h SER 55 Cb 0.26 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.67 3fnc h SER 55 CO -0.01 0.62 -1.66 0.00 -1.14 0.00 0.00 176.83 174.64 3fnc n ALA 56 N -2.48 2.83 -2.83 3.77 0.00 -0.65 -5.01 120.51 116.14 3fnc n ALA 56 Ca 0.01 -0.42 -0.09 0.00 0.00 0.00 0.00 53.44 52.94 3fnc n ALA 56 Cb 0.31 -0.59 -0.10 0.00 0.00 0.00 0.00 19.45 19.07 3fnc n ALA 56 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3fnc s THR 57 N -3.11 0.13 -0.06 0.00 -4.23 0.09 -5.07 115.64 103.39 3fnc s THR 57 Ca -0.05 -1.04 -0.29 0.00 -1.18 0.00 0.00 61.69 59.13 3fnc s THR 57 Cb 0.11 -0.58 -0.07 0.00 1.34 0.00 0.00 72.50 73.30 3fnc s THR 57 CO 0.71 -0.57 1.97 -2.84 -0.54 0.00 0.00 174.62 173.34 3fnc s PRO 58 N -2.01 3.87 -0.09 3.99 0.02 -1.25 -4.55 135.00 134.98 3fnc s PRO 58 Ca -0.11 2.35 0.00 0.00 0.02 0.00 0.00 61.00 63.26 3fnc s PRO 58 Cb -0.05 -4.19 0.02 0.00 0.02 0.00 0.00 34.50 30.30 3fnc s PRO 58 CO -0.03 -1.26 -0.07 -0.06 -0.33 0.00 0.00 177.00 175.26 3fnc s PHE 59 N 5.42 1.27 0.06 6.54 0.08 -1.26 -1.39 117.98 128.70 3fnc s PHE 59 Ca 0.88 -0.56 0.07 0.00 0.12 0.00 0.00 56.93 57.45 3fnc s PHE 59 Cb -0.38 -1.07 -0.03 0.00 -0.57 0.00 0.00 43.02 40.96 3fnc s PHE 59 CO 0.38 -0.41 -0.17 0.00 -0.10 0.00 0.00 175.22 174.92 3fnc s ALA 60 N 1.48 2.66 0.15 5.36 0.00 0.04 -0.67 121.76 130.78 3fnc s ALA 60 Ca -0.00 -1.21 0.10 0.00 0.00 0.00 0.00 51.96 50.85 3fnc s ALA 60 Cb -0.13 -0.76 -0.04 0.00 0.00 0.00 0.00 23.12 22.19 3fnc s ALA 60 CO -0.05 0.58 -0.24 0.14 0.00 0.00 0.00 175.76 176.20 3fnc s VAL 61 N -0.99 2.15 -0.20 0.00 -7.23 0.45 -0.81 120.40 113.77 3fnc s VAL 61 Ca 0.16 -1.82 -0.06 0.00 -1.81 0.00 0.00 61.98 58.44 3fnc s VAL 61 Cb -0.11 -1.95 -0.03 0.00 0.56 0.00 0.00 36.38 34.85 3fnc s VAL 61 CO 0.07 -0.04 0.04 -0.22 -0.31 0.00 0.00 175.10 174.64 3fnc s LEU 62 N -2.29 3.54 -0.04 1.32 2.96 -0.04 -1.89 118.68 122.25 3fnc s LEU 62 Ca 0.15 -0.07 0.04 0.00 -0.22 0.00 0.00 54.13 54.03 3fnc s LEU 62 Cb -0.09 -1.90 -0.00 0.00 0.50 0.00 0.00 46.19 44.70 3fnc s LEU 62 CO 0.07 0.10 -0.15 -0.70 -1.32 0.00 0.00 176.35 174.36 3fnc s GLU 63 N 0.78 1.55 -0.13 1.98 2.12 -0.06 -0.83 118.70 124.11 3fnc s GLU 63 Ca 0.02 -0.52 -0.16 0.00 0.36 0.00 0.00 54.97 54.68 3fnc s GLU 63 Cb -0.14 -1.37 0.04 0.00 0.26 0.00 0.00 34.13 32.92 3fnc s GLU 63 CO 0.02 0.20 0.42 -1.14 -0.54 0.00 0.00 175.26 174.22 3fnc s GLN 64 N 0.10 0.55 -1.56 4.30 0.74 -0.34 -0.88 119.66 122.58 3fnc s GLN 64 Ca -0.04 0.46 -0.15 0.00 0.05 0.00 0.00 55.36 55.68 3fnc s GLN 64 Cb -0.11 0.26 0.11 0.00 1.10 0.00 0.00 33.01 34.37 3fnc s GLN 64 CO 0.02 -0.09 0.86 0.00 -0.55 0.00 0.00 175.29 175.52 3fnc n ALA 65 N 2.51 -1.23 -1.36 1.58 0.00 -1.26 -1.62 120.51 119.13 3fnc n ALA 65 Ca -0.15 0.12 -0.12 0.00 0.00 0.00 0.00 53.44 53.29 3fnc n ALA 65 Cb 0.57 -3.97 -0.05 0.00 0.00 0.00 0.00 19.45 15.99 3fnc n ALA 65 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3fnc n ASP 66 N -2.69 -4.76 -4.09 0.00 2.03 -1.26 -5.00 116.55 100.78 3fnc n ASP 66 Ca 0.05 0.31 -0.24 0.00 0.52 0.00 0.00 54.79 55.42 3fnc n ASP 66 Cb 0.52 -3.36 -0.16 0.00 -0.72 0.00 0.00 41.12 37.40 3fnc n ASP 66 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 3fnc s LYS 67 N -2.97 1.47 -0.03 -0.67 2.20 -0.64 -5.09 119.74 114.01 3fnc s LYS 67 Ca 0.00 -0.50 -0.30 0.00 -0.36 0.00 0.00 55.97 54.81 3fnc s LYS 67 Cb 0.00 -1.31 -0.05 0.00 -1.51 0.00 0.00 37.83 34.96 3fnc s LYS 67 CO 0.00 0.20 1.55 0.08 -0.36 0.00 0.00 175.35 176.82 3fnc s VAL 68 N 0.09 3.60 0.00 4.02 1.01 -1.26 -1.20 120.40 126.66 3fnc s VAL 68 Ca -0.03 0.85 0.00 0.00 0.00 0.00 0.00 61.98 62.80 3fnc s VAL 68 Cb -0.10 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.73 3fnc s VAL 68 CO 0.01 -0.05 0.49 2.30 0.00 0.00 0.00 175.10 177.86 3fnc n ILE 69 N 5.16 0.00 -3.51 2.22 -5.35 -0.01 -4.89 119.36 112.99 3fnc n ILE 69 Ca 0.16 -0.50 -0.09 0.00 -0.27 0.00 0.00 62.75 62.05 3fnc n ILE 69 Cb 0.43 1.00 -0.02 0.00 -1.74 0.00 0.00 39.64 39.31 3fnc n ILE 69 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3fnc s GLY 70 N -0.01 -0.47 0.15 3.28 0.00 -1.18 -1.09 107.32 108.01 3fnc s GLY 70 Ca 0.00 0.92 -0.17 0.00 0.00 0.00 0.00 44.72 45.47 3fnc s GLY 70 CO 0.00 0.30 0.47 -0.11 0.00 0.00 0.00 173.10 173.76 3fnc s PHE 71 N -3.19 -0.21 -0.01 1.90 -0.71 -0.33 -0.86 117.98 114.58 3fnc s PHE 71 Ca 0.05 -0.11 -0.01 0.00 -1.04 0.00 0.00 56.93 55.83 3fnc s PHE 71 Cb -0.01 0.34 0.00 0.00 -1.21 0.00 0.00 43.02 42.14 3fnc s PHE 71 CO -0.09 -0.80 0.02 0.00 -1.34 0.00 0.00 175.22 173.01 3fnc s ALA 72 N -3.82 -0.04 -0.11 1.99 0.00 0.01 -1.65 121.76 118.13 3fnc s ALA 72 Ca 0.05 0.03 0.02 0.00 0.00 0.00 0.00 51.96 52.06 3fnc s ALA 72 Cb 0.01 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.11 3fnc s ALA 72 CO -0.09 -0.01 -0.16 1.21 0.00 0.00 0.00 175.76 176.71 3fnc s ASN 73 N -0.04 2.52 -0.13 0.00 3.04 -0.08 -0.78 114.94 119.48 3fnc s ASN 73 Ca -0.01 -0.45 -0.02 0.00 0.04 0.00 0.00 52.86 52.42 3fnc s ASN 73 Cb -0.00 -1.14 -0.03 0.00 -1.54 0.00 0.00 41.25 38.54 3fnc s ASN 73 CO 0.00 0.03 -0.06 -0.36 -3.04 0.00 0.00 177.10 173.67 3fnc s PHE 74 N 0.94 2.97 0.14 0.43 0.08 -0.49 -0.89 117.98 121.18 3fnc s PHE 74 Ca -0.07 -0.27 0.08 0.00 0.12 0.00 0.00 56.93 56.79 3fnc s PHE 74 Cb -0.15 -1.88 -0.04 0.00 -0.57 0.00 0.00 43.02 40.38 3fnc s PHE 74 CO -0.01 0.03 -0.18 0.96 -0.10 0.00 0.00 175.22 175.92 3fnc s ILE 75 N 0.07 1.68 0.24 0.64 -4.36 0.08 -3.80 121.20 115.75 3fnc s ILE 75 Ca -0.01 -1.79 -0.30 0.00 -0.26 0.00 0.00 60.65 58.29 3fnc s ILE 75 Cb -0.14 -1.71 -0.09 0.00 1.25 0.00 0.00 42.46 41.78 3fnc s ILE 75 CO 0.03 -0.28 1.00 -1.61 0.24 0.00 0.00 174.94 174.32 3fnc s GLU 76 N -2.56 4.77 0.32 0.37 8.01 -1.26 -0.67 118.70 127.68 3fnc s GLU 76 Ca 0.12 1.59 0.10 0.00 0.01 0.00 0.00 54.97 56.79 3fnc s GLU 76 Cb -0.07 -3.26 -0.05 0.00 -4.31 0.00 0.00 34.13 26.44 3fnc s GLU 76 CO 0.05 0.39 -0.04 -0.51 0.01 0.00 0.00 175.26 175.16 3fnc s LEU 77 N -1.13 2.92 0.80 1.80 1.43 0.18 -4.81 118.68 119.86 3fnc s LEU 77 Ca 0.43 -0.95 -0.13 0.00 -1.03 0.00 0.00 54.13 52.44 3fnc s LEU 77 Cb -0.28 -1.34 0.08 0.00 0.03 0.00 0.00 46.19 44.68 3fnc s LEU 77 CO 0.35 -0.14 1.21 -1.83 0.23 0.00 0.00 176.35 176.16 3fnc s GLU 78 N -3.66 1.70 -0.98 1.70 -1.05 -1.26 -3.55 118.70 111.60 3fnc s GLU 78 Ca 0.33 1.76 -0.03 0.00 -0.15 0.00 0.00 54.97 56.89 3fnc s GLU 78 Cb -0.02 -1.78 0.00 0.00 -0.44 0.00 0.00 34.13 31.89 3fnc s GLU 78 CO 0.18 -2.17 0.34 1.63 0.95 0.00 0.00 175.26 176.20 3fnc n LYS 79 N -3.22 -2.85 -1.71 -4.83 4.76 -1.26 -2.96 118.16 106.09 3fnc n LYS 79 Ca 0.13 0.57 -0.06 0.00 -2.87 0.00 0.00 58.31 56.09 3fnc n LYS 79 Cb 0.50 -4.73 -0.01 0.00 -1.84 0.00 0.00 35.03 28.95 3fnc n LYS 79 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3fnc n GLY 80 N -1.21 0.43 3.74 0.72 0.00 -1.26 -5.00 105.19 102.62 3fnc n GLY 80 Ca -0.08 -0.70 -0.26 0.00 0.00 0.00 0.00 46.02 44.98 3fnc n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fnc s LYS 81 N -3.52 2.68 0.16 1.61 1.02 -1.16 -4.04 119.74 116.49 3fnc s LYS 81 Ca 0.00 -1.01 0.07 0.00 0.02 0.00 0.00 55.97 55.05 3fnc s LYS 81 Cb 0.00 -2.50 -0.04 0.00 -0.52 0.00 0.00 37.83 34.77 3fnc s LYS 81 CO 0.00 0.46 -0.14 -1.12 -0.92 0.00 0.00 175.35 173.63 3fnc s SER 82 N -3.14 2.26 -0.05 2.83 0.01 0.20 -0.65 113.70 115.15 3fnc s SER 82 Ca 0.30 -0.94 0.04 0.00 1.31 0.00 0.00 55.95 56.65 3fnc s SER 82 Cb -0.09 -0.09 -0.00 0.00 0.21 0.00 0.00 66.02 66.04 3fnc s SER 82 CO 0.21 -0.18 -0.16 -0.70 0.41 0.00 0.00 173.24 172.82 3fnc s GLU 83 N -3.31 1.81 -1.00 12.44 2.12 0.16 -0.36 118.70 130.56 3fnc s GLU 83 Ca 0.17 -0.58 -0.22 0.00 0.36 0.00 0.00 54.97 54.70 3fnc s GLU 83 Cb -0.02 -1.54 0.08 0.00 0.26 0.00 0.00 34.13 32.91 3fnc s GLU 83 CO 0.04 0.20 1.36 -1.17 -0.54 0.00 0.00 175.26 175.15 3fnc s LEU 84 N 0.16 3.98 0.29 2.70 2.96 0.42 -0.74 118.68 128.45 3fnc s LEU 84 Ca -0.06 -1.66 0.12 0.00 -0.22 0.00 0.00 54.13 52.30 3fnc s LEU 84 Cb -0.12 -2.52 0.43 0.00 0.50 0.00 0.00 46.19 44.48 3fnc s LEU 84 CO 0.03 -1.36 1.65 0.00 -1.32 0.00 0.00 176.35 175.34 3fnc h ALA 85 N 9.45 1.03 -2.96 5.97 0.00 -1.31 -3.42 119.26 128.02 3fnc h ALA 85 Ca 0.19 -0.51 -0.16 0.00 0.00 0.00 0.00 54.91 54.43 3fnc h ALA 85 Cb 1.01 -0.09 -0.27 0.00 0.00 0.00 0.00 17.79 18.44 3fnc h ALA 85 CO 1.33 0.71 -0.39 0.00 0.00 0.00 0.00 179.25 180.90 3fnc s ALA 86 N -3.67 -0.74 -0.26 0.00 0.00 -1.11 -4.96 121.76 111.02 3fnc s ALA 86 Ca -0.01 1.00 -0.01 0.00 0.00 0.00 0.00 51.96 52.93 3fnc s ALA 86 Cb 0.13 -0.60 0.14 0.00 0.00 0.00 0.00 23.12 22.78 3fnc s ALA 86 CO 0.75 -0.18 0.36 0.12 0.00 0.00 0.00 175.76 176.81 3fnc s PHE 87 N 0.67 -0.77 -0.02 0.00 5.36 -1.26 -0.90 117.98 121.06 3fnc s PHE 87 Ca -0.04 0.48 0.02 0.00 -0.96 0.00 0.00 56.93 56.43 3fnc s PHE 87 Cb -0.05 -0.14 0.00 0.00 -0.34 0.00 0.00 43.02 42.49 3fnc s PHE 87 CO -0.04 -0.82 -0.07 0.71 -1.46 0.00 0.00 175.22 173.54 3fnc s TYR 88 N 2.50 0.77 0.07 10.12 2.02 -0.66 -5.02 117.35 127.15 3fnc s TYR 88 Ca 0.11 -0.18 0.09 0.00 -0.37 0.00 0.00 57.07 56.72 3fnc s TYR 88 Cb -0.14 -0.57 -0.03 0.00 -0.40 0.00 0.00 41.96 40.82 3fnc s TYR 88 CO -0.22 -0.09 -0.24 -0.51 -1.57 0.00 0.00 175.55 172.93 3fnc s LEU 89 N 0.23 2.36 0.39 -1.29 1.43 -1.26 -1.19 118.68 119.35 3fnc s LEU 89 Ca -0.03 -0.58 -0.26 0.00 -1.03 0.00 0.00 54.13 52.23 3fnc s LEU 89 Cb -0.08 -1.36 -0.11 0.00 0.03 0.00 0.00 46.19 44.68 3fnc s LEU 89 CO 0.00 0.23 1.26 0.18 0.23 0.00 0.00 176.35 178.25 3fnc n LEU 90 N 1.43 3.75 -0.18 1.79 4.77 -0.25 -4.77 117.00 123.55 3fnc n LEU 90 Ca -0.17 1.14 0.26 0.00 -0.03 0.00 0.00 56.01 57.21 3fnc n LEU 90 Cb 0.52 -1.48 0.68 0.00 -2.33 0.00 0.00 43.42 40.81 3fnc n LEU 90 CO 0.24 -0.64 1.25 -0.65 -1.33 0.00 0.00 177.39 176.26 3fnc h PRO 91 N 2.23 0.07 0.00 3.23 0.11 -1.92 -1.70 132.00 134.03 3fnc h PRO 91 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3fnc h PRO 91 Cb 1.29 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3fnc h PRO 91 CO 0.61 0.05 0.00 0.39 -0.21 0.00 0.00 178.00 178.84 3fnc n GLU 92 N -4.33 0.14 -0.03 1.05 4.71 -1.26 -3.48 120.64 117.44 3fnc n GLU 92 Ca 0.18 0.30 0.03 0.00 -0.01 0.00 0.00 57.16 57.67 3fnc n GLU 92 Cb 0.88 -1.74 0.04 0.00 -1.01 0.00 0.00 31.44 29.62 3fnc n GLU 92 CO 0.00 0.00 0.00 1.33 0.09 0.00 0.00 177.13 178.55 3fnc n VAL 93 N -2.00 1.22 -1.86 2.62 0.24 -0.64 -5.01 118.33 112.90 3fnc n VAL 93 Ca 0.04 -1.34 -0.31 0.00 -2.04 0.00 0.00 64.34 60.69 3fnc n VAL 93 Cb 0.26 0.29 0.03 0.00 -1.47 0.00 0.00 33.84 32.95 3fnc n VAL 93 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3fnc s THR 94 N -1.53 4.21 -1.20 3.34 -4.23 -1.23 -4.20 115.64 110.80 3fnc s THR 94 Ca 0.10 0.72 0.00 0.00 -1.18 0.00 0.00 61.69 61.33 3fnc s THR 94 Cb 0.09 -3.70 0.00 0.00 1.34 0.00 0.00 72.50 70.23 3fnc s THR 94 CO 0.01 -0.94 0.00 0.00 -0.54 0.00 0.00 174.62 173.15 3fnc n GLN 95 N -2.87 -0.80 -0.13 3.99 1.13 -1.26 -4.87 117.38 112.57 3fnc n GLN 95 Ca 0.06 0.88 0.07 0.00 -1.94 0.00 0.00 57.00 56.07 3fnc n GLN 95 Cb 0.55 -4.87 0.10 0.00 0.11 0.00 0.00 30.24 26.12 3fnc n GLN 95 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3fnc n ARG 96 N -2.63 1.25 -0.95 -1.09 3.00 -1.26 -4.98 116.66 109.99 3fnc n ARG 96 Ca -0.12 -2.13 0.00 0.00 -0.01 0.00 0.00 57.85 55.59 3fnc n ARG 96 Cb 0.39 -1.25 0.00 0.00 0.00 0.00 0.00 32.46 31.60 3fnc n ARG 96 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3fnc n GLY 97 N -1.05 1.09 0.10 -0.13 0.00 -1.26 -4.90 105.19 99.03 3fnc n GLY 97 Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.10 3fnc n GLY 97 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3fnc h LEU 98 N 0.00 0.00 -0.58 0.99 3.38 -1.94 -3.16 115.31 114.00 3fnc h LEU 98 Ca 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 3fnc h LEU 98 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3fnc h LEU 98 CO 0.00 0.79 -0.40 1.23 0.09 0.00 0.00 178.44 180.15 3fnc h GLY 99 N 2.79 0.75 0.74 0.83 0.00 -1.90 -1.04 103.07 105.23 3fnc h GLY 99 Ca -0.01 -0.76 0.04 0.00 0.00 0.00 0.00 47.33 46.61 3fnc h GLY 99 CO 0.10 0.68 0.31 -0.84 0.00 0.00 0.00 176.54 176.80 3fnc h THR 100 N 0.56 0.98 -0.14 4.70 2.02 -1.98 -1.11 112.91 117.94 3fnc h THR 100 Ca 0.05 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 3fnc h THR 100 Cb 0.94 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 3fnc h THR 100 CO 0.08 0.11 0.00 -0.33 0.37 0.00 0.00 175.52 175.76 3fnc h GLU 101 N 0.60 0.25 -0.40 6.66 4.39 -1.47 -0.44 114.58 124.17 3fnc h GLU 101 Ca 0.25 -0.08 0.07 0.00 0.34 0.00 0.00 59.36 59.94 3fnc h GLU 101 Cb 0.12 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.69 3fnc h GLU 101 CO -0.15 0.47 0.05 1.25 -1.16 0.00 0.00 179.01 179.47 3fnc h LEU 102 N -0.01 -0.06 0.22 1.33 5.85 -1.01 0.84 115.31 122.47 3fnc h LEU 102 Ca 0.04 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3fnc h LEU 102 Cb 0.36 0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.51 3fnc h LEU 102 CO 0.01 0.01 -0.11 0.25 -0.34 0.00 0.00 178.44 178.26 3fnc h LEU 103 N 0.17 -0.25 -0.26 2.25 5.85 -1.14 0.28 115.31 122.20 3fnc h LEU 103 Ca 0.19 -0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.70 3fnc h LEU 103 Cb 0.25 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.34 3fnc h LEU 103 CO -0.28 -0.06 -0.28 -0.33 -0.34 0.00 0.00 178.44 177.16 3fnc h GLU 104 N -0.44 0.65 -0.03 1.25 5.08 -0.87 -3.18 114.58 117.04 3fnc h GLU 104 Ca -0.03 -0.35 -0.24 0.00 -1.00 0.00 0.00 59.36 57.74 3fnc h GLU 104 Cb 0.34 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.61 3fnc h GLU 104 CO 0.05 0.96 -0.93 0.28 -1.00 0.00 0.00 179.01 178.37 3fnc h VAL 105 N 0.38 1.34 0.00 3.13 2.07 -0.92 -2.73 116.25 119.50 3fnc h VAL 105 Ca 0.04 -2.27 0.00 0.00 0.82 0.00 0.00 66.70 65.29 3fnc h VAL 105 Cb 0.85 2.30 0.00 0.00 -1.52 0.00 0.00 31.29 32.92 3fnc h VAL 105 CO 0.07 0.69 0.00 0.61 0.02 0.00 0.00 177.57 178.96 3fnc n GLY 106 N 0.91 0.00 2.11 2.17 0.00 0.09 -1.22 105.19 109.25 3fnc n GLY 106 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3fnc n GLY 106 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3fnc n THR 108 N 0.56 0.00 -0.06 2.61 -1.04 -1.03 -2.72 114.28 112.60 3fnc n THR 108 Ca 0.00 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.14 3fnc n THR 108 Cb 0.00 0.00 0.54 0.00 -1.82 0.00 0.00 70.33 69.05 3fnc n THR 108 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3fnc h LEU 109 N 0.00 0.30 -2.94 -4.42 3.38 -1.47 -2.68 115.31 107.48 3fnc h LEU 109 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3fnc h LEU 109 Cb 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3fnc h LEU 109 CO 0.00 0.18 0.00 0.49 0.09 0.00 0.00 178.44 179.20 3fnc n PHE 110 N -4.46 0.37 -3.44 1.13 3.72 -1.10 -4.98 117.46 108.69 3fnc n PHE 110 Ca 0.10 -0.53 -0.25 0.00 -0.05 0.00 0.00 57.45 56.72 3fnc n PHE 110 Cb 0.41 -0.05 0.05 0.00 -0.94 0.00 0.00 39.48 38.95 3fnc n PHE 110 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 3fnc n HIS 111 N 0.16 -2.37 -2.31 1.38 8.25 -1.01 -4.91 115.22 114.41 3fnc n HIS 111 Ca 0.09 0.78 -0.42 0.00 -0.26 0.00 0.00 57.72 57.91 3fnc n HIS 111 Cb 0.41 -4.47 -0.03 0.00 1.12 0.00 0.00 29.99 27.02 3fnc n HIS 111 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3fnc s VAL 112 N -3.23 4.02 0.44 1.59 1.01 -1.26 -5.01 120.40 117.95 3fnc s VAL 112 Ca 0.49 1.30 -0.13 0.00 0.00 0.00 0.00 61.98 63.64 3fnc s VAL 112 Cb -0.23 -3.84 -0.07 0.00 0.00 0.00 0.00 36.38 32.25 3fnc s VAL 112 CO 0.61 -0.07 0.84 -2.16 0.00 0.00 0.00 175.10 174.32 3fnc s PRO 113 N 3.09 3.84 0.36 2.72 0.04 -1.26 -4.89 135.00 138.91 3fnc s PRO 113 Ca 0.60 0.64 -0.10 0.00 0.04 0.00 0.00 61.00 62.18 3fnc s PRO 113 Cb -0.27 -2.30 -0.07 0.00 0.04 0.00 0.00 34.50 31.90 3fnc s PRO 113 CO 0.21 -0.11 0.72 -0.51 0.04 0.00 0.00 177.00 177.35 3fnc s LEU 114 N -3.91 3.92 0.00 -3.56 1.43 -1.26 -4.17 118.68 111.14 3fnc s LEU 114 Ca 0.54 1.09 0.00 0.00 -1.03 0.00 0.00 54.13 54.73 3fnc s LEU 114 Cb -0.10 -3.94 0.00 0.00 0.03 0.00 0.00 46.19 42.18 3fnc s LEU 114 CO 0.31 -0.32 0.00 -0.81 0.23 0.00 0.00 176.35 175.76 3fnc n PRO 115 N -1.01 1.40 -3.49 1.29 -0.04 -1.26 -4.72 135.00 127.17 3fnc n PRO 115 Ca 0.02 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.33 3fnc n PRO 115 Cb 0.54 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.95 3fnc n PRO 115 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3fnc s PHE 117 N 0.00 -0.57 -0.10 0.54 0.40 0.51 -0.63 117.98 118.13 3fnc s PHE 117 Ca 0.00 0.76 -0.11 0.00 -0.60 0.00 0.00 56.93 56.98 3fnc s PHE 117 Cb 0.00 0.47 0.03 0.00 0.51 0.00 0.00 43.02 44.03 3fnc s PHE 117 CO 0.00 -0.65 0.31 0.54 0.70 0.00 0.00 175.22 176.11 3fnc s VAL 118 N -2.13 0.01 -0.15 -0.44 0.11 -0.30 -0.43 120.40 117.06 3fnc s VAL 118 Ca -0.05 -0.06 -0.08 0.00 -2.93 0.00 0.00 61.98 58.86 3fnc s VAL 118 Cb -0.00 -0.45 -0.04 0.00 -1.53 0.00 0.00 36.38 34.35 3fnc s VAL 118 CO 0.01 -0.03 0.12 0.20 -3.33 0.00 0.00 175.10 172.06 3fnc s ASN 119 N -0.01 6.20 -0.01 3.54 0.01 -1.26 -1.06 114.94 122.35 3fnc s ASN 119 Ca -0.02 0.34 0.02 0.00 -0.71 0.00 0.00 52.86 52.49 3fnc s ASN 119 Cb -0.03 -2.04 -0.00 0.00 0.41 0.00 0.00 41.25 39.60 3fnc s ASN 119 CO 0.01 0.31 -0.08 -0.69 -1.51 0.00 0.00 177.10 175.14 3fnc s VAL 120 N -0.42 0.65 0.25 1.60 1.01 0.33 -4.97 120.40 118.85 3fnc s VAL 120 Ca 0.11 -0.33 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 3fnc s VAL 120 Cb -0.12 -0.56 -0.10 0.00 0.00 0.00 0.00 36.38 35.61 3fnc s VAL 120 CO 0.01 0.19 1.35 -0.70 0.00 0.00 0.00 175.10 175.95 3fnc s GLU 121 N -0.06 4.35 0.53 2.72 -6.30 -1.26 -0.50 118.70 118.18 3fnc s GLU 121 Ca 0.01 2.17 0.20 0.00 -2.50 0.00 0.00 54.97 54.86 3fnc s GLU 121 Cb -0.05 -3.13 1.37 0.00 0.00 0.00 0.00 34.13 32.32 3fnc s GLU 121 CO -0.00 -0.27 2.11 -0.22 0.02 0.00 0.00 175.26 176.90 3fnc h LYS 122 N 4.66 0.00 -0.42 4.30 3.64 -1.18 -1.91 116.57 125.66 3fnc h LYS 122 Ca -0.46 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 3fnc h LYS 122 Cb 1.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 3fnc h LYS 122 CO 0.74 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 178.33 3fnc n GLY 123 N -1.54 1.40 3.44 5.01 0.00 -1.26 -4.67 105.19 107.56 3fnc n GLY 123 Ca 0.01 -0.62 -0.44 0.00 0.00 0.00 0.00 46.02 44.97 3fnc n GLY 123 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3fnc n ASN 124 N 1.11 5.21 -0.15 1.61 2.85 -0.72 -4.81 115.26 120.36 3fnc n ASN 124 Ca 0.19 -2.98 0.01 0.00 -0.11 0.00 0.00 54.58 51.69 3fnc n ASN 124 Cb 0.50 -1.57 0.30 0.00 1.24 0.00 0.00 39.78 40.24 3fnc n ASN 124 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 3fnc h GLU 125 N 7.06 0.84 -0.20 1.20 4.81 -1.86 -0.57 114.58 125.86 3fnc h GLU 125 Ca 0.33 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.49 3fnc h GLU 125 Cb 0.86 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 3fnc h GLU 125 CO 1.27 0.57 0.10 1.15 -0.73 0.00 0.00 179.01 181.38 3fnc h THR 126 N 0.87 1.12 -0.34 0.32 2.02 -1.99 0.30 112.91 115.21 3fnc h THR 126 Ca 0.23 -0.33 -0.11 0.00 0.77 0.00 0.00 66.41 66.97 3fnc h THR 126 Cb -0.08 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 3fnc h THR 126 CO -0.05 0.12 -0.20 0.00 0.37 0.00 0.00 175.52 175.75 3fnc h ALA 127 N 0.98 0.48 -0.19 6.16 0.00 -1.79 -2.11 119.26 122.80 3fnc h ALA 127 Ca 0.07 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.63 3fnc h ALA 127 Cb 0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3fnc h ALA 127 CO -0.01 0.43 0.07 0.82 0.00 0.00 0.00 179.25 180.56 3fnc h ILE 128 N 0.51 0.96 -0.75 0.00 2.04 -1.05 -0.22 117.51 118.99 3fnc h ILE 128 Ca 0.07 -0.05 0.06 0.00 1.00 0.00 0.00 64.86 65.94 3fnc h ILE 128 Cb 0.75 0.79 -0.06 0.00 -0.74 0.00 0.00 36.82 37.56 3fnc h ILE 128 CO 0.06 0.03 0.44 -0.74 0.00 0.00 0.00 178.15 177.94 3fnc h HIS 129 N 0.16 0.82 0.30 1.37 2.76 -0.93 -0.80 115.15 118.83 3fnc h HIS 129 Ca 0.08 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.26 3fnc h HIS 129 Cb 0.05 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 28.75 3fnc h HIS 129 CO -0.11 0.40 -0.14 0.35 -1.30 0.00 0.00 177.93 177.12 3fnc h PHE 130 N 0.81 -0.37 -0.51 5.26 3.57 -0.77 -0.18 116.94 124.75 3fnc h PHE 130 Ca 0.34 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.81 3fnc h PHE 130 Cb 0.19 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 3fnc h PHE 130 CO -0.06 -0.23 0.24 1.88 -2.23 0.00 0.00 178.31 177.92 3fnc h TYR 131 N -0.41 0.73 -0.97 0.41 0.05 -0.81 -1.98 116.97 113.99 3fnc h TYR 131 Ca -0.04 -0.04 0.01 0.00 0.05 0.00 0.00 58.73 58.71 3fnc h TYR 131 Cb 0.31 -0.23 -0.05 0.00 1.01 0.00 0.00 36.73 37.78 3fnc h TYR 131 CO -0.06 0.57 0.62 0.87 -1.05 0.00 0.00 178.16 179.12 3fnc h LYS 132 N 0.67 1.28 -0.34 4.88 1.57 -1.10 -1.07 116.57 122.46 3fnc h LYS 132 Ca 0.17 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 3fnc h LYS 132 Cb 0.12 -0.28 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 3fnc h LYS 132 CO -0.02 0.86 0.10 0.00 -0.57 0.00 0.00 179.45 179.83 3fnc h ALA 133 N 1.34 1.54 -0.01 3.86 0.00 -0.66 -1.41 119.26 123.93 3fnc h ALA 133 Ca 0.35 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3fnc h ALA 133 Cb -0.13 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.52 3fnc h ALA 133 CO -0.07 0.35 0.00 1.63 0.00 0.00 0.00 179.25 181.16 3fnc n LYS 134 N -4.37 1.17 -0.34 0.00 4.76 -0.78 -4.91 118.16 113.70 3fnc n LYS 134 Ca 0.02 -0.24 0.00 0.00 -2.87 0.00 0.00 58.31 55.21 3fnc n LYS 134 Cb 0.16 -1.46 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 3fnc n LYS 134 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3fnc n GLY 135 N 1.01 0.83 3.76 0.72 0.00 -0.53 -5.05 105.19 105.93 3fnc n GLY 135 Ca 0.21 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3fnc n GLY 135 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fnc s PHE 136 N -2.00 2.53 -0.04 1.61 0.40 -0.47 -4.79 117.98 115.23 3fnc s PHE 136 Ca 0.00 1.48 0.03 0.00 -0.60 0.00 0.00 56.93 57.84 3fnc s PHE 136 Cb 0.00 -3.54 0.00 0.00 0.51 0.00 0.00 43.02 39.99 3fnc s PHE 136 CO 0.00 -2.17 -0.13 0.08 0.70 0.00 0.00 175.22 173.70 3fnc s VAL 137 N -1.49 1.15 0.18 -0.44 1.01 -0.05 -4.45 120.40 116.31 3fnc s VAL 137 Ca 0.71 -0.54 -0.31 0.00 0.00 0.00 0.00 61.98 61.84 3fnc s VAL 137 Cb -0.33 -1.01 -0.09 0.00 0.00 0.00 0.00 36.38 34.96 3fnc s VAL 137 CO 0.38 0.34 1.39 -1.58 0.00 0.00 0.00 175.10 175.63 3fnc s GLN 138 N 0.24 4.32 0.00 2.72 0.74 -1.26 -1.10 119.66 125.32 3fnc s GLN 138 Ca -0.06 2.15 0.00 0.00 0.05 0.00 0.00 55.36 57.50 3fnc s GLN 138 Cb -0.12 -3.18 0.00 0.00 1.10 0.00 0.00 33.01 30.81 3fnc s GLN 138 CO 0.02 -0.38 0.00 1.33 -0.55 0.00 0.00 175.29 175.71 3fnc n VAL 139 N 3.06 0.00 -3.90 1.34 0.24 0.57 -4.91 118.33 114.73 3fnc n VAL 139 Ca 0.09 -0.03 -0.09 0.00 -2.04 0.00 0.00 64.34 62.27 3fnc n VAL 139 Cb 0.42 0.45 -0.08 0.00 -1.47 0.00 0.00 33.84 33.16 3fnc n VAL 139 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3fnc s GLU 140 N -1.60 0.88 -0.05 7.34 2.12 -0.98 -5.02 118.70 121.39 3fnc s GLU 140 Ca 0.00 -1.03 -0.03 0.00 0.36 0.00 0.00 54.97 54.27 3fnc s GLU 140 Cb 0.00 0.33 0.02 0.00 0.26 0.00 0.00 34.13 34.75 3fnc s GLU 140 CO 0.00 -0.28 0.12 -2.00 -0.54 0.00 0.00 175.26 172.56 3fnc s GLU 141 N -3.89 0.10 0.16 4.30 2.12 -1.26 -1.17 118.70 119.05 3fnc s GLU 141 Ca 0.08 0.24 -0.23 0.00 0.36 0.00 0.00 54.97 55.42 3fnc s GLU 141 Cb 0.05 -0.06 0.07 0.00 0.26 0.00 0.00 34.13 34.45 3fnc s GLU 141 CO -0.09 -0.09 0.59 -0.59 -0.54 0.00 0.00 175.26 174.55 3fnc s PHE 142 N 0.58 -0.52 -0.26 5.30 -0.71 -0.54 -5.01 117.98 116.81 3fnc s PHE 142 Ca -0.04 0.31 -0.10 0.00 -1.04 0.00 0.00 56.93 56.06 3fnc s PHE 142 Cb -0.06 0.55 -0.04 0.00 -1.21 0.00 0.00 43.02 42.26 3fnc s PHE 142 CO -0.03 -0.85 0.14 0.99 -1.34 0.00 0.00 175.22 174.14 3fnc s THR 143 N -3.75 4.98 0.15 -4.49 2.01 -1.26 -0.45 115.64 112.82 3fnc s THR 143 Ca 0.01 0.05 -0.24 0.00 0.31 0.00 0.00 61.69 61.83 3fnc s THR 143 Cb -0.01 -3.34 -0.08 0.00 0.01 0.00 0.00 72.50 69.08 3fnc s THR 143 CO -0.13 0.31 0.74 -0.70 -0.69 0.00 0.00 174.62 174.14 3fnc s GLU 144 N 1.52 4.49 -0.37 4.92 2.12 0.67 -4.89 118.70 127.15 3fnc s GLU 144 Ca 0.07 1.07 -0.19 0.00 0.36 0.00 0.00 54.97 56.27 3fnc s GLU 144 Cb -0.15 -3.23 0.00 0.00 0.26 0.00 0.00 34.13 31.01 3fnc s GLU 144 CO 0.07 0.57 0.56 0.34 -0.54 0.00 0.00 175.26 176.27 3fnc s ASP 145 N -1.17 6.33 -0.45 -1.70 -1.08 -1.26 -0.71 116.67 116.63 3fnc s ASP 145 Ca 0.35 -0.09 -0.02 0.00 -0.52 0.00 0.00 52.55 52.27 3fnc s ASP 145 Cb -0.22 -2.29 0.12 0.00 -1.46 0.00 0.00 42.92 39.07 3fnc s ASP 145 CO 0.25 -0.57 0.24 0.12 0.52 0.00 0.00 175.17 175.73 3fnc s PHE 146 N 2.53 3.55 -1.39 -5.34 5.36 0.90 -4.64 117.98 118.95 3fnc s PHE 146 Ca 0.20 -2.56 -0.12 0.00 -0.96 0.00 0.00 56.93 53.49 3fnc s PHE 146 Cb -0.15 -3.18 0.09 0.00 -0.34 0.00 0.00 43.02 39.44 3fnc s PHE 146 CO 0.15 -0.94 0.59 0.66 -1.46 0.00 0.00 175.22 174.22 3fnc n TYR 147 N 4.28 -1.82 -0.19 10.12 4.02 -1.26 -0.96 117.16 131.35 3fnc n TYR 147 Ca 0.01 0.57 0.00 0.00 -0.01 0.00 0.00 57.90 58.47 3fnc n TYR 147 Cb 0.40 -2.99 0.00 0.00 -0.02 0.00 0.00 39.34 36.73 3fnc n TYR 147 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3fnc n GLY 148 N -1.25 0.93 3.87 2.72 0.00 -1.26 -5.04 105.19 105.15 3fnc n GLY 148 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 3fnc n GLY 148 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fnc s TYR 149 N -2.58 3.64 0.15 1.61 1.51 -0.14 -5.09 117.35 116.46 3fnc s TYR 149 Ca 0.00 0.66 -0.30 0.00 -1.01 0.00 0.00 57.07 56.42 3fnc s TYR 149 Cb 0.00 -2.04 -0.07 0.00 -0.11 0.00 0.00 41.96 39.74 3fnc s TYR 149 CO 0.00 0.71 1.08 -1.25 -1.11 0.00 0.00 175.55 174.98 3fnc s PRO 150 N -1.06 4.60 -0.26 -1.71 0.04 -1.26 -0.07 135.00 135.28 3fnc s PRO 150 Ca 0.18 1.67 0.01 0.00 0.04 0.00 0.00 61.00 62.89 3fnc s PRO 150 Cb -0.13 -3.30 0.07 0.00 0.04 0.00 0.00 34.50 31.18 3fnc s PRO 150 CO 0.07 0.07 -0.01 -0.51 0.04 0.00 0.00 177.00 176.67 3fnc s LEU 151 N -0.16 2.78 -0.02 -3.56 1.02 0.11 -4.91 118.68 113.94 3fnc s LEU 151 Ca 0.50 -1.39 -0.30 0.00 0.02 0.00 0.00 54.13 52.95 3fnc s LEU 151 Cb -0.28 -1.16 -0.05 0.00 0.02 0.00 0.00 46.19 44.72 3fnc s LEU 151 CO 0.33 -0.29 1.35 -1.61 0.02 0.00 0.00 176.35 176.15 3fnc s GLU 152 N 1.38 4.30 -0.03 1.70 0.41 -1.26 -0.24 118.70 124.96 3fnc s GLU 152 Ca -0.00 1.88 0.05 0.00 -0.41 0.00 0.00 54.97 56.49 3fnc s GLU 152 Cb -0.18 -3.58 -0.01 0.00 -1.78 0.00 0.00 34.13 28.58 3fnc s GLU 152 CO -0.10 -0.55 -0.18 0.99 -0.49 0.00 0.00 175.26 174.93 3fnc s THR 153 N 2.40 1.48 -0.14 3.63 2.01 0.40 -0.57 115.64 124.84 3fnc s THR 153 Ca 0.62 -0.77 -0.03 0.00 0.31 0.00 0.00 61.69 61.82 3fnc s THR 153 Cb -0.29 -1.25 -0.03 0.00 0.01 0.00 0.00 72.50 70.94 3fnc s THR 153 CO 0.25 0.42 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.92 3fnc s ILE 154 N -0.18 3.80 -0.18 1.82 -1.09 0.35 -1.47 121.20 124.24 3fnc s ILE 154 Ca 0.01 -0.40 -0.05 0.00 -2.23 0.00 0.00 60.65 57.98 3fnc s ILE 154 Cb -0.10 -2.64 -0.03 0.00 -1.58 0.00 0.00 42.46 38.11 3fnc s ILE 154 CO 0.01 0.52 0.01 -0.60 -1.23 0.00 0.00 174.94 173.64 3fnc s ARG 155 N 0.14 3.75 0.28 2.79 3.52 -0.32 -0.51 118.95 128.60 3fnc s ARG 155 Ca -0.02 -0.46 0.11 0.00 -0.13 0.00 0.00 55.73 55.23 3fnc s ARG 155 Cb -0.14 -3.07 -0.05 0.00 -1.56 0.00 0.00 34.95 30.13 3fnc s ARG 155 CO 0.03 0.17 -0.13 -0.06 -0.81 0.00 0.00 175.30 174.50 3fnc s PHE 156 N 0.60 2.42 0.10 5.12 0.08 -0.22 -0.31 117.98 125.75 3fnc s PHE 156 Ca -0.00 -0.31 0.01 0.00 0.12 0.00 0.00 56.93 56.75 3fnc s PHE 156 Cb -0.14 -1.08 -0.04 0.00 -0.57 0.00 0.00 43.02 41.19 3fnc s PHE 156 CO 0.02 0.68 -0.05 0.54 -0.10 0.00 0.00 175.22 176.31 3fnc s ASN 157 N -3.57 1.01 -0.06 1.36 4.22 -0.26 -1.15 114.94 116.50 3fnc s ASN 157 Ca 0.31 -1.02 0.06 0.00 -2.14 0.00 0.00 52.86 50.06 3fnc s ASN 157 Cb -0.05 0.12 -0.01 0.00 1.28 0.00 0.00 41.25 42.59 3fnc s ASN 157 CO 0.17 -0.50 -0.24 -0.22 -2.04 0.00 0.00 177.10 174.26 3fnc s LEU 158 N -3.03 2.12 0.00 3.54 2.96 -1.26 -0.87 118.68 122.14 3fnc s LEU 158 Ca 0.12 -0.50 0.17 0.00 -0.22 0.00 0.00 54.13 53.71 3fnc s LEU 158 Cb 0.06 -1.39 0.29 0.00 0.50 0.00 0.00 46.19 45.64 3fnc s LEU 158 CO -0.05 0.24 1.11 -3.20 -1.32 0.00 0.00 176.35 173.13 3fnc n ASN 159 N 3.00 0.65 0.00 3.68 5.15 -1.26 -4.28 115.26 122.19 3fnc n ASN 159 Ca -0.18 -1.99 0.00 0.00 -0.60 0.00 0.00 54.58 51.81 3fnc n ASN 159 Cb 0.52 -0.26 0.00 0.00 -0.53 0.00 0.00 39.78 39.51 3fnc n ASN 159 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66