#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iqc n ASN 2 N 0.00 0.00 -3.00 0.00 3.02 -1.26 -5.14 115.26 108.88 1iqc n ASN 2 Ca 0.00 0.00 -0.27 0.00 -0.03 0.00 0.00 54.58 54.28 1iqc n ASN 2 Cb 0.00 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.18 1iqc n ASN 2 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1iqc n GLU 3 N 0.49 0.00 0.00 3.52 -0.58 -1.26 -4.88 120.64 117.93 1iqc n GLU 3 Ca 0.00 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 56.87 1iqc n GLU 3 Cb 0.00 -0.72 0.71 0.00 -0.57 0.00 0.00 31.44 30.86 1iqc n GLU 3 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 1iqc n PRO 4 N 1.26 0.53 -4.96 3.49 -0.02 -1.26 -4.72 135.00 129.32 1iqc n PRO 4 Ca 0.04 0.03 -0.27 0.00 -2.02 0.00 0.00 63.50 61.28 1iqc n PRO 4 Cb 0.35 -1.50 -0.15 0.00 -0.02 0.00 0.00 33.50 32.18 1iqc n PRO 4 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1iqc s ILE 5 N -2.39 1.66 0.18 4.25 -1.09 -1.26 -1.00 121.20 121.55 1iqc s ILE 5 Ca 0.30 -0.95 0.10 0.00 -2.23 0.00 0.00 60.65 57.87 1iqc s ILE 5 Cb 0.18 -1.39 -0.04 0.00 -1.58 0.00 0.00 42.46 39.63 1iqc s ILE 5 CO 0.37 0.42 -0.16 -1.10 -1.23 0.00 0.00 174.94 173.24 1iqc s GLN 6 N -0.62 1.83 0.68 2.79 1.11 -1.24 -4.93 119.66 119.28 1iqc s GLN 6 Ca 0.08 -1.36 -0.14 0.00 0.01 0.00 0.00 55.36 53.95 1iqc s GLN 6 Cb -0.08 -2.03 0.01 0.00 -1.01 0.00 0.00 33.01 29.89 1iqc s GLN 6 CO -0.00 0.42 1.10 -2.14 0.01 0.00 0.00 175.29 174.68 1iqc s PRO 7 N -2.73 2.71 -0.01 2.91 0.02 -1.26 -4.27 135.00 132.37 1iqc s PRO 7 Ca 0.23 1.32 -0.17 0.00 0.02 0.00 0.00 61.00 62.40 1iqc s PRO 7 Cb -0.09 -1.94 -0.06 0.00 0.02 0.00 0.00 34.50 32.43 1iqc s PRO 7 CO 0.13 -1.31 0.47 0.42 -0.33 0.00 0.00 177.00 176.38 1iqc s ILE 8 N -2.49 4.99 0.00 2.83 1.01 -1.26 -4.91 121.20 121.37 1iqc s ILE 8 Ca 0.65 0.98 -0.00 0.00 0.00 0.00 0.00 60.65 62.28 1iqc s ILE 8 Cb -0.19 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.45 1iqc s ILE 8 CO 0.45 0.50 0.08 -0.54 0.00 0.00 0.00 174.94 175.43 1iqc s LYS 9 N -0.63 3.05 0.59 2.79 -0.14 -1.26 -4.49 119.74 119.65 1iqc s LYS 9 Ca 0.26 -0.50 -0.20 0.00 -1.36 0.00 0.00 55.97 54.17 1iqc s LYS 9 Cb -0.17 -2.85 -0.03 0.00 -1.68 0.00 0.00 37.83 33.10 1iqc s LYS 9 CO 0.14 0.64 1.29 0.00 -0.76 0.00 0.00 175.35 176.66 1iqc s ALA 10 N -1.21 2.61 -0.14 5.17 0.00 -1.26 -4.79 121.76 122.14 1iqc s ALA 10 Ca 0.23 1.19 0.02 0.00 0.00 0.00 0.00 51.96 53.40 1iqc s ALA 10 Cb -0.12 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.49 1iqc s ALA 10 CO 0.14 -1.35 -0.18 0.08 0.00 0.00 0.00 175.76 174.46 1iqc s VAL 11 N -1.42 1.76 -0.23 0.00 1.01 -1.26 -5.11 120.40 115.16 1iqc s VAL 11 Ca 0.76 -0.78 -0.10 0.00 0.00 0.00 0.00 61.98 61.86 1iqc s VAL 11 Cb -0.36 -1.59 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 1iqc s VAL 11 CO 0.40 0.49 0.13 0.42 0.00 0.00 0.00 175.10 176.55 1iqc s THR 12 N 1.08 5.20 0.19 3.92 -4.23 -1.26 -4.84 115.64 115.71 1iqc s THR 12 Ca -0.03 0.12 -0.32 0.00 -1.18 0.00 0.00 61.69 60.28 1iqc s THR 12 Cb -0.14 -3.41 -0.15 0.00 1.34 0.00 0.00 72.50 70.14 1iqc s THR 12 CO -0.05 0.38 1.29 -2.65 -0.54 0.00 0.00 174.62 173.05 1iqc n PRO 13 N 4.10 1.56 0.17 3.99 -0.02 -1.26 -4.88 135.00 138.66 1iqc n PRO 13 Ca -0.15 0.56 0.03 0.00 -2.02 0.00 0.00 63.50 61.91 1iqc n PRO 13 Cb 0.52 -2.14 0.41 0.00 -0.02 0.00 0.00 33.50 32.27 1iqc n PRO 13 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1iqc h GLU 14 N 3.91 0.10 -3.48 -0.52 4.57 -1.97 -3.37 114.58 113.82 1iqc h GLU 14 Ca -0.44 -0.03 -0.56 0.00 -1.18 0.00 0.00 59.36 57.15 1iqc h GLU 14 Cb 1.31 -0.01 -0.40 0.00 -0.16 0.00 0.00 28.75 29.49 1iqc h GLU 14 CO 0.74 0.32 -0.76 1.21 -1.18 0.00 0.00 179.01 179.33 1iqc s ASN 15 N -6.94 3.76 0.13 1.04 3.84 -1.26 -5.04 114.94 110.48 1iqc s ASN 15 Ca -0.04 -1.43 -0.24 0.00 0.21 0.00 0.00 52.86 51.36 1iqc s ASN 15 Cb 0.15 -0.76 -0.02 0.00 -0.55 0.00 0.00 41.25 40.07 1iqc s ASN 15 CO 0.72 -0.39 1.64 0.00 -2.79 0.00 0.00 177.10 176.28 1iqc h ALA 16 N 8.15 -0.23 -0.20 1.71 0.00 -1.99 -1.62 119.26 125.08 1iqc h ALA 16 Ca -0.15 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1iqc h ALA 16 Cb 1.04 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1iqc h ALA 16 CO 0.44 -0.70 -0.04 -0.44 0.00 0.00 0.00 179.25 178.51 1iqc h ASP 17 N -0.31 0.27 -0.24 0.00 3.45 -1.97 -2.71 116.42 114.91 1iqc h ASP 17 Ca 0.09 -0.04 -0.08 0.00 0.43 0.00 0.00 57.03 57.43 1iqc h ASP 17 Cb 0.44 -0.07 -0.01 0.00 -0.56 0.00 0.00 39.33 39.14 1iqc h ASP 17 CO -0.28 0.35 -0.14 -0.03 -1.57 0.00 0.00 179.24 177.57 1iqc h MET 18 N 0.29 0.53 -0.34 3.56 4.05 -1.82 -2.37 114.93 118.83 1iqc h MET 18 Ca 0.06 -0.24 0.01 0.00 -0.28 0.00 0.00 59.70 59.25 1iqc h MET 18 Cb 0.26 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.03 1iqc h MET 18 CO 0.01 0.80 0.23 0.00 0.23 0.00 0.00 176.91 178.18 1iqc h ALA 19 N 0.71 1.80 -0.13 0.39 0.00 -1.07 -0.15 119.26 120.80 1iqc h ALA 19 Ca 0.05 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1iqc h ALA 19 Cb 0.66 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1iqc h ALA 19 CO 0.04 0.17 -0.14 1.49 0.00 0.00 0.00 179.25 180.82 1iqc h GLU 20 N 0.42 0.33 -0.69 0.00 4.57 -1.32 -1.09 114.58 116.81 1iqc h GLU 20 Ca 0.13 -0.18 0.01 0.00 -1.18 0.00 0.00 59.36 58.15 1iqc h GLU 20 Cb 0.00 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.57 1iqc h GLU 20 CO -0.03 0.73 0.45 1.25 -1.18 0.00 0.00 179.01 180.23 1iqc h LEU 21 N -0.06 0.77 -1.18 1.64 5.85 -0.87 -1.37 115.31 120.09 1iqc h LEU 21 Ca 0.02 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 1iqc h LEU 21 Cb 0.67 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1iqc h LEU 21 CO 0.03 0.55 0.08 1.23 -0.34 0.00 0.00 178.44 179.99 1iqc h GLY 22 N 0.91 0.69 0.94 3.75 0.00 -0.97 -1.60 103.07 106.79 1iqc h GLY 22 Ca 0.26 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 1iqc h GLY 22 CO -0.07 0.37 0.16 1.70 0.00 0.00 0.00 176.54 178.70 1iqc h LYS 23 N 0.63 0.60 -0.19 4.80 3.64 -0.29 -1.16 116.57 124.59 1iqc h LYS 23 Ca 0.14 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1iqc h LYS 23 Cb 0.28 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1iqc h LYS 23 CO 0.00 0.56 0.10 0.52 -2.27 0.00 0.00 179.45 178.37 1iqc h MET 24 N 0.50 0.27 -0.65 1.90 2.86 -0.82 -2.87 114.93 116.12 1iqc h MET 24 Ca 0.13 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.72 1iqc h MET 24 Cb 0.19 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.77 1iqc h MET 24 CO -0.01 0.28 0.34 -0.07 1.06 0.00 0.00 176.91 178.51 1iqc h LEU 25 N 0.20 0.81 -1.83 1.22 3.38 -1.17 -1.78 115.31 116.14 1iqc h LEU 25 Ca 0.07 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1iqc h LEU 25 Cb 0.09 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1iqc h LEU 25 CO -0.01 0.67 0.07 0.15 0.09 0.00 0.00 178.44 179.41 1iqc h PHE 26 N 0.92 0.17 -0.21 1.13 3.57 -1.00 -2.15 116.94 119.37 1iqc h PHE 26 Ca 0.23 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.73 1iqc h PHE 26 Cb 0.05 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1iqc h PHE 26 CO 0.01 0.13 0.00 1.19 -2.23 0.00 0.00 178.31 177.40 1iqc n PHE 27 N -4.50 0.25 -2.96 0.41 3.01 -0.87 -2.19 117.46 110.61 1iqc n PHE 27 Ca -0.01 -0.14 -0.43 0.00 1.01 0.00 0.00 57.45 57.88 1iqc n PHE 27 Cb 0.10 -0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.51 1iqc n PHE 27 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1iqc s ASP 28 N -1.60 6.35 0.00 4.37 3.68 -0.73 -4.90 116.67 123.85 1iqc s ASP 28 Ca 0.31 -0.35 0.15 0.00 2.13 0.00 0.00 52.55 54.79 1iqc s ASP 28 Cb 0.20 -2.38 0.74 0.00 -1.45 0.00 0.00 42.92 40.02 1iqc s ASP 28 CO 0.28 -1.01 1.42 -0.81 0.13 0.00 0.00 175.17 175.19 1iqc n PRO 29 N 6.84 0.19 0.00 4.34 -0.04 -1.26 -2.69 135.00 142.38 1iqc n PRO 29 Ca 0.00 0.16 0.14 0.00 -0.04 0.00 0.00 63.50 63.76 1iqc n PRO 29 Cb 0.47 -1.50 0.75 0.00 -0.04 0.00 0.00 33.50 33.18 1iqc n PRO 29 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1iqc n ARG 30 N -1.31 0.59 0.05 0.54 1.74 -1.26 -2.05 116.66 114.96 1iqc n ARG 30 Ca 0.07 0.02 0.13 0.00 -0.77 0.00 0.00 57.85 57.29 1iqc n ARG 30 Cb 0.13 -1.50 0.49 0.00 -1.02 0.00 0.00 32.46 30.56 1iqc n ARG 30 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1iqc n LEU 31 N -1.17 0.38 -4.94 0.55 4.77 -1.09 -4.76 117.00 110.73 1iqc n LEU 31 Ca 0.16 0.55 -0.25 0.00 -0.03 0.00 0.00 56.01 56.44 1iqc n LEU 31 Cb 0.17 -0.44 -0.02 0.00 -2.33 0.00 0.00 43.42 40.80 1iqc n LEU 31 CO 0.19 -0.15 0.01 -0.94 -1.33 0.00 0.00 177.39 175.17 1iqc s SER 32 N -3.72 6.34 0.19 -1.43 1.04 -0.87 -4.58 113.70 110.67 1iqc s SER 32 Ca 0.11 0.27 -0.11 0.00 0.48 0.00 0.00 55.95 56.70 1iqc s SER 32 Cb 0.14 -1.95 0.12 0.00 0.10 0.00 0.00 66.02 64.44 1iqc s SER 32 CO 0.52 -0.08 1.83 0.50 0.98 0.00 0.00 173.24 176.98 1iqc h LYS 33 N 1.56 0.94 0.00 4.02 3.64 -1.31 -2.69 116.57 122.72 1iqc h LYS 33 Ca -0.50 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 58.79 1iqc h LYS 33 Cb 1.21 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1iqc h LYS 33 CO 0.65 0.68 0.00 0.66 -2.27 0.00 0.00 179.45 179.17 1iqc h SER 34 N 0.94 0.00 -0.61 4.20 4.64 -1.77 0.81 113.55 121.76 1iqc h SER 34 Ca 0.25 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.33 1iqc h SER 34 Cb -0.01 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 61.99 1iqc h SER 34 CO -0.04 0.00 -0.22 0.61 -0.87 0.00 0.00 176.83 176.31 1iqc n GLY 35 N 0.56 1.19 0.00 -0.77 0.00 -1.02 -3.97 105.19 101.18 1iqc n GLY 35 Ca 0.03 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1iqc n GLY 35 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1iqc n PHE 36 N -2.75 0.00 -4.50 1.61 7.35 -1.21 -4.53 117.46 113.44 1iqc n PHE 36 Ca -0.12 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.24 1iqc n PHE 36 Cb 0.39 0.00 -0.15 0.00 0.35 0.00 0.00 39.48 40.07 1iqc n PHE 36 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1iqc s ILE 37 N -1.14 2.80 0.46 -2.13 1.01 -1.25 -4.93 121.20 116.02 1iqc s ILE 37 Ca 0.00 -0.72 0.03 0.00 0.00 0.00 0.00 60.65 59.96 1iqc s ILE 37 Cb 0.00 -2.19 -0.04 0.00 0.01 0.00 0.00 42.46 40.24 1iqc s ILE 37 CO 0.00 0.51 0.02 -0.94 0.00 0.00 0.00 174.94 174.53 1iqc s SER 38 N 0.81 3.82 0.23 3.58 1.04 -1.26 -3.84 113.70 118.07 1iqc s SER 38 Ca -0.05 -1.55 -0.08 0.00 0.48 0.00 0.00 55.95 54.75 1iqc s SER 38 Cb -0.15 0.21 0.22 0.00 0.10 0.00 0.00 66.02 66.39 1iqc s SER 38 CO 0.00 -0.73 1.90 0.00 0.98 0.00 0.00 173.24 175.40 1iqc h ASN 40 N 1.18 0.00 -0.48 0.00 -0.73 -1.67 0.37 115.58 114.25 1iqc h ASN 40 Ca 0.33 0.00 -0.03 0.00 1.87 0.00 0.00 56.30 58.47 1iqc h ASN 40 Cb -0.11 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 38.46 1iqc h ASN 40 CO -0.08 0.01 0.18 0.28 -0.37 0.00 0.00 177.43 177.45 1iqc h SER 41 N 0.00 0.67 0.04 1.15 0.02 -1.53 -1.66 113.55 112.25 1iqc h SER 41 Ca -0.00 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1iqc h SER 41 Cb 0.13 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1iqc h SER 41 CO 0.00 0.67 -0.92 0.00 -1.14 0.00 0.00 176.83 175.43 1iqc n HIS 43 N -1.42 0.69 -1.69 0.00 8.25 0.07 -1.41 115.22 119.72 1iqc n HIS 43 Ca 0.04 -3.75 -0.40 0.00 -0.26 0.00 0.00 57.72 53.35 1iqc n HIS 43 Cb 0.34 -0.41 -0.03 0.00 1.12 0.00 0.00 29.99 31.01 1iqc n HIS 43 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1iqc s ASN 44 N -1.88 5.16 0.00 0.41 3.04 -0.63 -4.30 114.94 116.75 1iqc s ASN 44 Ca 0.38 1.41 0.11 0.00 0.04 0.00 0.00 52.86 54.80 1iqc s ASN 44 Cb 0.22 -2.51 0.61 0.00 -1.54 0.00 0.00 41.25 38.03 1iqc s ASN 44 CO -0.09 -2.27 1.19 0.18 -3.04 0.00 0.00 177.10 173.08 1iqc n LEU 45 N 12.98 0.00 0.03 3.21 4.77 -1.26 -0.52 117.00 136.20 1iqc n LEU 45 Ca 0.30 0.16 0.11 0.00 -0.03 0.00 0.00 56.01 56.56 1iqc n LEU 45 Cb 0.49 -0.16 -0.11 0.00 -2.33 0.00 0.00 43.42 41.31 1iqc n LEU 45 CO 0.68 -0.10 -0.47 -1.20 -1.33 0.00 0.00 177.39 174.98 1iqc n SER 46 N -1.16 0.32 -0.16 -1.43 7.64 -1.26 -4.41 113.62 113.15 1iqc n SER 46 Ca 0.07 0.08 0.05 0.00 1.01 0.00 0.00 58.87 60.08 1iqc n SER 46 Cb 0.07 1.43 -0.02 0.00 -1.01 0.00 0.00 64.21 64.68 1iqc n SER 46 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1iqc n MET 47 N -2.37 2.54 0.00 1.43 2.81 0.32 -4.99 117.12 116.86 1iqc n MET 47 Ca -0.02 -0.41 0.00 0.00 -1.81 0.00 0.00 57.70 55.45 1iqc n MET 47 Cb 0.55 -1.08 0.00 0.00 -0.71 0.00 0.00 33.22 31.99 1iqc n MET 47 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1iqc n GLY 48 N 1.05 1.46 0.90 3.03 0.00 -0.49 -4.72 105.19 106.43 1iqc n GLY 48 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1iqc n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iqc n GLY 49 N -0.15 0.77 3.38 -0.02 0.00 -0.11 -4.63 105.19 104.42 1iqc n GLY 49 Ca 0.00 -0.02 -0.21 0.00 0.00 0.00 0.00 46.02 45.79 1iqc n GLY 49 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1iqc s THR 50 N -2.00 0.31 -2.70 2.61 -4.23 -1.26 -3.05 115.64 105.32 1iqc s THR 50 Ca 0.00 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.75 1iqc s THR 50 Cb 0.00 -2.45 0.33 0.00 1.34 0.00 0.00 72.50 71.72 1iqc s THR 50 CO 0.00 0.00 1.37 -0.90 -0.54 0.00 0.00 174.62 174.55 1iqc n ASP 51 N -1.25 3.11 -3.43 3.99 5.68 -0.50 -2.42 116.55 121.73 1iqc n ASP 51 Ca 0.01 -1.96 -0.24 0.00 -0.50 0.00 0.00 54.79 52.09 1iqc n ASP 51 Cb 0.64 -0.13 -0.00 0.00 -1.14 0.00 0.00 41.12 40.49 1iqc n ASP 51 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1iqc n ASN 52 N 1.33 -3.92 -4.23 -1.12 3.02 -1.26 -4.96 115.26 104.12 1iqc n ASN 52 Ca 0.17 -0.45 -0.13 0.00 -0.03 0.00 0.00 54.58 54.14 1iqc n ASN 52 Cb 0.58 -3.22 -0.10 0.00 -0.61 0.00 0.00 39.78 36.43 1iqc n ASN 52 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1iqc s ILE 53 N -2.99 0.52 0.03 2.41 -4.36 -1.26 -4.48 121.20 111.07 1iqc s ILE 53 Ca 0.43 -1.97 -0.08 0.00 -0.26 0.00 0.00 60.65 58.77 1iqc s ILE 53 Cb -0.23 -2.15 -0.03 0.00 1.25 0.00 0.00 42.46 41.30 1iqc s ILE 53 CO 0.53 -0.42 1.14 0.71 0.24 0.00 0.00 174.94 177.14 1iqc h THR 54 N 2.71 0.00 -3.38 8.37 1.35 -1.92 -3.43 112.91 116.61 1iqc h THR 54 Ca -0.36 0.00 -0.36 0.00 -0.55 0.00 0.00 66.41 65.14 1iqc h THR 54 Cb 1.21 0.00 -0.16 0.00 -1.73 0.00 0.00 68.15 67.47 1iqc h THR 54 CO 0.62 0.00 -0.73 0.42 -0.25 0.00 0.00 175.52 175.58 1iqc s THR 55 N -3.68 1.26 0.45 6.82 -4.23 -1.26 -3.54 115.64 111.46 1iqc s THR 55 Ca -0.04 -1.98 -0.23 0.00 -1.18 0.00 0.00 61.69 58.26 1iqc s THR 55 Cb 0.02 -1.77 -0.08 0.00 1.34 0.00 0.00 72.50 72.02 1iqc s THR 55 CO 0.16 -0.64 1.16 -0.44 -0.54 0.00 0.00 174.62 174.32 1iqc s SER 56 N -2.98 6.23 -0.25 3.99 0.01 -1.25 -4.59 113.70 114.85 1iqc s SER 56 Ca 0.15 2.30 -0.21 0.00 1.31 0.00 0.00 55.95 59.50 1iqc s SER 56 Cb 0.00 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.61 1iqc s SER 56 CO 0.02 -0.88 0.66 -0.63 0.41 0.00 0.00 173.24 172.82 1iqc s ILE 57 N -1.53 4.96 0.00 1.44 -1.09 -1.26 0.79 121.20 124.50 1iqc s ILE 57 Ca 0.63 1.21 0.00 0.00 -2.23 0.00 0.00 60.65 60.25 1iqc s ILE 57 Cb -0.29 -3.96 0.00 0.00 -1.58 0.00 0.00 42.46 36.63 1iqc s ILE 57 CO 0.35 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.68 1iqc n GLY 58 N 4.08 3.33 3.66 6.18 0.00 -0.07 -4.88 105.19 117.48 1iqc n GLY 58 Ca 0.00 -2.08 -0.45 0.00 0.00 0.00 0.00 46.02 43.50 1iqc n GLY 58 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1iqc n HIS 59 N -0.24 2.06 -3.26 1.61 -0.00 -0.09 -1.31 115.22 114.00 1iqc n HIS 59 Ca 0.00 0.46 -0.24 0.00 -0.00 0.00 0.00 57.72 57.95 1iqc n HIS 59 Cb 0.00 -2.44 0.04 0.00 -0.00 0.00 0.00 29.99 27.59 1iqc n HIS 59 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 1iqc n LYS 60 N 1.96 -5.23 -3.49 1.57 5.02 -1.26 -2.53 118.16 114.20 1iqc n LYS 60 Ca 0.12 0.80 -0.26 0.00 -2.02 0.00 0.00 58.31 56.95 1iqc n LYS 60 Cb 0.31 -5.67 0.03 0.00 -0.02 0.00 0.00 35.03 29.67 1iqc n LYS 60 CO 0.00 0.00 0.00 1.87 -0.52 0.00 0.00 177.40 178.75 1iqc n TRP 61 N -4.52 -2.15 -2.29 2.13 -0.00 -0.42 -4.95 117.44 105.24 1iqc n TRP 61 Ca -0.06 0.70 -0.41 0.00 -0.00 0.00 0.00 57.50 57.73 1iqc n TRP 61 Cb 0.59 -3.97 -0.03 0.00 -0.00 0.00 0.00 31.31 27.89 1iqc n TRP 61 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 177.69 177.04 1iqc s GLN 62 N -6.18 4.48 -0.41 5.87 -0.21 -1.05 -4.72 119.66 117.43 1iqc s GLN 62 Ca 0.49 2.01 -0.26 0.00 0.02 0.00 0.00 55.36 57.62 1iqc s GLN 62 Cb -0.24 -3.15 0.02 0.00 1.00 0.00 0.00 33.01 30.64 1iqc s GLN 62 CO 0.60 -0.04 0.94 -1.14 -2.12 0.00 0.00 175.29 173.54 1iqc s GLN 63 N -1.25 3.71 0.77 2.91 0.74 -1.26 -0.89 119.66 124.39 1iqc s GLN 63 Ca 0.49 0.41 -0.15 0.00 0.05 0.00 0.00 55.36 56.16 1iqc s GLN 63 Cb -0.36 -3.86 0.01 0.00 1.10 0.00 0.00 33.01 29.91 1iqc s GLN 63 CO 0.45 -1.09 0.81 0.41 -0.55 0.00 0.00 175.29 175.31 1iqc n GLY 64 N 4.64 -0.90 0.02 2.59 0.00 0.24 -4.94 105.19 106.84 1iqc n GLY 64 Ca 0.07 -0.44 0.13 0.00 0.00 0.00 0.00 46.02 45.78 1iqc n GLY 64 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1iqc n PRO 65 N -1.80 0.08 -3.54 1.61 -0.04 -1.26 -4.59 135.00 125.46 1iqc n PRO 65 Ca 0.11 0.04 -0.14 0.00 -0.04 0.00 0.00 63.50 63.48 1iqc n PRO 65 Cb 0.50 -1.57 -0.05 0.00 -0.04 0.00 0.00 33.50 32.35 1iqc n PRO 65 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1iqc s ILE 66 N -3.04 0.02 0.19 0.52 2.07 -1.26 -4.86 121.20 114.85 1iqc s ILE 66 Ca 0.12 -0.19 -0.31 0.00 -1.41 0.00 0.00 60.65 58.86 1iqc s ILE 66 Cb 0.17 -1.00 -0.09 0.00 0.13 0.00 0.00 42.46 41.67 1iqc s ILE 66 CO 0.61 -0.11 1.41 0.21 -1.91 0.00 0.00 174.94 175.16 1iqc s ASN 67 N -2.11 6.75 -0.12 4.50 3.84 0.18 -3.89 114.94 124.08 1iqc s ASN 67 Ca -0.04 2.50 -0.29 0.00 0.21 0.00 0.00 52.86 55.24 1iqc s ASN 67 Cb -0.00 -2.61 -0.01 0.00 -0.55 0.00 0.00 41.25 38.08 1iqc s ASN 67 CO -0.04 -0.66 1.12 0.00 -2.79 0.00 0.00 177.10 174.73 1iqc s ALA 68 N 0.50 3.53 0.77 1.71 0.00 -1.26 -4.94 121.76 122.07 1iqc s ALA 68 Ca 0.62 0.43 -0.12 0.00 0.00 0.00 0.00 51.96 52.89 1iqc s ALA 68 Cb -0.39 -3.51 0.05 0.00 0.00 0.00 0.00 23.12 19.26 1iqc s ALA 68 CO 0.37 -0.84 1.12 -1.25 0.00 0.00 0.00 175.76 175.16 1iqc s PRO 69 N 2.56 2.33 0.34 0.00 0.04 -1.26 -4.66 135.00 134.34 1iqc s PRO 69 Ca 0.51 0.41 -0.22 0.00 0.04 0.00 0.00 61.00 61.74 1iqc s PRO 69 Cb -0.20 -1.97 -0.10 0.00 0.04 0.00 0.00 34.50 32.27 1iqc s PRO 69 CO 0.16 -1.40 0.89 -0.08 0.04 0.00 0.00 177.00 176.61 1iqc s THR 70 N -3.36 4.38 -1.20 1.26 -1.32 -1.25 -4.65 115.64 109.50 1iqc s THR 70 Ca 0.60 1.53 0.27 0.00 -1.21 0.00 0.00 61.69 62.88 1iqc s THR 70 Cb -0.12 -3.81 0.19 0.00 -1.51 0.00 0.00 72.50 67.25 1iqc s THR 70 CO 0.52 -0.03 1.66 1.33 -2.21 0.00 0.00 174.62 175.88 1iqc n VAL 71 N 0.10 0.00 -2.10 5.08 0.24 -1.17 -4.53 118.33 115.94 1iqc n VAL 71 Ca 0.03 -0.02 -0.42 0.00 -2.04 0.00 0.00 64.34 61.88 1iqc n VAL 71 Cb 0.52 -0.01 -0.03 0.00 -1.47 0.00 0.00 33.84 32.85 1iqc n VAL 71 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1iqc s LEU 72 N -2.84 4.29 0.00 1.34 1.43 -1.26 -2.13 118.68 119.51 1iqc s LEU 72 Ca 0.17 2.11 0.00 0.00 -1.03 0.00 0.00 54.13 55.38 1iqc s LEU 72 Cb 0.19 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.87 1iqc s LEU 72 CO 0.59 -0.88 0.00 0.59 0.23 0.00 0.00 176.35 176.88 1iqc n ASN 73 N 6.98 -2.07 0.12 2.29 3.02 -0.53 -4.86 115.26 120.21 1iqc n ASN 73 Ca 0.16 0.00 0.20 0.00 -0.03 0.00 0.00 54.58 54.91 1iqc n ASN 73 Cb 0.43 -1.69 0.76 0.00 -0.61 0.00 0.00 39.78 38.68 1iqc n ASN 73 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1iqc h SER 74 N 0.00 0.00 0.06 6.41 4.64 -1.66 0.16 113.55 123.16 1iqc h SER 74 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1iqc h SER 74 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1iqc h SER 74 CO 0.00 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.42 1iqc n SER 75 N -3.72 0.17 -0.13 4.97 3.41 -1.26 -1.15 113.62 115.91 1iqc n SER 75 Ca 0.06 0.57 0.12 0.00 -0.26 0.00 0.00 58.87 59.36 1iqc n SER 75 Cb 0.56 -0.60 0.14 0.00 -0.26 0.00 0.00 64.21 64.06 1iqc n SER 75 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1iqc n MET 76 N -1.72 0.36 -1.95 4.33 2.81 0.55 -4.96 117.12 116.54 1iqc n MET 76 Ca -0.00 -0.26 -0.38 0.00 -1.81 0.00 0.00 57.70 55.25 1iqc n MET 76 Cb 0.03 -1.49 0.02 0.00 -0.71 0.00 0.00 33.22 31.07 1iqc n MET 76 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1iqc s ASN 77 N -2.81 5.65 0.41 7.83 0.01 -0.30 -4.82 114.94 120.90 1iqc s ASN 77 Ca 0.14 2.63 0.17 0.00 -0.71 0.00 0.00 52.86 55.09 1iqc s ASN 77 Cb 0.18 -2.63 0.90 0.00 0.41 0.00 0.00 41.25 40.11 1iqc s ASN 77 CO 0.69 -1.30 1.88 0.17 -1.51 0.00 0.00 177.10 177.03 1iqc h LEU 78 N 1.77 0.00 -8.03 0.60 -0.00 -1.61 -3.46 115.31 104.59 1iqc h LEU 78 Ca -0.50 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.40 1iqc h LEU 78 Cb 1.28 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.90 1iqc h LEU 78 CO 0.59 0.30 0.21 0.00 -0.00 0.00 0.00 178.44 179.53 1iqc s ALA 79 N -4.13 -0.94 0.08 0.17 0.00 -1.26 -4.94 121.76 110.74 1iqc s ALA 79 Ca -0.02 -0.53 0.06 0.00 0.00 0.00 0.00 51.96 51.47 1iqc s ALA 79 Cb 0.14 0.82 -0.04 0.00 0.00 0.00 0.00 23.12 24.03 1iqc s ALA 79 CO 0.68 -1.00 -0.09 -0.65 0.00 0.00 0.00 175.76 174.70 1iqc s GLN 80 N -3.37 2.23 0.00 0.00 -1.52 0.13 -4.88 119.66 112.25 1iqc s GLN 80 Ca 0.14 -0.96 0.00 0.00 -1.95 0.00 0.00 55.36 52.59 1iqc s GLN 80 Cb -0.05 -2.35 0.00 0.00 -0.22 0.00 0.00 33.01 30.39 1iqc s GLN 80 CO 0.09 0.53 0.00 1.19 -0.25 0.00 0.00 175.29 176.85 1iqc n PHE 81 N 0.91 0.00 0.07 0.91 0.99 -1.26 -2.22 117.46 116.86 1iqc n PHE 81 Ca -0.14 0.00 0.16 0.00 -0.00 0.00 0.00 57.45 57.47 1iqc n PHE 81 Cb 0.52 -0.08 0.66 0.00 -1.00 0.00 0.00 39.48 39.58 1iqc n PHE 81 CO 0.00 0.00 0.00 -1.49 -0.00 0.00 0.00 176.76 175.27 1iqc h TRP 82 N 0.00 0.04 -0.14 1.38 4.06 -1.95 -0.56 115.95 118.78 1iqc h TRP 82 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1iqc h TRP 82 Cb 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.15 1iqc h TRP 82 CO 0.00 0.02 0.00 -0.40 -3.56 0.00 0.00 178.44 174.50 1iqc n ASP 83 N -4.44 3.12 -1.92 -3.49 5.75 -1.26 -1.48 116.55 112.84 1iqc n ASP 83 Ca 0.06 -1.98 -0.18 0.00 -0.01 0.00 0.00 54.79 52.68 1iqc n ASP 83 Cb 0.43 -0.08 -0.02 0.00 -1.03 0.00 0.00 41.12 40.42 1iqc n ASP 83 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1iqc n GLY 84 N 1.38 -0.08 0.18 6.12 0.00 -0.22 -4.55 105.19 108.01 1iqc n GLY 84 Ca 0.15 -0.15 0.14 0.00 0.00 0.00 0.00 46.02 46.16 1iqc n GLY 84 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1iqc h ARG 85 N 0.00 0.00 -5.28 1.61 0.11 -1.78 -3.42 114.38 105.62 1iqc h ARG 85 Ca -0.41 0.00 -0.62 0.00 0.10 0.00 0.00 59.98 59.05 1iqc h ARG 85 Cb 1.29 0.00 -0.17 0.00 1.11 0.00 0.00 29.97 32.20 1iqc h ARG 85 CO 0.50 0.00 -0.58 0.00 0.10 0.00 0.00 179.97 179.99 1iqc s ALA 86 N -3.39 3.33 0.15 0.08 0.00 -0.94 -5.00 121.76 115.99 1iqc s ALA 86 Ca 0.04 -0.76 -0.15 0.00 0.00 0.00 0.00 51.96 51.10 1iqc s ALA 86 Cb 0.09 -1.85 0.03 0.00 0.00 0.00 0.00 23.12 21.40 1iqc s ALA 86 CO 0.48 0.19 1.76 -0.22 0.00 0.00 0.00 175.76 177.97 1iqc h LYS 87 N 6.69 0.66 0.00 0.00 3.64 -1.86 0.37 116.57 126.07 1iqc h LYS 87 Ca -0.36 -0.08 -0.14 0.00 -1.27 0.00 0.00 60.65 58.80 1iqc h LYS 87 Cb 1.17 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.84 1iqc h LYS 87 CO 0.69 0.53 0.02 -0.40 -2.27 0.00 0.00 179.45 178.02 1iqc n ASP 88 N -4.67 -1.34 -0.38 4.20 5.68 -1.26 -4.48 116.55 114.30 1iqc n ASP 88 Ca 0.02 -2.37 -0.00 0.00 -0.50 0.00 0.00 54.79 51.93 1iqc n ASP 88 Cb 0.09 2.37 0.14 0.00 -1.14 0.00 0.00 41.12 42.57 1iqc n ASP 88 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 1iqc h LEU 89 N 0.00 1.11 -0.11 -2.12 3.38 -1.93 -1.45 115.31 114.19 1iqc h LEU 89 Ca -0.23 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 1iqc h LEU 89 Cb 0.93 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1iqc h LEU 89 CO 0.30 0.77 0.07 0.50 0.09 0.00 0.00 178.44 180.17 1iqc h LYS 90 N 1.30 0.15 -0.72 1.13 3.64 -1.94 -1.46 116.57 118.67 1iqc h LYS 90 Ca 0.39 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.72 1iqc h LYS 90 Cb -0.03 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 1iqc h LYS 90 CO -0.12 0.15 0.27 1.49 -2.27 0.00 0.00 179.45 178.97 1iqc h GLU 91 N 0.12 1.09 -0.06 1.90 4.81 -1.85 -3.09 114.58 117.49 1iqc h GLU 91 Ca 0.04 -0.21 0.03 0.00 -0.13 0.00 0.00 59.36 59.09 1iqc h GLU 91 Cb 0.03 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.21 1iqc h GLU 91 CO -0.01 0.91 -0.11 0.37 -0.73 0.00 0.00 179.01 179.43 1iqc h GLN 92 N 1.04 -0.16 -0.92 1.92 -0.00 -1.01 -3.05 115.11 112.94 1iqc h GLN 92 Ca 0.24 0.01 0.27 0.00 -0.00 0.00 0.00 58.65 59.17 1iqc h GLN 92 Cb 0.23 0.04 -0.04 0.00 0.00 0.00 0.00 27.48 27.71 1iqc h GLN 92 CO -0.02 -0.11 0.72 0.00 0.00 0.00 0.00 178.83 179.43 1iqc h ALA 93 N 0.86 2.82 0.00 3.38 0.00 -1.18 -0.17 119.26 124.97 1iqc h ALA 93 Ca 0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1iqc h ALA 93 Cb 0.25 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1iqc h ALA 93 CO -0.16 -1.20 -0.14 0.00 0.00 0.00 0.00 179.25 177.76 1iqc h ALA 94 N 1.42 0.99 0.64 0.00 0.00 -1.63 -3.36 119.26 117.32 1iqc h ALA 94 Ca 0.44 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 1iqc h ALA 94 Cb 1.88 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.65 1iqc h ALA 94 CO -0.00 0.17 -0.31 0.78 0.00 0.00 0.00 179.25 179.89 1iqc h GLY 95 N 2.42 -0.90 -0.41 0.00 0.00 -1.17 -3.30 103.07 99.72 1iqc h GLY 95 Ca -0.00 0.33 0.14 0.00 0.00 0.00 0.00 47.33 47.80 1iqc h GLY 95 CO 0.02 -0.33 -0.19 -2.55 0.00 0.00 0.00 176.54 173.49 1iqc h PRO 96 N -0.95 -0.01 -1.00 4.80 0.11 -1.74 -2.01 132.00 131.20 1iqc h PRO 96 Ca -0.09 0.00 0.14 0.00 0.11 0.00 0.00 66.00 66.16 1iqc h PRO 96 Cb 0.66 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.69 1iqc h PRO 96 CO 0.15 -0.01 0.62 0.82 -0.21 0.00 0.00 178.00 179.37 1iqc h ILE 97 N -0.01 0.87 -0.35 4.15 2.04 -1.74 -2.60 117.51 119.87 1iqc h ILE 97 Ca 0.33 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.87 1iqc h ILE 97 Cb 0.52 -0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.45 1iqc h ILE 97 CO -0.72 0.17 0.00 0.00 0.00 0.00 0.00 178.15 177.60 1iqc n ALA 98 N -2.35 2.37 -2.62 1.87 0.00 -0.94 -1.13 120.51 117.71 1iqc n ALA 98 Ca 0.20 -1.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.22 1iqc n ALA 98 Cb 0.40 -0.69 -0.03 0.00 0.00 0.00 0.00 19.45 19.13 1iqc n ALA 98 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1iqc s ASN 99 N -1.23 6.78 0.53 0.00 3.04 -0.80 -4.71 114.94 118.56 1iqc s ASN 99 Ca 0.32 0.81 0.20 0.00 0.04 0.00 0.00 52.86 54.23 1iqc s ASN 99 Cb 0.18 -2.48 1.37 0.00 -1.54 0.00 0.00 41.25 38.79 1iqc s ASN 99 CO 0.25 -0.78 2.12 1.55 -3.04 0.00 0.00 177.10 177.20 1iqc h PRO 100 N 8.18 0.00 -0.00 0.43 0.13 -1.89 0.15 132.00 139.01 1iqc h PRO 100 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 1iqc h PRO 100 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1iqc h PRO 100 CO 0.97 0.00 -0.03 1.63 -0.23 0.00 0.00 178.00 180.34 1iqc n LYS 101 N -4.40 0.36 0.00 0.86 5.02 -1.26 -4.38 118.16 114.36 1iqc n LYS 101 Ca 0.01 -0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1iqc n LYS 101 Cb 0.24 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.75 1iqc n LYS 101 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1iqc n GLU 102 N -1.30 0.00 0.17 1.97 1.02 -0.22 -4.07 120.64 118.22 1iqc n GLU 102 Ca 0.12 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.30 1iqc n GLU 102 Cb 0.27 0.00 0.27 0.00 -0.02 0.00 0.00 31.44 31.96 1iqc n GLU 102 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 1iqc h MET 103 N 0.00 0.00 -1.53 3.49 2.86 -1.34 -0.20 114.93 118.22 1iqc h MET 103 Ca 0.00 0.00 -0.40 0.00 -2.06 0.00 0.00 59.70 57.24 1iqc h MET 103 Cb 0.00 0.00 -0.11 0.00 0.06 0.00 0.00 31.60 31.55 1iqc h MET 103 CO 0.00 0.44 -0.41 0.00 1.06 0.00 0.00 176.91 178.00 1iqc n ALA 104 N -2.31 -0.39 -2.02 6.32 0.00 0.37 -1.06 120.51 121.42 1iqc n ALA 104 Ca -0.00 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1iqc n ALA 104 Cb 0.55 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 17.99 1iqc n ALA 104 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1iqc n SER 105 N -1.36 0.04 -4.10 0.00 2.88 -0.28 -4.46 113.62 106.34 1iqc n SER 105 Ca -0.21 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.23 1iqc n SER 105 Cb 0.66 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 64.01 1iqc n SER 105 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1iqc s THR 106 N 2.14 0.46 0.26 2.46 -4.23 -1.25 -4.17 115.64 111.30 1iqc s THR 106 Ca 0.00 -1.56 -0.05 0.00 -1.18 0.00 0.00 61.69 58.90 1iqc s THR 106 Cb 0.00 -1.19 0.26 0.00 1.34 0.00 0.00 72.50 72.91 1iqc s THR 106 CO 0.00 -0.74 1.94 0.45 -0.54 0.00 0.00 174.62 175.73 1iqc h HIS 107 N 3.60 1.21 -0.14 3.99 3.86 -1.95 -0.71 115.15 125.02 1iqc h HIS 107 Ca -0.35 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.89 1iqc h HIS 107 Cb 1.17 -0.41 -0.01 0.00 1.06 0.00 0.00 27.41 29.23 1iqc h HIS 107 CO 0.60 0.75 0.09 1.49 0.86 0.00 0.00 177.93 181.72 1iqc h GLU 108 N 1.30 0.18 -0.33 2.45 4.81 -1.99 -0.87 114.58 120.14 1iqc h GLU 108 Ca 0.36 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.50 1iqc h GLU 108 Cb -0.13 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 1iqc h GLU 108 CO -0.08 0.12 -0.10 0.82 -0.73 0.00 0.00 179.01 179.04 1iqc h ILE 109 N 0.19 1.28 -0.95 2.32 2.04 -1.90 -1.21 117.51 119.28 1iqc h ILE 109 Ca 0.05 -1.16 0.08 0.00 1.00 0.00 0.00 64.86 64.83 1iqc h ILE 109 Cb -0.02 1.35 -0.07 0.00 -0.74 0.00 0.00 36.82 37.35 1iqc h ILE 109 CO -0.01 0.38 0.61 0.00 0.00 0.00 0.00 178.15 179.13 1iqc h ALA 110 N 0.80 1.50 -0.25 1.87 0.00 -1.00 0.30 119.26 122.48 1iqc h ALA 110 Ca 0.08 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1iqc h ALA 110 Cb 0.60 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1iqc h ALA 110 CO 0.04 0.34 -0.02 0.93 0.00 0.00 0.00 179.25 180.54 1iqc h GLU 111 N 1.05 0.45 -0.87 0.00 5.08 -0.94 -2.09 114.58 117.26 1iqc h GLU 111 Ca 0.42 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1iqc h GLU 111 Cb 0.26 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 1iqc h GLU 111 CO -0.17 0.65 0.54 -0.22 -1.00 0.00 0.00 179.01 178.80 1iqc h LYS 112 N 0.21 1.18 0.06 2.33 3.64 -0.07 0.59 116.57 124.50 1iqc h LYS 112 Ca 0.07 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1iqc h LYS 112 Cb 0.46 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1iqc h LYS 112 CO 0.02 0.81 -0.03 0.28 -2.27 0.00 0.00 179.45 178.26 1iqc h VAL 113 N 1.20 1.02 -0.36 2.00 2.07 -0.35 -2.14 116.25 119.70 1iqc h VAL 113 Ca 0.32 -0.26 -0.05 0.00 0.82 0.00 0.00 66.70 67.52 1iqc h VAL 113 Cb -0.08 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1iqc h VAL 113 CO -0.06 0.07 0.03 0.58 0.02 0.00 0.00 177.57 178.20 1iqc h VAL 114 N -0.19 1.25 0.00 2.57 2.07 -1.18 -2.98 116.25 117.80 1iqc h VAL 114 Ca -0.01 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.58 1iqc h VAL 114 Cb 0.17 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1iqc h VAL 114 CO 0.01 0.31 -0.05 0.00 0.02 0.00 0.00 177.57 177.86 1iqc h ALA 115 N 0.88 1.16 0.00 1.67 0.00 -0.86 -2.77 119.26 119.34 1iqc h ALA 115 Ca 0.10 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1iqc h ALA 115 Cb 0.41 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1iqc h ALA 115 CO 0.01 0.06 -0.22 0.66 0.00 0.00 0.00 179.25 179.77 1iqc h SER 116 N 0.00 0.00 -3.61 0.00 4.64 -1.21 -3.42 113.55 109.95 1iqc h SER 116 Ca -0.00 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.67 1iqc h SER 116 Cb 0.25 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.19 1iqc h SER 116 CO 0.01 0.22 -0.06 -0.04 -0.87 0.00 0.00 176.83 176.08 1iqc s MET 117 N -4.22 3.64 0.31 4.77 -1.94 -1.04 -4.83 119.30 115.98 1iqc s MET 117 Ca -0.03 -0.15 0.07 0.00 -1.71 0.00 0.00 55.69 53.87 1iqc s MET 117 Cb 0.14 -3.80 0.81 0.00 2.01 0.00 0.00 34.83 33.99 1iqc s MET 117 CO 0.65 -0.62 1.71 -1.35 -0.01 0.00 0.00 175.02 175.40 1iqc h PRO 118 N 8.44 0.47 -0.44 2.03 0.11 -1.87 -0.74 132.00 140.00 1iqc h PRO 118 Ca -0.28 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.86 1iqc h PRO 118 Cb 1.13 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 32.08 1iqc h PRO 118 CO 0.77 0.31 0.15 1.96 -0.21 0.00 0.00 178.00 180.98 1iqc h GLN 119 N 0.48 0.31 -0.54 1.05 7.50 -1.94 -0.30 115.11 121.67 1iqc h GLN 119 Ca 0.61 -0.02 -0.06 0.00 0.50 0.00 0.00 58.65 59.68 1iqc h GLN 119 Cb 1.16 -0.07 -0.02 0.00 0.05 0.00 0.00 27.48 28.60 1iqc h GLN 119 CO -0.51 0.20 0.11 1.88 -1.50 0.00 0.00 178.83 179.02 1iqc h TYR 120 N 0.32 0.93 -0.88 2.96 0.99 -1.43 -2.48 116.97 117.39 1iqc h TYR 120 Ca 0.21 -0.12 0.07 0.00 2.00 0.00 0.00 58.73 60.89 1iqc h TYR 120 Cb 0.20 -0.26 -0.06 0.00 1.00 0.00 0.00 36.73 37.62 1iqc h TYR 120 CO -0.16 0.82 0.57 0.00 -0.00 0.00 0.00 178.16 179.39 1iqc h ARG 121 N 0.77 0.94 0.35 4.88 3.08 -0.78 -0.92 114.38 122.71 1iqc h ARG 121 Ca 0.17 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 1iqc h ARG 121 Cb 0.37 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 1iqc h ARG 121 CO 0.01 0.62 -0.22 1.49 -1.07 0.00 0.00 179.97 180.80 1iqc h GLU 122 N 0.97 -0.52 -0.22 0.04 4.22 -0.63 -1.51 114.58 116.92 1iqc h GLU 122 Ca 0.38 0.04 0.01 0.00 0.08 0.00 0.00 59.36 59.86 1iqc h GLU 122 Cb 0.23 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1iqc h GLU 122 CO -0.14 -0.35 0.13 0.00 -2.18 0.00 0.00 179.01 176.47 1iqc h ARG 123 N -0.54 0.27 -0.68 1.92 3.08 -1.08 -0.00 114.38 117.35 1iqc h ARG 123 Ca -0.04 -0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.09 1iqc h ARG 123 Cb 0.45 -0.06 -0.07 0.00 0.08 0.00 0.00 29.97 30.37 1iqc h ARG 123 CO 0.04 0.18 0.32 0.74 -1.07 0.00 0.00 179.97 180.18 1iqc h PHE 124 N 0.28 0.57 -0.26 3.04 -1.00 -1.10 0.58 116.94 119.05 1iqc h PHE 124 Ca 0.08 0.03 -0.06 0.00 2.81 0.00 0.00 57.97 60.83 1iqc h PHE 124 Cb -0.02 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 39.37 1iqc h PHE 124 CO -0.07 0.20 -0.10 -0.22 -1.61 0.00 0.00 178.31 176.51 1iqc h LYS 125 N 0.55 0.42 -0.08 1.51 3.64 -0.83 0.58 116.57 122.37 1iqc h LYS 125 Ca 0.33 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.58 1iqc h LYS 125 Cb 0.35 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1iqc h LYS 125 CO -0.27 0.53 -0.04 -0.22 -2.27 0.00 0.00 179.45 177.18 1iqc h LYS 126 N 0.40 0.16 0.13 1.90 1.63 0.11 0.06 116.57 120.98 1iqc h LYS 126 Ca 0.08 -0.08 -0.29 0.00 -0.85 0.00 0.00 60.65 59.52 1iqc h LYS 126 Cb 0.42 -0.00 0.02 0.00 -0.60 0.00 0.00 32.23 32.07 1iqc h LYS 126 CO 0.02 0.55 -1.25 0.28 -3.45 0.00 0.00 179.45 175.60 1iqc h VAL 127 N -0.22 1.38 0.00 2.00 2.07 0.23 -3.39 116.25 118.32 1iqc h VAL 127 Ca 0.02 -2.73 0.00 0.00 0.82 0.00 0.00 66.70 64.80 1iqc h VAL 127 Cb 0.50 2.82 0.00 0.00 -1.52 0.00 0.00 31.29 33.09 1iqc h VAL 127 CO 0.01 0.81 -0.70 0.49 0.02 0.00 0.00 177.57 178.21 1iqc n PHE 128 N -3.67 0.00 0.00 1.57 3.01 0.20 -5.00 117.46 113.57 1iqc n PHE 128 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.35 1iqc n PHE 128 Cb 1.00 -0.05 0.00 0.00 -0.01 0.00 0.00 39.48 40.42 1iqc n PHE 128 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1iqc n GLY 129 N 1.38 2.32 3.26 1.37 0.00 0.01 -5.00 105.19 108.52 1iqc n GLY 129 Ca 0.01 -0.43 -0.18 0.00 0.00 0.00 0.00 46.02 45.43 1iqc n GLY 129 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1iqc s SER 130 N 0.02 2.05 0.00 1.61 1.04 -1.25 -4.86 113.70 112.31 1iqc s SER 130 Ca 0.00 -0.86 0.00 0.00 0.48 0.00 0.00 55.95 55.57 1iqc s SER 130 Cb 0.00 -0.07 0.00 0.00 0.10 0.00 0.00 66.02 66.05 1iqc s SER 130 CO 0.00 -0.17 0.88 -0.90 0.98 0.00 0.00 173.24 174.03 1iqc n ASP 131 N 0.34 0.24 -4.77 7.02 3.85 -1.26 -2.30 116.55 119.67 1iqc n ASP 131 Ca -0.14 -1.99 -0.40 0.00 -0.71 0.00 0.00 54.79 51.55 1iqc n ASP 131 Cb 0.58 -0.12 -0.03 0.00 -1.35 0.00 0.00 41.12 40.21 1iqc n ASP 131 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 1iqc s GLU 132 N -1.76 4.35 -0.17 0.11 2.12 -1.26 -4.75 118.70 117.33 1iqc s GLU 132 Ca 0.00 2.04 -0.02 0.00 0.36 0.00 0.00 54.97 57.36 1iqc s GLU 132 Cb 0.00 -3.01 -0.01 0.00 0.26 0.00 0.00 34.13 31.37 1iqc s GLU 132 CO 0.00 -0.13 -0.10 0.08 -0.54 0.00 0.00 175.26 174.57 1iqc s VAL 133 N -1.20 3.15 0.10 3.70 1.01 -1.26 -4.86 120.40 121.03 1iqc s VAL 133 Ca 0.50 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.90 1iqc s VAL 133 Cb -0.36 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 1iqc s VAL 133 CO 0.47 0.49 -0.07 0.42 0.00 0.00 0.00 175.10 176.41 1iqc s THR 134 N 0.85 0.70 0.39 3.92 -4.23 -1.26 -4.93 115.64 111.08 1iqc s THR 134 Ca -0.03 -1.88 0.13 0.00 -1.18 0.00 0.00 61.69 58.73 1iqc s THR 134 Cb -0.15 -1.61 0.12 0.00 1.34 0.00 0.00 72.50 72.20 1iqc s THR 134 CO 0.01 -0.83 1.88 -0.29 -0.54 0.00 0.00 174.62 174.84 1iqc h ILE 135 N 3.07 1.23 -0.26 2.99 6.09 -1.99 -1.32 117.51 127.32 1iqc h ILE 135 Ca -0.35 -1.08 -0.00 0.00 -1.37 0.00 0.00 64.86 62.05 1iqc h ILE 135 Cb 1.17 1.59 -0.01 0.00 0.47 0.00 0.00 36.82 40.03 1iqc h ILE 135 CO 0.63 0.31 0.16 -0.78 -3.07 0.00 0.00 178.15 175.40 1iqc h ASP 136 N 0.00 0.30 -0.04 2.19 3.58 -1.99 0.05 116.42 120.52 1iqc h ASP 136 Ca -0.00 -0.04 -0.12 0.00 0.42 0.00 0.00 57.03 57.29 1iqc h ASP 136 Cb 0.56 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.52 1iqc h ASP 136 CO 0.04 0.25 -0.37 0.03 -2.88 0.00 0.00 179.24 176.31 1iqc h ARG 137 N 0.33 0.54 -0.24 0.28 3.08 -1.86 -1.20 114.38 115.30 1iqc h ARG 137 Ca 0.09 -0.26 -0.03 0.00 0.07 0.00 0.00 59.98 59.86 1iqc h ARG 137 Cb -0.00 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 1iqc h ARG 137 CO -0.02 0.83 0.05 0.82 -1.07 0.00 0.00 179.97 180.57 1iqc h ILE 138 N 0.45 1.22 -0.16 2.04 2.04 -0.93 -1.34 117.51 120.84 1iqc h ILE 138 Ca 0.05 -0.74 -0.12 0.00 1.00 0.00 0.00 64.86 65.04 1iqc h ILE 138 Cb 0.85 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 38.16 1iqc h ILE 138 CO 0.07 0.24 -0.43 0.71 0.00 0.00 0.00 178.15 178.73 1iqc h THR 139 N 0.21 1.31 -0.20 -0.27 1.35 -0.94 -1.22 112.91 113.16 1iqc h THR 139 Ca 0.07 -1.60 -0.01 0.00 -0.55 0.00 0.00 66.41 64.32 1iqc h THR 139 Cb 0.31 1.67 -0.01 0.00 -1.73 0.00 0.00 68.15 68.39 1iqc h THR 139 CO 0.00 0.49 0.09 0.74 -0.25 0.00 0.00 175.52 176.59 1iqc h THR 140 N 0.32 1.14 -0.34 6.82 2.02 -1.08 0.15 112.91 121.95 1iqc h THR 140 Ca 0.02 -0.42 -0.02 0.00 0.77 0.00 0.00 66.41 66.76 1iqc h THR 140 Cb 0.89 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 68.35 1iqc h THR 140 CO 0.07 0.14 0.14 0.00 0.37 0.00 0.00 175.52 176.25 1iqc h ALA 141 N 0.94 0.44 -0.75 6.16 0.00 -1.09 -0.93 119.26 124.02 1iqc h ALA 141 Ca 0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1iqc h ALA 141 Cb 0.14 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1iqc h ALA 141 CO -0.01 0.03 0.39 0.82 0.00 0.00 0.00 179.25 180.48 1iqc h ILE 142 N 0.40 1.23 -0.17 0.00 2.04 -1.08 -1.51 117.51 118.42 1iqc h ILE 142 Ca 0.11 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 1iqc h ILE 142 Cb 0.17 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 1iqc h ILE 142 CO -0.01 0.26 0.06 0.00 0.00 0.00 0.00 178.15 178.46 1iqc h ALA 143 N 1.37 0.22 -0.71 1.87 0.00 -0.64 -1.04 119.26 120.33 1iqc h ALA 143 Ca 0.26 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.15 1iqc h ALA 143 Cb 0.06 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 1iqc h ALA 143 CO -0.04 -0.17 0.34 0.37 0.00 0.00 0.00 179.25 179.75 1iqc h GLN 144 N 0.10 0.55 -0.42 0.00 5.75 -0.71 -0.65 115.11 119.73 1iqc h GLN 144 Ca 0.05 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.52 1iqc h GLN 144 Cb 0.21 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 1iqc h GLN 144 CO -0.00 0.37 0.24 0.35 -2.65 0.00 0.00 178.83 177.14 1iqc h PHE 145 N 0.57 0.57 0.00 3.99 3.57 -0.95 -2.44 116.94 122.26 1iqc h PHE 145 Ca 0.36 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.82 1iqc h PHE 145 Cb 0.41 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 38.96 1iqc h PHE 145 CO -0.12 0.43 -0.13 0.93 -2.23 0.00 0.00 178.31 177.19 1iqc h GLU 146 N 0.55 0.00 0.00 1.11 5.08 -0.03 -1.31 114.58 119.99 1iqc h GLU 146 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1iqc h GLU 146 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1iqc h GLU 146 CO -0.03 0.13 0.00 0.93 -1.00 0.00 0.00 179.01 179.05 1iqc h GLU 147 N 0.00 0.00 -0.01 2.33 4.39 -0.65 -0.34 114.58 120.30 1iqc h GLU 147 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1iqc h GLU 147 Cb 0.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1iqc h GLU 147 CO 0.02 0.00 -0.25 0.25 -1.16 0.00 0.00 179.01 177.86 1iqc n THR 148 N -2.99 0.00 -0.92 1.13 -2.24 -0.50 -4.48 114.28 104.29 1iqc n THR 148 Ca -0.01 -0.23 -0.14 0.00 -2.27 0.00 0.00 64.05 61.39 1iqc n THR 148 Cb 0.15 0.81 -0.01 0.00 -2.10 0.00 0.00 70.33 69.18 1iqc n THR 148 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1iqc n LEU 149 N -0.08 6.06 -4.93 3.22 4.77 -0.14 -4.87 117.00 121.04 1iqc n LEU 149 Ca 0.13 -3.21 -0.25 0.00 -0.03 0.00 0.00 56.01 52.64 1iqc n LEU 149 Cb 0.42 -1.15 -0.01 0.00 -2.33 0.00 0.00 43.42 40.35 1iqc n LEU 149 CO 0.24 1.32 0.28 0.68 -1.33 0.00 0.00 177.39 178.58 1iqc s VAL 150 N -1.35 5.03 -0.61 4.08 -7.23 -1.26 -1.45 120.40 117.60 1iqc s VAL 150 Ca 0.33 -0.19 0.06 0.00 -1.81 0.00 0.00 61.98 60.37 1iqc s VAL 150 Cb 0.22 -3.86 0.23 0.00 0.56 0.00 0.00 36.38 33.53 1iqc s VAL 150 CO -0.04 -0.65 0.64 0.35 -0.31 0.00 0.00 175.10 175.08 1iqc n THR 151 N -1.91 1.58 -1.44 5.32 -2.24 -1.26 -4.84 114.28 109.49 1iqc n THR 151 Ca -0.03 -4.88 -0.29 0.00 -2.27 0.00 0.00 64.05 56.58 1iqc n THR 151 Cb 0.56 -2.08 0.17 0.00 -2.10 0.00 0.00 70.33 66.88 1iqc n THR 151 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1iqc s PRO 152 N -1.93 0.46 0.00 -0.78 0.04 -1.26 -3.93 135.00 127.60 1iqc s PRO 152 Ca 0.35 0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.54 1iqc s PRO 152 Cb 0.10 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.87 1iqc s PRO 152 CO -0.07 -2.63 0.00 0.41 0.04 0.00 0.00 177.00 174.75 1iqc n GLY 153 N -2.00 0.66 3.75 0.56 0.00 -1.26 -0.72 105.19 106.17 1iqc n GLY 153 Ca 0.09 -0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1iqc n GLY 153 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1iqc s SER 154 N -2.05 4.16 0.15 1.61 1.04 -1.26 -4.56 113.70 112.80 1iqc s SER 154 Ca 0.00 1.82 -0.16 0.00 0.48 0.00 0.00 55.95 58.08 1iqc s SER 154 Cb 0.00 -2.48 0.01 0.00 0.10 0.00 0.00 66.02 63.66 1iqc s SER 154 CO 0.00 -2.25 1.80 0.11 0.98 0.00 0.00 173.24 173.88 1iqc h LYS 155 N -1.28 0.46 -0.57 4.02 1.57 -1.71 -1.57 116.57 117.49 1iqc h LYS 155 Ca -0.44 -0.03 0.10 0.00 -1.87 0.00 0.00 60.65 58.41 1iqc h LYS 155 Cb 1.24 -0.10 -0.08 0.00 0.08 0.00 0.00 32.23 33.37 1iqc h LYS 155 CO 0.51 0.31 0.15 0.35 -0.57 0.00 0.00 179.45 180.19 1iqc h PHE 156 N 0.48 0.25 -0.23 -1.35 3.57 -1.66 0.16 116.94 118.16 1iqc h PHE 156 Ca 0.14 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 1iqc h PHE 156 Cb -0.03 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 1iqc h PHE 156 CO -0.06 0.02 -0.08 -0.44 -2.23 0.00 0.00 178.31 175.52 1iqc h ASP 157 N 0.30 0.33 -0.55 0.41 3.45 -1.72 0.28 116.42 118.92 1iqc h ASP 157 Ca 0.29 -0.07 -0.06 0.00 0.43 0.00 0.00 57.03 57.63 1iqc h ASP 157 Cb 0.40 -0.09 -0.02 0.00 -0.56 0.00 0.00 39.33 39.06 1iqc h ASP 157 CO -0.35 0.46 0.13 0.11 -1.57 0.00 0.00 179.24 178.01 1iqc h LYS 158 N 0.34 0.90 0.61 3.56 1.57 0.14 0.15 116.57 123.83 1iqc h LYS 158 Ca 0.07 -0.22 -0.03 0.00 -1.87 0.00 0.00 60.65 58.60 1iqc h LYS 158 Cb 0.36 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.56 1iqc h LYS 158 CO 0.02 0.84 -0.29 2.35 -0.57 0.00 0.00 179.45 181.80 1iqc h TRP 159 N 0.79 -0.76 -0.95 -1.35 7.01 0.23 -2.76 115.95 118.16 1iqc h TRP 159 Ca 0.17 -0.02 0.24 0.00 2.11 0.00 0.00 58.89 61.40 1iqc h TRP 159 Cb 0.36 0.25 -0.06 0.00 -2.10 0.00 0.00 29.16 27.61 1iqc h TRP 159 CO 0.03 -0.43 0.65 -0.07 -2.79 0.00 0.00 178.44 175.82 1iqc h LEU 160 N -0.94 0.28 -1.58 0.65 3.38 -0.32 0.44 115.31 117.22 1iqc h LEU 160 Ca -0.08 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1iqc h LEU 160 Cb 0.67 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1iqc h LEU 160 CO 0.14 0.09 0.00 -0.62 0.09 0.00 0.00 178.44 178.14 1iqc n GLU 161 N -4.45 2.12 -0.49 1.13 1.02 0.03 -4.89 120.64 115.10 1iqc n GLU 161 Ca 0.21 -1.06 0.00 0.00 -0.02 0.00 0.00 57.16 56.29 1iqc n GLU 161 Cb 0.85 -1.57 0.00 0.00 -0.02 0.00 0.00 31.44 30.69 1iqc n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1iqc n GLY 162 N 0.47 -0.30 2.65 0.62 0.00 0.15 -5.04 105.19 103.74 1iqc n GLY 162 Ca 0.09 -0.52 -0.04 0.00 0.00 0.00 0.00 46.02 45.56 1iqc n GLY 162 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1iqc n ASP 163 N -0.09 -1.06 0.28 1.61 2.03 -1.04 -4.87 116.55 113.40 1iqc n ASP 163 Ca 0.00 -1.12 0.17 0.00 0.52 0.00 0.00 54.79 54.36 1iqc n ASP 163 Cb 0.00 0.53 0.85 0.00 -0.72 0.00 0.00 41.12 41.79 1iqc n ASP 163 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 1iqc h LYS 164 N 3.46 0.00 -0.00 -0.67 3.64 -1.90 0.64 116.57 121.74 1iqc h LYS 164 Ca -0.15 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1iqc h LYS 164 Cb 1.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1iqc h LYS 164 CO -0.21 0.00 -0.04 0.09 -2.27 0.00 0.00 179.45 177.02 1iqc n ASN 165 N -3.14 0.14 0.18 4.20 5.03 -1.26 -3.27 115.26 117.14 1iqc n ASN 165 Ca -0.00 -0.27 0.06 0.00 0.87 0.00 0.00 54.58 55.24 1iqc n ASN 165 Cb 0.38 -0.22 0.26 0.00 -1.02 0.00 0.00 39.78 39.19 1iqc n ASN 165 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1iqc h ALA 166 N 3.47 0.89 -3.35 5.41 0.00 -0.05 -3.44 119.26 122.20 1iqc h ALA 166 Ca 0.00 -0.34 -0.66 0.00 0.00 0.00 0.00 54.91 53.91 1iqc h ALA 166 Cb 0.31 -0.06 -0.19 0.00 0.00 0.00 0.00 17.79 17.85 1iqc h ALA 166 CO 0.00 0.47 -0.82 -0.51 0.00 0.00 0.00 179.25 178.39 1iqc s LEU 167 N -6.79 2.50 0.53 0.00 1.43 -1.20 -4.81 118.68 110.34 1iqc s LEU 167 Ca 0.01 -0.78 0.07 0.00 -1.03 0.00 0.00 54.13 52.40 1iqc s LEU 167 Cb 0.10 -1.27 0.04 0.00 0.03 0.00 0.00 46.19 45.09 1iqc s LEU 167 CO 0.69 0.13 0.52 0.54 0.23 0.00 0.00 176.35 178.47 1iqc s ASN 168 N -2.53 4.86 0.08 2.29 2.20 -1.26 -4.86 114.94 115.72 1iqc s ASN 168 Ca 0.20 -1.03 -0.17 0.00 -0.94 0.00 0.00 52.86 50.92 1iqc s ASN 168 Cb -0.09 0.20 -0.05 0.00 -2.00 0.00 0.00 41.25 39.32 1iqc s ASN 168 CO 0.10 -1.10 1.29 -0.61 -2.94 0.00 0.00 177.10 173.83 1iqc h GLN 169 N 0.61 -0.08 -0.58 3.55 5.75 -1.99 0.38 115.11 122.75 1iqc h GLN 169 Ca -0.35 0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.12 1iqc h GLN 169 Cb 1.29 0.02 -0.03 0.00 1.07 0.00 0.00 27.48 29.83 1iqc h GLN 169 CO 0.52 -0.05 0.22 -0.44 -2.65 0.00 0.00 178.83 176.42 1iqc h ASP 170 N -0.08 0.78 0.21 -0.69 3.32 -1.96 -1.45 116.42 116.55 1iqc h ASP 170 Ca 0.07 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 1iqc h ASP 170 Cb 0.25 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.60 1iqc h ASP 170 CO -0.42 0.72 -0.10 -0.33 -1.72 0.00 0.00 179.24 177.38 1iqc h GLU 171 N 0.84 -0.27 -0.22 3.56 5.08 -1.67 0.21 114.58 122.11 1iqc h GLU 171 Ca 0.20 0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.53 1iqc h GLU 171 Cb 0.19 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1iqc h GLU 171 CO -0.02 -0.05 -0.07 1.25 -1.00 0.00 0.00 179.01 179.13 1iqc h LEU 172 N -0.46 0.32 -0.49 1.33 5.85 -0.90 -2.31 115.31 118.64 1iqc h LEU 172 Ca -0.03 -0.06 -0.16 0.00 0.84 0.00 0.00 57.88 58.47 1iqc h LEU 172 Cb 0.35 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1iqc h LEU 172 CO 0.05 0.43 -0.52 -0.08 -0.34 0.00 0.00 178.44 177.98 1iqc h GLU 173 N 0.32 0.65 -0.30 1.25 4.81 -1.04 -2.87 114.58 117.41 1iqc h GLU 173 Ca 0.07 -0.39 -0.06 0.00 -0.13 0.00 0.00 59.36 58.85 1iqc h GLU 173 Cb 0.33 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1iqc h GLU 173 CO 0.02 1.01 -0.07 0.78 -0.73 0.00 0.00 179.01 180.01 1iqc h GLY 174 N 0.97 0.51 1.46 1.92 0.00 -0.06 -2.19 103.07 105.68 1iqc h GLY 174 Ca 0.02 -0.33 -0.10 0.00 0.00 0.00 0.00 47.33 46.92 1iqc h GLY 174 CO 0.10 0.30 -0.19 -1.82 0.00 0.00 0.00 176.54 174.94 1iqc h TYR 175 N 0.45 0.71 0.00 5.60 3.20 -1.30 0.12 116.97 125.74 1iqc h TYR 175 Ca 0.09 -0.14 -0.11 0.00 3.14 0.00 0.00 58.73 61.71 1iqc h TYR 175 Cb 0.41 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 1iqc h TYR 175 CO 0.01 0.78 -0.50 -0.91 -1.64 0.00 0.00 178.16 175.91 1iqc h ASN 176 N 0.57 0.00 0.68 -2.11 -0.26 -1.24 -2.02 115.58 111.20 1iqc h ASN 176 Ca 0.09 0.00 -0.23 0.00 -0.56 0.00 0.00 56.30 55.60 1iqc h ASN 176 Cb 0.64 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.89 1iqc h ASN 176 CO 0.05 0.50 -1.03 0.25 -1.06 0.00 0.00 177.43 176.14 1iqc h LEU 177 N 0.00 0.27 0.85 1.61 6.46 -0.95 -1.14 115.31 122.40 1iqc h LEU 177 Ca -0.01 -0.25 -0.04 0.00 -0.12 0.00 0.00 57.88 57.46 1iqc h LEU 177 Cb 0.96 -0.08 0.01 0.00 -0.73 0.00 0.00 40.66 40.81 1iqc h LEU 177 CO 0.07 1.13 -0.44 0.15 -0.62 0.00 0.00 178.44 178.73 1iqc h PHE 178 N 0.08 -1.14 0.68 1.25 3.04 -0.37 -0.72 116.94 119.76 1iqc h PHE 178 Ca -0.07 -0.02 -0.03 0.00 3.98 0.00 0.00 57.97 61.83 1iqc h PHE 178 Cb 1.72 0.38 0.01 0.00 2.56 0.00 0.00 35.95 40.62 1iqc h PHE 178 CO 0.04 -0.69 -0.32 0.87 -2.02 0.00 0.00 178.31 176.18 1iqc h LYS 179 N -1.18 -0.87 -1.21 1.11 1.57 -1.45 -1.77 116.57 112.77 1iqc h LYS 179 Ca -0.11 0.06 0.36 0.00 -1.87 0.00 0.00 60.65 59.08 1iqc h LYS 179 Cb 0.91 0.20 -0.10 0.00 0.08 0.00 0.00 32.23 33.32 1iqc h LYS 179 CO 0.17 -0.58 0.80 0.78 -0.57 0.00 0.00 179.45 180.05 1iqc h GLY 180 N -0.98 1.03 2.00 3.86 0.00 -1.27 0.32 103.07 108.04 1iqc h GLY 180 Ca -0.09 -0.13 -0.11 0.00 0.00 0.00 0.00 47.33 47.00 1iqc h GLY 180 CO 0.15 -0.22 -0.52 1.76 0.00 0.00 0.00 176.54 177.72 1iqc h SER 181 N 0.20 0.00 0.00 0.19 0.02 -1.07 -3.47 113.55 109.42 1iqc h SER 181 Ca 0.69 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.64 1iqc h SER 181 Cb 2.13 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.67 1iqc h SER 181 CO -0.29 0.52 0.00 0.61 -1.14 0.00 0.00 176.83 176.52 1iqc n GLY 182 N 0.53 1.29 0.24 -3.77 0.00 0.11 -5.00 105.19 98.58 1iqc n GLY 182 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 1iqc n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iqc n VAL 184 N -4.70 1.01 -0.15 0.00 0.24 -1.25 -1.53 118.33 111.95 1iqc n VAL 184 Ca 0.04 0.25 -0.04 0.00 -2.04 0.00 0.00 64.34 62.56 1iqc n VAL 184 Cb 0.03 -1.25 0.16 0.00 -1.47 0.00 0.00 33.84 31.31 1iqc n VAL 184 CO 0.00 0.00 0.00 -0.61 -2.14 0.00 0.00 176.83 174.08 1iqc h GLN 185 N 0.00 0.89 0.00 7.34 4.15 -1.69 -3.36 115.11 122.44 1iqc h GLN 185 Ca 0.00 -0.19 -0.02 0.00 0.77 0.00 0.00 58.65 59.21 1iqc h GLN 185 Cb 0.00 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 27.56 1iqc h GLN 185 CO 0.00 0.80 -1.09 0.00 -1.93 0.00 0.00 178.83 176.61 1iqc s HIS 187 N -2.03 3.46 0.20 0.00 3.76 -0.58 -4.39 115.29 115.71 1iqc s HIS 187 Ca -0.01 -1.81 -0.04 0.00 -0.15 0.00 0.00 55.06 53.05 1iqc s HIS 187 Cb 0.00 -3.66 0.02 0.00 1.11 0.00 0.00 32.58 30.05 1iqc s HIS 187 CO 0.05 -0.99 0.34 0.27 -0.85 0.00 0.00 174.74 173.56 1iqc n ASN 188 N 4.61 -0.96 -0.23 1.40 0.23 -1.26 -3.95 115.26 115.10 1iqc n ASN 188 Ca -0.02 -1.96 0.01 0.00 -0.53 0.00 0.00 54.58 52.08 1iqc n ASN 188 Cb 0.42 1.68 -0.00 0.00 -2.08 0.00 0.00 39.78 39.80 1iqc n ASN 188 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1iqc n GLY 189 N -0.30 -1.94 0.28 4.83 0.00 -0.17 -1.23 105.19 106.66 1iqc n GLY 189 Ca -0.02 -1.37 0.04 0.00 0.00 0.00 0.00 46.02 44.68 1iqc n GLY 189 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1iqc h PRO 190 N 0.00 0.54 -0.01 1.61 0.11 -1.88 -2.02 132.00 130.35 1iqc h PRO 190 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1iqc h PRO 190 Cb 0.06 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.05 1iqc h PRO 190 CO 0.00 0.36 -0.18 0.00 -0.21 0.00 0.00 178.00 177.97 1iqc n ALA 191 N -2.45 2.93 -3.59 -0.75 0.00 -1.26 -4.75 120.51 110.64 1iqc n ALA 191 Ca 0.14 -0.43 -0.21 0.00 0.00 0.00 0.00 53.44 52.94 1iqc n ALA 191 Cb 0.36 -1.12 0.06 0.00 0.00 0.00 0.00 19.45 18.76 1iqc n ALA 191 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1iqc n VAL 192 N -0.32 -4.70 0.00 0.00 0.31 -0.76 -2.93 118.33 109.93 1iqc n VAL 192 Ca 0.14 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1iqc n VAL 192 Cb 0.36 -4.23 0.00 0.00 -0.91 0.00 0.00 33.84 29.06 1iqc n VAL 192 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1iqc n GLY 193 N -1.46 0.84 2.45 2.92 0.00 -0.37 -3.06 105.19 106.52 1iqc n GLY 193 Ca -0.22 -1.99 -0.11 0.00 0.00 0.00 0.00 46.02 43.70 1iqc n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iqc n GLY 194 N 0.00 1.18 0.51 -0.02 0.00 0.28 -4.74 105.19 102.40 1iqc n GLY 194 Ca 0.00 -0.30 0.05 0.00 0.00 0.00 0.00 46.02 45.77 1iqc n GLY 194 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1iqc n SER 195 N -0.30 2.36 -3.38 1.61 3.41 -1.26 -1.53 113.62 114.54 1iqc n SER 195 Ca -0.11 -1.72 -0.04 0.00 -0.26 0.00 0.00 58.87 56.75 1iqc n SER 195 Cb 0.42 -0.11 0.01 0.00 -0.26 0.00 0.00 64.21 64.28 1iqc n SER 195 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1iqc s SER 196 N -0.93 -0.02 -0.12 4.04 1.04 -1.26 -4.85 113.70 111.59 1iqc s SER 196 Ca 0.17 -0.68 -0.01 0.00 0.48 0.00 0.00 55.95 55.91 1iqc s SER 196 Cb 0.10 0.53 -0.02 0.00 0.10 0.00 0.00 66.02 66.73 1iqc s SER 196 CO 0.14 -1.04 -0.08 -0.31 0.98 0.00 0.00 173.24 172.92 1iqc s TYR 197 N -2.34 2.91 0.03 5.02 1.51 -1.26 -0.88 117.35 122.34 1iqc s TYR 197 Ca 0.20 -0.35 0.01 0.00 -1.01 0.00 0.00 57.07 55.92 1iqc s TYR 197 Cb -0.03 -1.85 -0.02 0.00 -0.11 0.00 0.00 41.96 39.95 1iqc s TYR 197 CO 0.05 -0.01 -0.06 -0.65 -1.11 0.00 0.00 175.55 173.77 1iqc s GLN 198 N 0.06 0.45 0.15 -0.62 -1.52 0.82 -4.87 119.66 114.14 1iqc s GLN 198 Ca -0.03 -0.71 -0.31 0.00 -1.95 0.00 0.00 55.36 52.36 1iqc s GLN 198 Cb -0.14 -0.16 -0.10 0.00 -0.22 0.00 0.00 33.01 32.39 1iqc s GLN 198 CO 0.03 0.02 1.60 0.21 -0.25 0.00 0.00 175.29 176.90 1iqc s LYS 199 N -1.54 4.21 -0.57 2.91 2.47 -1.26 -1.12 119.74 124.84 1iqc s LYS 199 Ca -0.12 2.37 -0.22 0.00 -1.56 0.00 0.00 55.97 56.45 1iqc s LYS 199 Cb -0.10 -3.24 0.06 0.00 -1.46 0.00 0.00 37.83 33.09 1iqc s LYS 199 CO -0.00 -0.64 0.84 1.41 0.16 0.00 0.00 175.35 177.12 1iqc s MET 200 N 1.45 3.19 0.00 4.03 -2.45 0.03 -4.13 119.30 121.43 1iqc s MET 200 Ca 0.71 -0.66 0.00 0.00 -1.25 0.00 0.00 55.69 54.49 1iqc s MET 200 Cb -0.43 -4.12 0.00 0.00 1.25 0.00 0.00 34.83 31.52 1iqc s MET 200 CO 0.32 -1.50 0.00 0.41 1.05 0.00 0.00 175.02 175.30 1iqc n GLY 201 N 5.20 0.76 0.27 2.11 0.00 -1.26 -4.13 105.19 108.14 1iqc n GLY 201 Ca -0.03 -0.78 -0.15 0.00 0.00 0.00 0.00 46.02 45.05 1iqc n GLY 201 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1iqc h VAL 202 N 0.00 0.51 0.00 1.61 2.07 -1.17 -3.35 116.25 115.92 1iqc h VAL 202 Ca 0.00 -0.25 -0.20 0.00 0.82 0.00 0.00 66.70 67.07 1iqc h VAL 202 Cb 0.00 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 1iqc h VAL 202 CO 0.00 0.04 -1.87 0.49 0.02 0.00 0.00 177.57 176.25 1iqc n PHE 203 N -5.30 0.44 -3.85 1.57 3.01 0.03 -4.93 117.46 108.42 1iqc n PHE 203 Ca -0.11 0.15 -0.13 0.00 1.01 0.00 0.00 57.45 58.37 1iqc n PHE 203 Cb 0.29 -0.93 -0.14 0.00 -0.01 0.00 0.00 39.48 38.69 1iqc n PHE 203 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1iqc s LYS 204 N -2.91 -0.00 0.48 -1.08 1.02 -1.24 -5.07 119.74 110.94 1iqc s LYS 204 Ca -0.06 0.04 -0.23 0.00 0.02 0.00 0.00 55.97 55.73 1iqc s LYS 204 Cb 0.09 -0.04 -0.07 0.00 -0.52 0.00 0.00 37.83 37.29 1iqc s LYS 204 CO 0.84 -0.03 1.27 -1.25 -0.92 0.00 0.00 175.35 175.26 1iqc s PRO 205 N 0.20 3.56 -0.16 -1.68 0.04 -1.26 -4.20 135.00 131.49 1iqc s PRO 205 Ca -0.02 2.03 -0.29 0.00 0.04 0.00 0.00 61.00 62.76 1iqc s PRO 205 Cb -0.02 -2.42 -0.00 0.00 0.04 0.00 0.00 34.50 32.10 1iqc s PRO 205 CO -0.01 -0.79 1.03 -0.47 0.04 0.00 0.00 177.00 176.80 1iqc s TYR 206 N -1.40 3.42 -0.22 0.56 6.04 -1.26 -4.97 117.35 119.53 1iqc s TYR 206 Ca 0.65 1.53 -0.29 0.00 0.04 0.00 0.00 57.07 59.00 1iqc s TYR 206 Cb -0.35 -3.23 -0.01 0.00 -1.04 0.00 0.00 41.96 37.33 1iqc s TYR 206 CO 0.43 -0.37 1.32 -1.21 -1.54 0.00 0.00 175.55 174.18 1iqc s GLU 207 N 2.57 4.06 -0.04 4.97 8.01 -1.26 -4.99 118.70 132.02 1iqc s GLU 207 Ca 0.47 1.51 -0.30 0.00 0.01 0.00 0.00 54.97 56.65 1iqc s GLU 207 Cb -0.17 -3.84 0.07 0.00 -4.31 0.00 0.00 34.13 25.88 1iqc s GLU 207 CO 0.13 -0.94 0.70 -0.08 0.01 0.00 0.00 175.26 175.08 1iqc s THR 208 N 4.04 0.00 -0.70 3.63 -1.32 -1.26 -5.02 115.64 115.01 1iqc s THR 208 Ca 0.57 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 61.28 1iqc s THR 208 Cb -0.20 -1.00 -0.15 0.00 -1.51 0.00 0.00 72.50 69.64 1iqc s THR 208 CO 0.20 0.00 1.00 0.29 -2.21 0.00 0.00 174.62 173.89 1iqc n LYS 209 N 0.80 0.22 -2.03 7.08 4.76 -1.26 -4.90 118.16 122.82 1iqc n LYS 209 Ca -0.18 -0.02 -0.42 0.00 -2.87 0.00 0.00 58.31 54.82 1iqc n LYS 209 Cb 0.58 -1.55 -0.03 0.00 -1.84 0.00 0.00 35.03 32.18 1iqc n LYS 209 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1iqc s ASN 210 N -3.65 6.69 0.00 4.39 3.84 -1.26 -4.92 114.94 120.03 1iqc s ASN 210 Ca 0.05 2.38 0.23 0.00 0.21 0.00 0.00 52.86 55.72 1iqc s ASN 210 Cb 0.15 -2.57 1.08 0.00 -0.55 0.00 0.00 41.25 39.37 1iqc s ASN 210 CO 0.82 -0.82 1.73 -0.81 -2.79 0.00 0.00 177.10 175.23 1iqc n PRO 211 N 5.30 0.21 -1.65 0.43 -0.04 -1.26 -4.91 135.00 133.07 1iqc n PRO 211 Ca 0.15 0.09 -0.49 0.00 -0.04 0.00 0.00 63.50 63.21 1iqc n PRO 211 Cb 0.41 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.32 1iqc n PRO 211 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1iqc n ALA 212 N -1.36 0.53 1.02 0.55 0.00 -1.26 -4.88 120.51 115.11 1iqc n ALA 212 Ca 0.09 0.44 0.11 0.00 0.00 0.00 0.00 53.44 54.08 1iqc n ALA 212 Cb 0.21 -2.29 -0.00 0.00 0.00 0.00 0.00 19.45 17.37 1iqc n ALA 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iqc n ALA 213 N 3.78 3.79 -0.50 0.00 0.00 -1.26 -4.80 120.51 121.52 1iqc n ALA 213 Ca 0.19 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1iqc n ALA 213 Cb 0.25 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.89 1iqc n ALA 213 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iqc n GLY 214 N 1.43 1.17 0.60 0.00 0.00 -1.26 -0.92 105.19 106.21 1iqc n GLY 214 Ca 0.08 -0.73 0.42 0.00 0.00 0.00 0.00 46.02 45.80 1iqc n GLY 214 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1iqc h ARG 215 N 0.00 0.01 -0.12 1.61 9.65 -0.60 0.14 114.38 125.08 1iqc h ARG 215 Ca 0.00 -0.00 0.03 0.00 -1.10 0.00 0.00 59.98 58.91 1iqc h ARG 215 Cb 0.00 -0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.57 1iqc h ARG 215 CO 0.00 0.01 0.10 1.98 2.80 0.00 0.00 179.97 184.86 1iqc h MET 216 N 0.01 0.00 -0.17 0.20 4.05 -1.51 0.13 114.93 117.65 1iqc h MET 216 Ca 0.73 0.00 0.04 0.00 -0.28 0.00 0.00 59.70 60.19 1iqc h MET 216 Cb 2.87 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 33.67 1iqc h MET 216 CO -0.03 0.00 0.12 -0.44 0.23 0.00 0.00 176.91 176.78 1iqc h ASP 217 N 0.00 0.04 0.02 1.39 3.32 -0.97 0.38 116.42 120.60 1iqc h ASP 217 Ca 0.06 -0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.85 1iqc h ASP 217 Cb 0.25 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 1iqc h ASP 217 CO -0.00 0.03 -1.41 0.52 -1.72 0.00 0.00 179.24 176.65 1iqc n VAL 218 N -4.50 1.57 0.03 -1.35 0.31 0.38 -4.57 118.33 110.20 1iqc n VAL 218 Ca 0.01 -0.12 -0.07 0.00 -0.01 0.00 0.00 64.34 64.15 1iqc n VAL 218 Cb 0.22 -2.00 -0.12 0.00 -0.91 0.00 0.00 33.84 31.03 1iqc n VAL 218 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 1iqc h THR 219 N -0.86 1.26 0.00 2.52 1.35 -1.32 -3.48 112.91 112.38 1iqc h THR 219 Ca -0.38 -3.00 0.00 0.00 -0.55 0.00 0.00 66.41 62.48 1iqc h THR 219 Cb 1.41 2.61 0.00 0.00 -1.73 0.00 0.00 68.15 70.45 1iqc h THR 219 CO -0.18 0.72 0.00 0.61 -0.25 0.00 0.00 175.52 176.42 1iqc n GLY 220 N 1.43 1.58 3.73 5.82 0.00 0.13 -5.00 105.19 112.88 1iqc n GLY 220 Ca -0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 1iqc n GLY 220 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1iqc s ASN 221 N -3.28 6.95 0.29 1.61 0.01 -1.26 -4.97 114.94 114.28 1iqc s ASN 221 Ca 0.00 1.14 0.03 0.00 -0.71 0.00 0.00 52.86 53.32 1iqc s ASN 221 Cb 0.00 -2.38 0.69 0.00 0.41 0.00 0.00 41.25 39.97 1iqc s ASN 221 CO 0.00 -0.02 1.73 -0.08 -1.51 0.00 0.00 177.10 177.22 1iqc h GLU 222 N 6.30 0.50 0.00 -0.60 4.57 -1.95 0.60 114.58 124.01 1iqc h GLU 222 Ca -0.43 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 1iqc h GLU 222 Cb 1.20 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.67 1iqc h GLU 222 CO 0.73 0.33 0.00 0.00 -1.18 0.00 0.00 179.01 178.89 1iqc h ALA 223 N 1.66 1.00 -0.58 2.92 0.00 -2.02 -1.08 119.26 121.16 1iqc h ALA 223 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1iqc h ALA 223 Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1iqc h ALA 223 CO -0.46 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.54 1iqc n ASP 224 N -2.58 3.72 -4.75 0.00 8.00 0.20 -4.88 116.55 116.27 1iqc n ASP 224 Ca -0.02 -2.00 -0.41 0.00 0.71 0.00 0.00 54.79 53.08 1iqc n ASP 224 Cb 0.07 -0.38 -0.03 0.00 -0.02 0.00 0.00 41.12 40.77 1iqc n ASP 224 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1iqc s ARG 225 N -1.24 4.42 -1.81 -1.24 3.52 -0.41 -2.14 118.95 120.05 1iqc s ARG 225 Ca 0.44 2.05 0.00 0.00 -0.13 0.00 0.00 55.73 58.10 1iqc s ARG 225 Cb 0.24 -3.16 0.00 0.00 -1.56 0.00 0.00 34.95 30.47 1iqc s ARG 225 CO 0.33 -0.15 0.00 0.09 -0.81 0.00 0.00 175.30 174.76 1iqc n ASN 226 N 1.86 -5.12 -4.66 -2.12 5.03 -0.10 -4.90 115.26 105.26 1iqc n ASN 226 Ca 0.03 0.37 -0.35 0.00 0.87 0.00 0.00 54.58 55.50 1iqc n ASN 226 Cb 0.43 -4.18 -0.09 0.00 -1.02 0.00 0.00 39.78 34.92 1iqc n ASN 226 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1iqc s VAL 227 N -2.69 5.03 0.15 2.41 1.01 -0.99 -0.79 120.40 124.53 1iqc s VAL 227 Ca 0.00 0.05 0.05 0.00 0.00 0.00 0.00 61.98 62.08 1iqc s VAL 227 Cb 0.00 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.05 1iqc s VAL 227 CO 0.00 0.43 -0.11 -0.36 0.00 0.00 0.00 175.10 175.06 1iqc s PHE 228 N 0.53 1.31 0.31 5.22 0.40 -0.28 -0.08 117.98 125.40 1iqc s PHE 228 Ca 0.05 -0.74 -0.29 0.00 -0.60 0.00 0.00 56.93 55.36 1iqc s PHE 228 Cb -0.12 -0.66 -0.10 0.00 0.51 0.00 0.00 43.02 42.65 1iqc s PHE 228 CO 0.00 0.11 1.33 0.21 0.70 0.00 0.00 175.22 177.57 1iqc s LYS 229 N -3.72 4.35 -0.14 0.44 2.20 -0.55 -0.13 119.74 122.19 1iqc s LYS 229 Ca 0.17 2.22 -0.29 0.00 -0.36 0.00 0.00 55.97 57.70 1iqc s LYS 229 Cb 0.02 -3.08 -0.02 0.00 -1.51 0.00 0.00 37.83 33.24 1iqc s LYS 229 CO 0.01 -0.22 1.26 0.08 -0.36 0.00 0.00 175.35 176.12 1iqc s VAL 230 N -0.89 4.26 0.76 4.02 1.01 -0.06 -4.85 120.40 124.65 1iqc s VAL 230 Ca 0.51 1.54 -0.11 0.00 0.00 0.00 0.00 61.98 63.92 1iqc s VAL 230 Cb -0.40 -3.99 0.05 0.00 0.00 0.00 0.00 36.38 32.04 1iqc s VAL 230 CO 0.51 -0.11 1.09 -2.84 0.00 0.00 0.00 175.10 173.74 1iqc s PRO 231 N 3.29 2.31 0.42 2.72 0.02 -1.26 0.10 135.00 142.60 1iqc s PRO 231 Ca 0.55 1.17 -0.22 0.00 0.02 0.00 0.00 61.00 62.52 1iqc s PRO 231 Cb -0.22 -1.90 -0.11 0.00 0.02 0.00 0.00 34.50 32.29 1iqc s PRO 231 CO 0.16 -1.61 0.96 -0.08 -0.33 0.00 0.00 177.00 176.11 1iqc s THR 232 N -2.88 4.28 -1.81 0.99 -1.32 -1.26 -3.60 115.64 110.05 1iqc s THR 232 Ca 0.61 1.51 0.20 0.00 -1.21 0.00 0.00 61.69 62.80 1iqc s THR 232 Cb -0.17 -3.66 -0.01 0.00 -1.51 0.00 0.00 72.50 67.15 1iqc s THR 232 CO 0.55 -0.23 0.99 0.18 -2.21 0.00 0.00 174.62 173.91 1iqc n LEU 233 N -0.46 1.87 -4.76 9.08 4.77 -1.15 -4.79 117.00 121.56 1iqc n LEU 233 Ca 0.06 -0.76 -0.41 0.00 -0.03 0.00 0.00 56.01 54.87 1iqc n LEU 233 Cb 0.53 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.61 1iqc n LEU 233 CO 0.39 0.35 1.16 -0.13 -1.33 0.00 0.00 177.39 177.83 1iqc s ARG 234 N -2.24 4.17 -1.99 3.23 1.81 -1.25 -1.32 118.95 121.35 1iqc s ARG 234 Ca 0.16 2.48 0.00 0.00 -1.72 0.00 0.00 55.73 56.66 1iqc s ARG 234 Cb 0.16 -3.03 0.00 0.00 -0.45 0.00 0.00 34.95 31.63 1iqc s ARG 234 CO 0.50 -0.52 0.00 0.09 -0.68 0.00 0.00 175.30 174.70 1iqc n ASN 235 N 1.55 -5.19 0.32 0.23 5.03 -1.00 -4.81 115.26 111.40 1iqc n ASN 235 Ca 0.05 0.40 0.20 0.00 0.87 0.00 0.00 54.58 56.10 1iqc n ASN 235 Cb 0.39 -4.56 1.11 0.00 -1.02 0.00 0.00 39.78 35.70 1iqc n ASN 235 CO 0.00 0.00 0.00 -0.29 -1.83 0.00 0.00 177.26 175.14 1iqc h ILE 236 N 0.00 0.17 0.00 2.41 6.09 -1.50 0.52 117.51 125.21 1iqc h ILE 236 Ca -0.41 -0.02 -0.07 0.00 -1.37 0.00 0.00 64.86 62.99 1iqc h ILE 236 Cb 1.28 1.02 -0.01 0.00 0.47 0.00 0.00 36.82 39.57 1iqc h ILE 236 CO 0.58 0.00 -0.34 -0.08 -3.07 0.00 0.00 178.15 175.23 1iqc h GLU 237 N 0.00 0.00 -0.01 2.19 4.81 -1.86 -3.12 114.58 116.59 1iqc h GLU 237 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1iqc h GLU 237 Cb 0.01 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.39 1iqc h GLU 237 CO 0.00 0.34 -0.56 1.28 -0.73 0.00 0.00 179.01 179.35 1iqc n LEU 238 N -3.49 1.32 -1.38 1.64 4.77 0.16 -4.53 117.00 115.48 1iqc n LEU 238 Ca -0.00 -0.47 -0.07 0.00 -0.03 0.00 0.00 56.01 55.45 1iqc n LEU 238 Cb 0.50 -0.07 0.21 0.00 -2.33 0.00 0.00 43.42 41.73 1iqc n LEU 238 CO 0.36 0.27 0.82 0.35 -1.33 0.00 0.00 177.39 177.86 1iqc n THR 239 N -0.75 2.67 -1.66 -5.08 -2.24 -1.12 -4.62 114.28 101.49 1iqc n THR 239 Ca 0.08 -2.45 -0.34 0.00 -2.27 0.00 0.00 64.05 59.07 1iqc n THR 239 Cb 0.39 -0.34 0.06 0.00 -2.10 0.00 0.00 70.33 68.34 1iqc n THR 239 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 1iqc s TYR 240 N -3.20 2.35 0.00 4.78 -0.85 -1.26 -4.62 117.35 114.54 1iqc s TYR 240 Ca 0.47 1.57 0.00 0.00 -0.52 0.00 0.00 57.07 58.59 1iqc s TYR 240 Cb 0.42 -3.34 0.00 0.00 0.38 0.00 0.00 41.96 39.42 1iqc s TYR 240 CO 0.03 -2.14 0.00 -0.35 -1.52 0.00 0.00 175.55 171.58 1iqc n PRO 241 N -2.43 -0.07 -4.25 -3.49 -0.04 -1.26 -4.19 135.00 119.27 1iqc n PRO 241 Ca 0.12 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.44 1iqc n PRO 241 Cb 0.51 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.87 1iqc n PRO 241 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1iqc s TYR 242 N -0.57 1.26 0.00 0.54 1.51 0.06 -4.98 117.35 115.17 1iqc s TYR 242 Ca 0.00 -0.75 0.00 0.00 -1.01 0.00 0.00 57.07 55.31 1iqc s TYR 242 Cb 0.00 -0.64 0.00 0.00 -0.11 0.00 0.00 41.96 41.21 1iqc s TYR 242 CO 0.00 0.08 0.00 1.19 -1.11 0.00 0.00 175.55 175.71 1iqc n PHE 243 N -0.16 0.00 0.29 2.71 0.99 -1.26 -2.57 117.46 117.47 1iqc n PHE 243 Ca -0.10 0.00 0.16 0.00 -0.00 0.00 0.00 57.45 57.51 1iqc n PHE 243 Cb 0.60 -0.01 0.89 0.00 -1.00 0.00 0.00 39.48 39.96 1iqc n PHE 243 CO 0.00 0.00 0.00 1.12 -0.00 0.00 0.00 176.76 177.88 1iqc h HIS 244 N 0.00 0.00 -0.02 1.38 2.07 -1.98 -1.18 115.15 115.43 1iqc h HIS 244 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1iqc h HIS 244 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 1iqc h HIS 244 CO 0.00 0.05 -0.30 -0.40 -3.07 0.00 0.00 177.93 174.21 1iqc n ASP 245 N -3.49 2.18 -1.14 3.10 5.75 -1.26 -0.64 116.55 121.05 1iqc n ASP 245 Ca -0.02 -1.59 -0.13 0.00 -0.01 0.00 0.00 54.79 53.04 1iqc n ASP 245 Cb 0.17 0.29 -0.04 0.00 -1.03 0.00 0.00 41.12 40.51 1iqc n ASP 245 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1iqc n GLY 246 N 1.38 1.01 0.25 6.12 0.00 -0.44 -4.82 105.19 108.70 1iqc n GLY 246 Ca 0.11 -0.39 0.14 0.00 0.00 0.00 0.00 46.02 45.88 1iqc n GLY 246 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1iqc h GLY 247 N 0.00 0.00 -7.18 -0.02 0.00 -1.77 -3.41 103.07 90.70 1iqc h GLY 247 Ca -0.28 0.00 -0.74 0.00 0.00 0.00 0.00 47.33 46.31 1iqc h GLY 247 CO 0.39 0.00 -0.20 0.00 0.00 0.00 0.00 176.54 176.73 1iqc s ALA 248 N -3.63 3.58 0.43 3.60 0.00 -1.06 -4.93 121.76 119.75 1iqc s ALA 248 Ca 0.01 -2.31 0.14 0.00 0.00 0.00 0.00 51.96 49.79 1iqc s ALA 248 Cb 0.09 -3.24 0.94 0.00 0.00 0.00 0.00 23.12 20.91 1iqc s ALA 248 CO 0.59 -1.96 1.96 0.00 0.00 0.00 0.00 175.76 176.35 1iqc h ALA 249 N 8.89 1.64 -2.41 0.00 0.00 -1.87 0.22 119.26 125.72 1iqc h ALA 249 Ca -0.29 -0.19 -0.32 0.00 0.00 0.00 0.00 54.91 54.11 1iqc h ALA 249 Cb 1.10 -0.04 -0.16 0.00 0.00 0.00 0.00 17.79 18.69 1iqc h ALA 249 CO 0.99 0.27 -0.72 -0.08 0.00 0.00 0.00 179.25 179.71 1iqc s THR 250 N -4.61 1.08 0.17 0.00 -1.32 -1.26 -4.73 115.64 104.97 1iqc s THR 250 Ca -0.04 -1.91 -0.14 0.00 -1.21 0.00 0.00 61.69 58.39 1iqc s THR 250 Cb 0.16 -1.68 0.07 0.00 -1.51 0.00 0.00 72.50 69.54 1iqc s THR 250 CO 0.70 -0.68 1.73 -0.07 -2.21 0.00 0.00 174.62 174.09 1iqc h LEU 251 N 3.06 0.06 -0.92 9.08 3.38 -1.97 -1.68 115.31 126.33 1iqc h LEU 251 Ca -0.37 0.07 0.17 0.00 0.09 0.00 0.00 57.88 57.84 1iqc h LEU 251 Cb 1.19 0.08 -0.10 0.00 0.09 0.00 0.00 40.66 41.91 1iqc h LEU 251 CO 0.60 0.07 0.50 -0.33 0.09 0.00 0.00 178.44 179.36 1iqc h GLU 252 N 0.26 0.63 -0.03 1.13 3.07 -1.96 0.23 114.58 117.89 1iqc h GLU 252 Ca 0.21 -0.04 -0.14 0.00 -0.50 0.00 0.00 59.36 58.89 1iqc h GLU 252 Cb 0.25 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 1iqc h GLU 252 CO -0.26 0.42 -0.62 0.37 -1.40 0.00 0.00 179.01 177.51 1iqc h GLN 253 N 0.65 0.13 0.02 2.33 4.15 -1.76 -2.49 115.11 118.13 1iqc h GLN 253 Ca 0.52 -0.09 -0.00 0.00 0.77 0.00 0.00 58.65 59.85 1iqc h GLN 253 Cb 0.80 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.51 1iqc h GLN 253 CO -0.39 0.71 -0.01 0.00 -1.93 0.00 0.00 178.83 177.21 1iqc h ALA 254 N 1.26 -0.02 -0.93 3.38 0.00 0.11 -2.09 119.26 120.97 1iqc h ALA 254 Ca -0.01 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.68 1iqc h ALA 254 Cb 1.12 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 1iqc h ALA 254 CO 0.09 -0.25 0.61 0.28 0.00 0.00 0.00 179.25 179.98 1iqc h VAL 255 N -0.55 1.16 -0.11 0.00 2.07 -0.74 -0.30 116.25 117.79 1iqc h VAL 255 Ca -0.00 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 1iqc h VAL 255 Cb 0.52 -0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1iqc h VAL 255 CO 0.00 0.21 0.00 -0.08 0.02 0.00 0.00 177.57 177.73 1iqc h GLU 256 N 1.17 0.18 -0.75 1.57 4.81 -1.45 -1.99 114.58 118.13 1iqc h GLU 256 Ca 0.37 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.50 1iqc h GLU 256 Cb 0.01 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 1iqc h GLU 256 CO -0.11 0.42 0.29 1.15 -0.73 0.00 0.00 179.01 180.04 1iqc h THR 257 N -0.08 1.25 -0.50 0.32 2.02 -1.04 -1.35 112.91 113.54 1iqc h THR 257 Ca 0.03 -0.80 -0.06 0.00 0.77 0.00 0.00 66.41 66.35 1iqc h THR 257 Cb 0.34 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 1iqc h THR 257 CO 0.00 0.32 0.07 0.24 0.37 0.00 0.00 175.52 176.52 1iqc h MET 258 N 1.09 0.78 -0.21 6.66 2.86 -0.99 -1.47 114.93 123.65 1iqc h MET 258 Ca 0.25 -0.18 -0.18 0.00 -2.06 0.00 0.00 59.70 57.53 1iqc h MET 258 Cb 0.21 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.77 1iqc h MET 258 CO -0.02 0.75 -0.58 0.78 1.06 0.00 0.00 176.91 178.90 1iqc h GLY 259 N 0.96 0.84 0.75 8.32 0.00 -0.99 -2.15 103.07 110.80 1iqc h GLY 259 Ca 0.16 -1.06 -0.02 0.00 0.00 0.00 0.00 47.33 46.41 1iqc h GLY 259 CO 0.01 0.95 -0.18 -0.09 0.00 0.00 0.00 176.54 177.23 1iqc h ARG 260 N 0.49 -0.48 0.00 4.80 2.43 -0.95 0.24 114.38 120.91 1iqc h ARG 260 Ca -0.01 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1iqc h ARG 260 Cb 1.20 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.86 1iqc h ARG 260 CO 0.12 -0.19 -1.10 0.44 -1.51 0.00 0.00 179.97 177.74 1iqc n ILE 261 N -5.20 0.25 -0.10 1.20 -5.35 -0.58 -2.49 119.36 107.08 1iqc n ILE 261 Ca -0.10 -0.33 -0.17 0.00 -0.27 0.00 0.00 62.75 61.88 1iqc n ILE 261 Cb 0.27 0.06 -0.13 0.00 -1.74 0.00 0.00 39.64 38.10 1iqc n ILE 261 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1iqc n GLN 262 N -2.14 0.67 0.00 6.28 1.13 -0.82 -0.79 117.38 121.71 1iqc n GLN 262 Ca 0.01 0.14 0.03 0.00 -1.94 0.00 0.00 57.00 55.24 1iqc n GLN 262 Cb 0.47 -1.55 -0.01 0.00 0.11 0.00 0.00 30.24 29.26 1iqc n GLN 262 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1iqc n LEU 263 N -3.20 0.75 -3.31 1.08 4.77 -1.06 -4.69 117.00 111.34 1iqc n LEU 263 Ca -0.41 -0.69 -0.16 0.00 -0.03 0.00 0.00 56.01 54.72 1iqc n LEU 263 Cb 1.03 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 42.20 1iqc n LEU 263 CO 0.32 0.16 0.07 -3.20 -1.33 0.00 0.00 177.39 173.41 1iqc n ASN 264 N -0.56 -4.18 -3.77 -1.43 4.05 0.32 -4.97 115.26 104.72 1iqc n ASN 264 Ca 0.02 -0.65 -0.13 0.00 0.45 0.00 0.00 54.58 54.27 1iqc n ASN 264 Cb 0.11 -5.10 -0.12 0.00 1.23 0.00 0.00 39.78 35.91 1iqc n ASN 264 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 177.26 173.61 1iqc s ARG 265 N -4.88 0.30 -0.25 1.20 3.52 0.57 -4.96 118.95 114.45 1iqc s ARG 265 Ca 0.21 0.41 -0.15 0.00 -0.13 0.00 0.00 55.73 56.07 1iqc s ARG 265 Cb -0.03 0.11 -0.04 0.00 -1.56 0.00 0.00 34.95 33.44 1iqc s ARG 265 CO 0.72 -0.06 0.37 -1.21 -0.81 0.00 0.00 175.30 174.32 1iqc s GLU 266 N 0.32 4.05 -0.15 5.12 0.41 -1.26 -2.51 118.70 124.68 1iqc s GLU 266 Ca -0.01 0.07 -0.19 0.00 -0.41 0.00 0.00 54.97 54.42 1iqc s GLU 266 Cb -0.03 -3.62 -0.04 0.00 -1.78 0.00 0.00 34.13 28.66 1iqc s GLU 266 CO -0.01 -0.21 0.53 -0.06 -0.49 0.00 0.00 175.26 175.02 1iqc s PHE 267 N 1.86 3.46 0.45 1.61 2.99 -1.26 -5.05 117.98 122.03 1iqc s PHE 267 Ca 0.16 0.89 -0.24 0.00 0.00 0.00 0.00 56.93 57.74 1iqc s PHE 267 Cb -0.15 -2.64 -0.07 0.00 0.00 0.00 0.00 43.02 40.15 1iqc s PHE 267 CO 0.09 0.03 1.22 -0.80 -0.00 0.00 0.00 175.22 175.77 1iqc s ASN 268 N 0.88 6.14 0.45 1.36 0.02 -1.26 -4.75 114.94 117.78 1iqc s ASN 268 Ca 0.27 2.46 0.32 0.00 -1.02 0.00 0.00 52.86 54.88 1iqc s ASN 268 Cb -0.16 -2.62 1.45 0.00 0.02 0.00 0.00 41.25 39.95 1iqc s ASN 268 CO 0.11 -0.95 1.63 0.50 0.02 0.00 0.00 177.10 178.41 1iqc h LYS 269 N 2.22 0.08 -0.27 -0.60 3.64 -2.00 0.64 116.57 120.28 1iqc h LYS 269 Ca -0.49 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 58.80 1iqc h LYS 269 Cb 1.25 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.05 1iqc h LYS 269 CO 0.61 0.05 -0.15 0.22 -2.27 0.00 0.00 179.45 177.91 1iqc h ASP 270 N 0.08 0.61 -0.23 4.20 3.58 -2.00 -2.51 116.42 120.15 1iqc h ASP 270 Ca 0.82 -0.42 0.02 0.00 0.42 0.00 0.00 57.03 57.86 1iqc h ASP 270 Cb 2.64 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 43.50 1iqc h ASP 270 CO -0.36 0.90 0.10 -0.33 -2.88 0.00 0.00 179.24 176.66 1iqc h GLU 271 N 0.32 0.22 -0.52 0.28 5.08 -0.07 -2.45 114.58 117.43 1iqc h GLU 271 Ca 0.06 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.44 1iqc h GLU 271 Cb 0.68 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.84 1iqc h GLU 271 CO 0.04 0.14 0.29 0.28 -1.00 0.00 0.00 179.01 178.77 1iqc h VAL 272 N 0.22 1.00 -0.92 3.13 2.07 -1.41 -1.40 116.25 118.95 1iqc h VAL 272 Ca 0.10 -0.19 0.06 0.00 0.82 0.00 0.00 66.70 67.49 1iqc h VAL 272 Cb 0.04 0.39 -0.06 0.00 -1.52 0.00 0.00 31.29 30.14 1iqc h VAL 272 CO -0.08 0.10 0.60 0.77 0.02 0.00 0.00 177.57 178.98 1iqc h SER 273 N 0.56 0.93 -0.21 0.57 4.64 -1.09 0.31 113.55 119.26 1iqc h SER 273 Ca 0.22 0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.45 1iqc h SER 273 Cb 0.09 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 61.98 1iqc h SER 273 CO -0.13 0.60 -0.26 0.11 -0.87 0.00 0.00 176.83 176.28 1iqc h LYS 274 N 1.06 0.55 -0.06 4.77 6.56 -0.98 -1.25 116.57 127.22 1iqc h LYS 274 Ca 0.40 -0.31 -0.00 0.00 -1.06 0.00 0.00 60.65 59.68 1iqc h LYS 274 Cb 0.19 0.02 -0.00 0.00 -0.57 0.00 0.00 32.23 31.87 1iqc h LYS 274 CO -0.15 0.90 0.03 0.82 -2.06 0.00 0.00 179.45 179.00 1iqc h ILE 275 N 0.22 1.04 -0.82 1.86 2.04 -0.53 0.12 117.51 121.44 1iqc h ILE 275 Ca 0.03 -0.10 0.05 0.00 1.00 0.00 0.00 64.86 65.84 1iqc h ILE 275 Cb 0.83 1.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.85 1iqc h ILE 275 CO 0.06 0.03 0.52 0.58 0.00 0.00 0.00 178.15 179.34 1iqc h VAL 276 N 0.05 1.08 -0.86 1.67 2.07 -0.42 -0.44 116.25 119.40 1iqc h VAL 276 Ca 0.02 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 1iqc h VAL 276 Cb 0.02 0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 29.77 1iqc h VAL 276 CO -0.00 0.18 0.51 0.00 0.02 0.00 0.00 177.57 178.27 1iqc h ALA 277 N 1.37 1.09 0.26 1.67 0.00 -0.74 -2.63 119.26 120.28 1iqc h ALA 277 Ca 0.35 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1iqc h ALA 277 Cb 0.10 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1iqc h ALA 277 CO -0.15 0.56 -0.13 0.35 0.00 0.00 0.00 179.25 179.88 1iqc h PHE 278 N 1.18 -0.35 -0.79 0.00 3.57 0.42 -3.09 116.94 117.88 1iqc h PHE 278 Ca 0.31 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.96 1iqc h PHE 278 Cb -0.03 0.12 -0.10 0.00 2.79 0.00 0.00 35.95 38.73 1iqc h PHE 278 CO 0.00 -0.21 0.33 -0.07 -2.23 0.00 0.00 178.31 176.12 1iqc h LEU 279 N -0.36 0.31 -1.49 0.59 3.38 -0.82 0.05 115.31 116.97 1iqc h LEU 279 Ca -0.03 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1iqc h LEU 279 Cb 0.29 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1iqc h LEU 279 CO 0.05 0.10 0.00 0.11 0.09 0.00 0.00 178.44 178.78 1iqc h LYS 280 N 0.45 0.00 -0.06 1.13 1.57 -1.39 0.24 116.57 118.52 1iqc h LYS 280 Ca 0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.23 1iqc h LYS 280 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1iqc h LYS 280 CO -0.43 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 178.70 1iqc n THR 281 N -2.36 0.07 1.22 -0.16 -2.24 0.01 -3.09 114.28 107.73 1iqc n THR 281 Ca -0.01 -0.13 0.13 0.00 -2.27 0.00 0.00 64.05 61.77 1iqc n THR 281 Cb 0.07 -0.05 0.29 0.00 -2.10 0.00 0.00 70.33 68.54 1iqc n THR 281 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1iqc n LEU 282 N -0.39 1.61 -4.68 3.22 4.77 0.84 -1.78 117.00 120.59 1iqc n LEU 282 Ca 0.15 -0.52 -0.43 0.00 -0.03 0.00 0.00 56.01 55.19 1iqc n LEU 282 Cb 0.17 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.18 1iqc n LEU 282 CO 0.12 0.29 0.96 -0.89 -1.33 0.00 0.00 177.39 176.54 1iqc s THR 283 N -2.32 4.34 0.00 -5.08 2.01 -1.18 -2.37 115.64 111.05 1iqc s THR 283 Ca 0.27 1.65 0.00 0.00 0.31 0.00 0.00 61.69 63.91 1iqc s THR 283 Cb 0.19 -4.06 0.00 0.00 0.01 0.00 0.00 72.50 68.64 1iqc s THR 283 CO 0.46 -0.04 0.00 0.61 -0.69 0.00 0.00 174.62 174.96 1iqc n GLY 284 N 3.39 2.81 3.69 4.40 0.00 -1.26 -4.21 105.19 114.02 1iqc n GLY 284 Ca 0.11 -2.15 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 1iqc n GLY 284 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1iqc s ASP 285 N -0.94 6.72 0.72 1.61 -0.00 0.10 -4.86 116.67 120.02 1iqc s ASP 285 Ca 0.00 2.30 -0.11 0.00 -0.00 0.00 0.00 52.55 54.74 1iqc s ASP 285 Cb 0.00 -2.56 0.03 0.00 -0.00 0.00 0.00 42.92 40.38 1iqc s ASP 285 CO 0.00 -0.81 1.08 -1.10 -0.00 0.00 0.00 175.17 174.34 1iqc s GLN 286 N 2.57 2.70 0.24 8.23 -1.52 -1.26 -4.41 119.66 126.21 1iqc s GLN 286 Ca 0.69 0.73 -0.30 0.00 -1.95 0.00 0.00 55.36 54.53 1iqc s GLN 286 Cb -0.36 -1.98 -0.15 0.00 -0.22 0.00 0.00 33.01 30.31 1iqc s GLN 286 CO 0.29 -1.21 1.09 -0.35 -0.25 0.00 0.00 175.29 174.86 1iqc n PRO 287 N -3.17 1.32 -3.80 2.91 -0.04 -1.26 -4.97 135.00 125.98 1iqc n PRO 287 Ca 0.07 0.47 -0.30 0.00 -0.04 0.00 0.00 63.50 63.70 1iqc n PRO 287 Cb 0.55 -1.90 -0.15 0.00 -0.04 0.00 0.00 33.50 31.96 1iqc n PRO 287 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1iqc s ASP 288 N -0.31 3.79 0.20 3.54 2.15 -1.26 -5.08 116.67 119.71 1iqc s ASP 288 Ca 0.64 -1.39 -0.24 0.00 0.43 0.00 0.00 52.55 52.00 1iqc s ASP 288 Cb -0.75 -0.94 0.05 0.00 -0.30 0.00 0.00 42.92 40.98 1iqc s ASP 288 CO 0.56 -0.35 0.88 0.72 -0.17 0.00 0.00 175.17 176.82 1iqc s PHE 289 N 1.56 -0.14 0.33 -5.34 -0.12 -1.26 -5.16 117.98 107.85 1iqc s PHE 289 Ca 0.04 -0.22 -0.27 0.00 -0.05 0.00 0.00 56.93 56.43 1iqc s PHE 289 Cb -0.18 0.67 -0.09 0.00 -0.63 0.00 0.00 43.02 42.79 1iqc s PHE 289 CO -0.16 -0.98 1.03 0.15 -0.05 0.00 0.00 175.22 175.22 1iqc s LYS 290 N -3.47 4.47 0.10 1.99 -0.14 -1.26 -4.96 119.74 116.46 1iqc s LYS 290 Ca 0.12 1.57 -0.32 0.00 -1.36 0.00 0.00 55.97 55.98 1iqc s LYS 290 Cb -0.03 -2.87 -0.11 0.00 -1.68 0.00 0.00 37.83 33.14 1iqc s LYS 290 CO 0.04 0.12 1.82 -0.11 -0.76 0.00 0.00 175.35 176.45 1iqc n LEU 291 N 0.61 3.85 -4.76 3.17 7.94 -1.26 -4.89 117.00 121.66 1iqc n LEU 291 Ca 0.02 0.99 -0.38 0.00 -1.11 0.00 0.00 56.01 55.53 1iqc n LEU 291 Cb 0.48 -1.51 0.03 0.00 0.53 0.00 0.00 43.42 42.95 1iqc n LEU 291 CO 0.48 0.09 0.95 -2.16 -1.11 0.00 0.00 177.39 175.64 1iqc s PRO 292 N 2.73 3.34 -0.32 1.96 0.04 -1.26 -4.99 135.00 136.50 1iqc s PRO 292 Ca 0.83 2.12 -0.04 0.00 0.04 0.00 0.00 61.00 63.95 1iqc s PRO 292 Cb -0.53 -2.33 0.04 0.00 0.04 0.00 0.00 34.50 31.72 1iqc s PRO 292 CO 0.39 -0.99 0.06 0.42 0.04 0.00 0.00 177.00 176.92 1iqc s ILE 293 N -1.36 3.43 0.27 0.56 -1.09 -1.26 -5.09 121.20 116.66 1iqc s ILE 293 Ca 0.69 -1.24 -0.16 0.00 -2.23 0.00 0.00 60.65 57.71 1iqc s ILE 293 Cb -0.37 -2.95 -0.08 0.00 -1.58 0.00 0.00 42.46 37.47 1iqc s ILE 293 CO 0.45 -0.14 0.71 -0.76 -1.23 0.00 0.00 174.94 173.96 1iqc s LEU 294 N 1.34 4.18 0.63 2.97 1.43 -1.26 -5.06 118.68 122.91 1iqc s LEU 294 Ca -0.03 1.28 -0.17 0.00 -1.03 0.00 0.00 54.13 54.18 1iqc s LEU 294 Cb -0.20 -3.84 -0.01 0.00 0.03 0.00 0.00 46.19 42.17 1iqc s LEU 294 CO 0.01 -0.10 1.19 -2.84 0.23 0.00 0.00 176.35 174.84 1iqc s PRO 295 N -2.58 2.77 0.40 1.29 0.02 -1.26 -4.99 135.00 130.64 1iqc s PRO 295 Ca 0.49 1.73 -0.15 0.00 0.02 0.00 0.00 61.00 63.08 1iqc s PRO 295 Cb -0.13 -1.91 -0.09 0.00 0.02 0.00 0.00 34.50 32.39 1iqc s PRO 295 CO 0.19 -1.34 0.83 -1.25 -0.33 0.00 0.00 177.00 175.10 1iqc s PRO 296 N -3.59 3.98 0.65 5.54 0.04 -1.26 -5.04 135.00 135.32 1iqc s PRO 296 Ca 0.75 0.77 -0.15 0.00 0.04 0.00 0.00 61.00 62.41 1iqc s PRO 296 Cb -0.28 -2.31 -0.01 0.00 0.04 0.00 0.00 34.50 31.94 1iqc s PRO 296 CO 0.37 -0.01 1.09 -1.12 0.04 0.00 0.00 177.00 177.37 1iqc s SER 297 N -2.62 5.27 0.05 6.66 0.01 -1.26 -4.86 113.70 116.95 1iqc s SER 297 Ca 0.56 1.92 0.00 0.00 1.31 0.00 0.00 55.95 59.74 1iqc s SER 297 Cb -0.10 -2.54 -0.00 0.00 0.21 0.00 0.00 66.02 63.59 1iqc s SER 297 CO 0.22 -1.52 0.01 -0.46 0.41 0.00 0.00 173.24 171.91 1iqc n ASN 298 N -2.43 1.28 0.33 2.44 0.23 -1.26 -4.99 115.26 110.86 1iqc n ASN 298 Ca 0.10 -1.25 0.21 0.00 -0.53 0.00 0.00 54.58 53.11 1iqc n ASN 298 Cb 0.52 0.10 1.13 0.00 -2.08 0.00 0.00 39.78 39.45 1iqc n ASN 298 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 1iqc h ASN 299 N 0.18 0.00 0.39 0.53 -0.26 -1.96 -1.70 115.58 112.76 1iqc h ASN 299 Ca -0.04 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.70 1iqc h ASN 299 Cb 0.14 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.40 1iqc h ASN 299 CO 0.06 0.00 -0.56 0.47 -1.06 0.00 0.00 177.43 176.35 1iqc n ASP 300 N -3.19 0.64 -4.68 5.81 8.00 -1.26 -4.90 116.55 116.97 1iqc n ASP 300 Ca -0.03 -0.44 -0.43 0.00 0.71 0.00 0.00 54.79 54.61 1iqc n ASP 300 Cb 0.10 0.36 -0.02 0.00 -0.02 0.00 0.00 41.12 41.54 1iqc n ASP 300 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1iqc s THR 301 N -2.95 4.21 0.19 -3.53 2.01 -0.64 -4.91 115.64 110.01 1iqc s THR 301 Ca 0.12 1.51 -0.33 0.00 0.31 0.00 0.00 61.69 63.30 1iqc s THR 301 Cb 0.17 -3.97 -0.14 0.00 0.01 0.00 0.00 72.50 68.57 1iqc s THR 301 CO 0.71 -0.05 1.53 -2.65 -0.69 0.00 0.00 174.62 173.47 1iqc n PRO 302 N 5.78 2.14 -2.49 4.92 -0.02 -1.26 -4.86 135.00 139.20 1iqc n PRO 302 Ca 0.12 0.77 -0.37 0.00 -2.02 0.00 0.00 63.50 62.00 1iqc n PRO 302 Cb 0.45 -2.51 -0.04 0.00 -0.02 0.00 0.00 33.50 31.39 1iqc n PRO 302 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1iqc s ARG 303 N 0.51 4.19 0.62 -0.52 0.52 -1.26 -4.97 118.95 118.05 1iqc s ARG 303 Ca 0.75 1.60 -0.19 0.00 -0.52 0.00 0.00 55.73 57.38 1iqc s ARG 303 Cb -0.67 -2.63 -0.02 0.00 0.52 0.00 0.00 34.95 32.15 1iqc s ARG 303 CO 0.41 -0.14 1.29 -1.12 0.02 0.00 0.00 175.30 175.76 1iqc s SER 304 N -1.42 4.80 -0.53 0.23 0.01 -1.26 -4.99 113.70 110.55 1iqc s SER 304 Ca 0.56 2.60 0.07 0.00 1.31 0.00 0.00 55.95 60.49 1iqc s SER 304 Cb -0.25 -2.62 0.25 0.00 0.21 0.00 0.00 66.02 63.61 1iqc s SER 304 CO 0.31 -1.87 0.64 0.00 0.41 0.00 0.00 173.24 172.73 1iqc n GLN 305 N -1.72 1.69 0.07 12.44 6.02 0.28 -4.95 117.38 131.21 1iqc n GLN 305 Ca 0.15 -4.02 -0.00 0.00 -0.01 0.00 0.00 57.00 53.12 1iqc n GLN 305 Cb 0.48 -1.79 0.29 0.00 1.02 0.00 0.00 30.24 30.24 1iqc n GLN 305 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1iqc h PRO 306 N 4.14 0.34 0.00 -1.09 0.13 -1.77 -3.37 132.00 130.38 1iqc h PRO 306 Ca 0.14 -0.11 -0.02 0.00 -0.87 0.00 0.00 66.00 65.15 1iqc h PRO 306 Cb 0.76 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.86 1iqc h PRO 306 CO 0.66 0.54 -1.11 0.66 -0.23 0.00 0.00 178.00 178.52 1iqc n TYR 307 N -4.18 0.00 0.51 1.56 4.02 -1.26 -4.80 117.16 113.01 1iqc n TYR 307 Ca -0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.93 1iqc n TYR 307 Cb 0.35 -0.07 0.24 0.00 -0.02 0.00 0.00 39.34 39.83 1iqc n TYR 307 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24