#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i0h s TYR 2 N 0.00 3.28 0.08 7.33 2.02 -1.26 -5.08 117.35 123.72 1i0h s TYR 2 Ca 0.00 1.48 0.03 0.00 -0.37 0.00 0.00 57.07 58.22 1i0h s TYR 2 Cb 0.00 -2.87 -0.03 0.00 -0.40 0.00 0.00 41.96 38.65 1i0h s TYR 2 CO 0.00 -0.65 -0.09 0.95 -1.57 0.00 0.00 175.55 174.19 1i0h s THR 3 N -2.55 0.82 -0.10 -0.71 -4.23 -1.26 -4.97 115.64 102.64 1i0h s THR 3 Ca 0.61 -1.54 -0.29 0.00 -1.18 0.00 0.00 61.69 59.28 1i0h s THR 3 Cb -0.12 -1.23 -0.05 0.00 1.34 0.00 0.00 72.50 72.44 1i0h s THR 3 CO 0.33 -0.55 1.72 -0.22 -0.54 0.00 0.00 174.62 175.36 1i0h s LEU 4 N -2.31 4.17 0.45 4.79 2.96 -1.26 -4.98 118.68 122.50 1i0h s LEU 4 Ca 0.03 2.11 -0.23 0.00 -0.22 0.00 0.00 54.13 55.82 1i0h s LEU 4 Cb -0.04 -3.53 -0.08 0.00 0.50 0.00 0.00 46.19 43.04 1i0h s LEU 4 CO -0.01 -1.09 1.12 -2.16 -1.32 0.00 0.00 176.35 172.89 1i0h s PRO 5 N 4.39 3.86 0.64 0.98 0.04 -1.26 -5.02 135.00 138.64 1i0h s PRO 5 Ca 0.76 1.65 -0.17 0.00 0.04 0.00 0.00 61.00 63.29 1i0h s PRO 5 Cb -0.32 -2.40 -0.01 0.00 0.04 0.00 0.00 34.50 31.81 1i0h s PRO 5 CO 0.31 -0.43 1.16 -1.54 0.04 0.00 0.00 177.00 176.54 1i0h s SER 6 N -1.50 5.04 0.43 6.66 1.04 -1.26 -5.04 113.70 119.08 1i0h s SER 6 Ca 0.63 2.21 -0.02 0.00 0.48 0.00 0.00 55.95 59.24 1i0h s SER 6 Cb -0.25 -2.58 -0.03 0.00 0.10 0.00 0.00 66.02 63.26 1i0h s SER 6 CO 0.31 -1.69 0.69 -0.76 0.98 0.00 0.00 173.24 172.77 1i0h s LEU 7 N -4.53 3.77 0.00 2.42 1.43 -1.26 -4.98 118.68 115.52 1i0h s LEU 7 Ca 0.72 0.67 0.10 0.00 -1.03 0.00 0.00 54.13 54.60 1i0h s LEU 7 Cb -0.26 -3.57 0.62 0.00 0.03 0.00 0.00 46.19 43.01 1i0h s LEU 7 CO 0.37 -0.50 1.31 -2.65 0.23 0.00 0.00 176.35 175.12 1i0h n PRO 8 N -2.07 0.89 -3.61 1.29 -0.02 -1.26 -4.89 135.00 125.33 1i0h n PRO 8 Ca -0.01 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.40 1i0h n PRO 8 Cb 0.56 -1.18 -0.02 0.00 -0.02 0.00 0.00 33.50 32.84 1i0h n PRO 8 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1i0h s TYR 9 N -2.00 -0.26 0.73 6.00 -0.85 -1.26 -5.16 117.35 114.55 1i0h s TYR 9 Ca 0.16 0.04 -0.11 0.00 -0.52 0.00 0.00 57.07 56.64 1i0h s TYR 9 Cb 0.07 0.59 0.03 0.00 0.38 0.00 0.00 41.96 43.03 1i0h s TYR 9 CO 0.12 -0.69 1.08 0.00 -1.52 0.00 0.00 175.55 174.54 1i0h s ALA 10 N -3.23 2.43 0.60 9.51 0.00 -1.26 -4.94 121.76 124.87 1i0h s ALA 10 Ca 0.08 0.23 0.35 0.00 0.00 0.00 0.00 51.96 52.62 1i0h s ALA 10 Cb -0.01 -3.24 2.02 0.00 0.00 0.00 0.00 23.12 21.89 1i0h s ALA 10 CO -0.04 -1.51 2.29 1.88 0.00 0.00 0.00 175.76 178.37 1i0h h TYR 11 N -0.85 0.00 -0.23 0.00 0.05 -1.97 -1.49 116.97 112.49 1i0h h TYR 11 Ca -0.44 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.34 1i0h h TYR 11 Cb 1.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.96 1i0h h TYR 11 CO 0.59 0.01 0.00 -0.40 -1.05 0.00 0.00 178.16 177.31 1i0h n ASP 12 N -3.54 2.30 0.14 3.88 5.75 -1.26 -4.26 116.55 119.56 1i0h n ASP 12 Ca -0.03 -1.81 0.13 0.00 -0.01 0.00 0.00 54.79 53.06 1i0h n ASP 12 Cb 0.09 -0.15 0.50 0.00 -1.03 0.00 0.00 41.12 40.53 1i0h n ASP 12 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1i0h h ALA 13 N 4.23 1.00 -0.27 2.12 0.00 -1.64 -2.72 119.26 121.97 1i0h h ALA 13 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1i0h h ALA 13 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1i0h h ALA 13 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 1i0h n LEU 14 N -2.35 3.12 -4.76 0.00 4.77 -1.26 -4.69 117.00 111.84 1i0h n LEU 14 Ca 0.02 -1.39 -0.37 0.00 -0.03 0.00 0.00 56.01 54.24 1i0h n LEU 14 Cb 0.27 -0.17 0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1i0h n LEU 14 CO 0.22 0.65 0.89 -1.61 -1.33 0.00 0.00 177.39 176.21 1i0h s GLU 15 N -1.44 3.21 -0.22 3.23 0.41 -1.03 -0.80 118.70 122.06 1i0h s GLU 15 Ca 0.32 1.97 0.05 0.00 -0.41 0.00 0.00 54.97 56.90 1i0h s GLU 15 Cb 0.19 -2.17 0.44 0.00 -1.78 0.00 0.00 34.13 30.81 1i0h s GLU 15 CO 0.27 -1.05 1.43 -0.35 -0.49 0.00 0.00 175.26 175.07 1i0h n PRO 16 N -1.12 2.38 -0.09 0.39 -0.04 -1.26 -4.92 135.00 130.35 1i0h n PRO 16 Ca 0.11 -1.84 -0.11 0.00 -0.04 0.00 0.00 63.50 61.62 1i0h n PRO 16 Cb 0.47 -1.81 -0.04 0.00 -0.04 0.00 0.00 33.50 32.09 1i0h n PRO 16 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1i0h n HIS 17 N -0.15 0.47 -4.33 0.54 8.25 0.02 -4.89 115.22 115.13 1i0h n HIS 17 Ca 0.28 0.20 -0.34 0.00 -0.26 0.00 0.00 57.72 57.61 1i0h n HIS 17 Cb 1.06 -0.73 -0.11 0.00 1.12 0.00 0.00 29.99 31.33 1i0h n HIS 17 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1i0h s PHE 18 N -2.55 3.09 0.29 4.41 0.40 -0.84 -4.96 117.98 117.82 1i0h s PHE 18 Ca -0.25 -0.11 -0.29 0.00 -0.60 0.00 0.00 56.93 55.69 1i0h s PHE 18 Cb 0.05 -1.93 -0.09 0.00 0.51 0.00 0.00 43.02 41.55 1i0h s PHE 18 CO 0.37 0.13 1.05 0.16 0.70 0.00 0.00 175.22 177.63 1i0h s ASP 19 N 0.04 7.27 0.39 1.36 -4.77 -1.26 -3.55 116.67 116.16 1i0h s ASP 19 Ca 0.02 2.15 0.12 0.00 -3.30 0.00 0.00 52.55 51.54 1i0h s ASP 19 Cb -0.13 -2.62 0.78 0.00 -1.09 0.00 0.00 42.92 39.87 1i0h s ASP 19 CO 0.02 -0.13 1.87 0.07 0.70 0.00 0.00 175.17 177.70 1i0h h LYS 20 N 3.66 0.04 -0.29 2.11 2.10 -1.93 -1.86 116.57 120.39 1i0h h LYS 20 Ca -0.47 -0.01 -0.04 0.00 -2.00 0.00 0.00 60.65 58.13 1i0h h LYS 20 Cb 1.21 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.52 1i0h h LYS 20 CO 0.66 0.34 0.01 0.37 -2.00 0.00 0.00 179.45 178.83 1i0h h GLN 21 N 0.04 0.51 -0.68 0.07 5.75 -1.92 -1.97 115.11 116.91 1i0h h GLN 21 Ca 0.00 -0.16 -0.05 0.00 -0.15 0.00 0.00 58.65 58.30 1i0h h GLN 21 Cb 0.55 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.02 1i0h h GLN 21 CO 0.04 0.65 0.24 1.15 -2.65 0.00 0.00 178.83 178.26 1i0h h THR 22 N 0.31 1.25 -0.47 2.39 2.02 -1.87 -2.09 112.91 114.44 1i0h h THR 22 Ca 0.09 -0.83 0.07 0.00 0.77 0.00 0.00 66.41 66.51 1i0h h THR 22 Cb 0.41 0.50 -0.06 0.00 -1.74 0.00 0.00 68.15 67.26 1i0h h THR 22 CO 0.01 0.32 0.15 0.24 0.37 0.00 0.00 175.52 176.62 1i0h h MET 23 N 0.99 0.31 -0.30 6.66 2.86 -1.12 0.15 114.93 124.46 1i0h h MET 23 Ca 0.22 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.81 1i0h h MET 23 Cb 0.26 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 1i0h h MET 23 CO -0.01 0.20 0.04 1.49 1.06 0.00 0.00 176.91 179.69 1i0h h GLU 24 N 0.32 0.50 -0.29 1.72 4.81 -1.14 -1.74 114.58 118.76 1i0h h GLU 24 Ca 0.23 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 1i0h h GLU 24 Cb 0.25 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1i0h h GLU 24 CO -0.25 0.61 0.09 0.82 -0.73 0.00 0.00 179.01 179.56 1i0h h ILE 25 N 0.32 1.20 -0.87 2.32 2.04 -1.03 -0.50 117.51 120.99 1i0h h ILE 25 Ca 0.09 -0.64 0.05 0.00 1.00 0.00 0.00 64.86 65.36 1i0h h ILE 25 Cb 0.35 1.07 -0.06 0.00 -0.74 0.00 0.00 36.82 37.45 1i0h h ILE 25 CO 0.01 0.21 0.55 -0.74 0.00 0.00 0.00 178.15 178.18 1i0h h HIS 26 N 0.31 1.02 0.33 1.37 2.76 -0.66 0.15 115.15 120.43 1i0h h HIS 26 Ca 0.09 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.28 1i0h h HIS 26 Cb 0.24 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 28.87 1i0h h HIS 26 CO 0.00 0.56 -0.16 1.25 -1.30 0.00 0.00 177.93 178.29 1i0h h HIS 27 N 1.04 -0.41 0.00 5.26 -0.00 -1.20 -0.61 115.15 119.23 1i0h h HIS 27 Ca 0.36 -0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.71 1i0h h HIS 27 Cb 0.08 0.13 -0.00 0.00 -0.00 0.00 0.00 27.41 27.62 1i0h h HIS 27 CO -0.02 -0.17 -0.06 1.79 -0.00 0.00 0.00 177.93 179.47 1i0h h THR 28 N -1.07 0.10 0.00 6.26 1.35 -0.98 -2.77 112.91 115.80 1i0h h THR 28 Ca -0.04 -1.04 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 1i0h h THR 28 Cb 0.42 1.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 1i0h h THR 28 CO 0.07 0.05 -0.12 0.29 -0.25 0.00 0.00 175.52 175.57 1i0h n LYS 29 N -3.12 0.06 0.06 4.72 4.76 0.52 -4.42 118.16 120.73 1i0h n LYS 29 Ca 0.03 0.03 -0.13 0.00 -2.87 0.00 0.00 58.31 55.37 1i0h n LYS 29 Cb 0.51 -0.42 -0.08 0.00 -1.84 0.00 0.00 35.03 33.20 1i0h n LYS 29 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1i0h h HIS 30 N -0.12 -0.10 -0.51 2.13 3.86 -1.46 -0.71 115.15 118.24 1i0h h HIS 30 Ca 0.00 -0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.12 1i0h h HIS 30 Cb 0.12 0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.60 1i0h h HIS 30 CO -0.05 0.11 -0.03 1.25 0.86 0.00 0.00 177.93 180.07 1i0h h HIS 31 N -0.30 1.02 -0.82 2.45 -0.00 -1.12 -2.60 115.15 113.78 1i0h h HIS 31 Ca -0.01 -0.19 0.08 0.00 -0.00 0.00 0.00 60.37 60.26 1i0h h HIS 31 Cb 0.25 -0.26 -0.07 0.00 -0.00 0.00 0.00 27.41 27.33 1i0h h HIS 31 CO -0.01 0.95 0.48 0.37 -0.00 0.00 0.00 177.93 179.72 1i0h h GLN 32 N 0.79 0.79 -0.82 5.26 5.75 -1.30 -1.52 115.11 124.07 1i0h h GLN 32 Ca 0.14 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.56 1i0h h GLN 32 Cb 0.57 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 28.90 1i0h h GLN 32 CO 0.03 0.53 0.38 1.15 -2.65 0.00 0.00 178.83 178.27 1i0h h THR 33 N 0.82 1.26 -0.59 2.39 2.02 -0.76 -0.06 112.91 117.98 1i0h h THR 33 Ca 0.38 -0.74 -0.03 0.00 0.77 0.00 0.00 66.41 66.79 1i0h h THR 33 Cb 0.31 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 1i0h h THR 33 CO -0.23 0.31 0.25 1.88 0.37 0.00 0.00 175.52 178.11 1i0h h TYR 34 N 1.17 0.89 -0.32 3.16 0.05 -0.97 -0.38 116.97 120.58 1i0h h TYR 34 Ca 0.28 -0.06 0.03 0.00 0.05 0.00 0.00 58.73 59.03 1i0h h TYR 34 Cb 0.14 -0.27 -0.03 0.00 1.01 0.00 0.00 36.73 37.58 1i0h h TYR 34 CO 0.02 0.70 0.12 0.28 -1.05 0.00 0.00 178.16 178.23 1i0h h VAL 35 N 0.82 0.94 -0.31 -2.88 2.07 -0.92 -0.39 116.25 115.58 1i0h h VAL 35 Ca 0.20 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.60 1i0h h VAL 35 Cb 0.18 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 1i0h h VAL 35 CO -0.02 0.05 0.11 0.78 0.02 0.00 0.00 177.57 178.51 1i0h h ASN 36 N 0.27 0.44 0.31 0.57 2.35 -0.73 -0.46 115.58 118.34 1i0h h ASN 36 Ca 0.14 -0.19 -0.19 0.00 -0.55 0.00 0.00 56.30 55.51 1i0h h ASN 36 Cb 0.09 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 1i0h h ASN 36 CO -0.13 0.52 -0.77 0.78 -1.65 0.00 0.00 177.43 176.18 1i0h h ASN 37 N 0.35 0.45 -0.26 5.81 2.35 -0.98 -1.20 115.58 122.11 1i0h h ASN 37 Ca 0.10 -0.31 -0.00 0.00 -0.55 0.00 0.00 56.30 55.54 1i0h h ASN 37 Cb 0.23 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 1i0h h ASN 37 CO -0.00 1.06 0.15 0.00 -1.65 0.00 0.00 177.43 176.99 1i0h h ALA 38 N 0.93 0.33 -0.88 -0.83 0.00 -0.99 -2.64 119.26 115.18 1i0h h ALA 38 Ca -0.04 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1i0h h ALA 38 Cb 1.35 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 1i0h h ALA 38 CO 0.13 -0.16 0.58 -0.91 0.00 0.00 0.00 179.25 178.89 1i0h h ASN 39 N 0.32 1.01 -0.81 0.00 2.35 -0.80 -1.25 115.58 116.39 1i0h h ASN 39 Ca 0.09 -0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.79 1i0h h ASN 39 Cb 0.03 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 38.12 1i0h h ASN 39 CO -0.02 0.73 0.39 0.00 -1.65 0.00 0.00 177.43 176.88 1i0h h ALA 40 N 1.45 1.04 0.00 -0.83 0.00 -1.07 -2.18 119.26 117.68 1i0h h ALA 40 Ca 0.32 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1i0h h ALA 40 Cb -0.14 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.33 1i0h h ALA 40 CO -0.07 0.60 -0.18 0.00 0.00 0.00 0.00 179.25 179.60 1i0h h ALA 41 N 1.21 0.97 -0.00 0.00 0.00 -1.01 -3.08 119.26 117.33 1i0h h ALA 41 Ca 0.28 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1i0h h ALA 41 Cb 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1i0h h ALA 41 CO -0.04 0.23 -0.52 1.28 0.00 0.00 0.00 179.25 180.20 1i0h n LEU 42 N -3.27 0.66 -0.20 0.00 4.77 -0.54 -4.20 117.00 114.23 1i0h n LEU 42 Ca 0.01 -0.11 0.04 0.00 -0.03 0.00 0.00 56.01 55.92 1i0h n LEU 42 Cb 0.46 -0.20 0.30 0.00 -2.33 0.00 0.00 43.42 41.66 1i0h n LEU 42 CO 0.33 0.15 1.23 -0.08 -1.33 0.00 0.00 177.39 177.69 1i0h h GLU 43 N 0.22 0.85 -0.11 3.23 4.57 -1.37 0.07 114.58 122.03 1i0h h GLU 43 Ca 0.00 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 1i0h h GLU 43 Cb 0.51 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1i0h h GLU 43 CO 0.00 0.56 0.00 -1.13 -1.18 0.00 0.00 179.01 177.26 1i0h n SER 44 N -4.46 1.25 -3.20 1.04 3.41 -1.26 -4.43 113.62 105.98 1i0h n SER 44 Ca 0.10 -1.62 -0.25 0.00 -0.26 0.00 0.00 58.87 56.84 1i0h n SER 44 Cb 0.14 -0.07 -0.06 0.00 -0.26 0.00 0.00 64.21 63.96 1i0h n SER 44 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1i0h n LEU 45 N 0.04 3.09 0.23 1.04 4.77 0.01 -4.92 117.00 121.26 1i0h n LEU 45 Ca 0.16 -5.36 0.16 0.00 -0.03 0.00 0.00 56.01 50.94 1i0h n LEU 45 Cb 0.27 -0.25 0.79 0.00 -2.33 0.00 0.00 43.42 41.90 1i0h n LEU 45 CO 0.13 2.19 0.97 1.55 -1.33 0.00 0.00 177.39 180.90 1i0h h PRO 46 N 3.60 0.00 0.00 3.23 0.13 -1.77 0.10 132.00 137.28 1i0h h PRO 46 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1i0h h PRO 46 Cb 0.68 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 1i0h h PRO 46 CO 0.73 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.43 1i0h h GLU 47 N 0.00 0.00 0.00 0.86 3.07 -1.92 -3.31 114.58 113.28 1i0h h GLU 47 Ca 0.00 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.79 1i0h h GLU 47 Cb 0.11 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 1i0h h GLU 47 CO 0.00 0.00 -1.49 1.19 -1.40 0.00 0.00 179.01 177.31 1i0h n PHE 48 N -2.59 0.00 0.29 4.33 3.72 0.16 -4.68 117.46 118.70 1i0h n PHE 48 Ca 0.04 0.00 0.18 0.00 -0.05 0.00 0.00 57.45 57.62 1i0h n PHE 48 Cb 0.38 -0.30 0.86 0.00 -0.94 0.00 0.00 39.48 39.49 1i0h n PHE 48 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1i0h h ALA 49 N 0.66 1.04 0.00 4.37 0.00 -1.11 -2.53 119.26 121.68 1i0h h ALA 49 Ca -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1i0h h ALA 49 Cb 0.90 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1i0h h ALA 49 CO 0.01 0.03 -0.45 -0.91 0.00 0.00 0.00 179.25 177.92 1i0h h ASN 50 N 0.00 0.00 -3.93 0.00 2.35 -1.83 -3.38 115.58 108.79 1i0h h ASN 50 Ca -0.00 -0.13 -0.51 0.00 -0.55 0.00 0.00 56.30 55.11 1i0h h ASN 50 Cb 0.33 0.00 0.05 0.00 0.05 0.00 0.00 38.32 38.75 1i0h h ASN 50 CO 0.00 0.07 0.53 -0.76 -1.65 0.00 0.00 177.43 175.62 1i0h s LEU 51 N -4.48 4.25 0.38 1.61 1.02 -0.96 -4.98 118.68 115.52 1i0h s LEU 51 Ca 0.07 2.42 -0.27 0.00 0.02 0.00 0.00 54.13 56.38 1i0h s LEU 51 Cb 0.12 -3.94 -0.11 0.00 0.02 0.00 0.00 46.19 42.28 1i0h s LEU 51 CO 0.69 -0.65 1.20 -2.65 0.02 0.00 0.00 176.35 174.96 1i0h n PRO 52 N 0.24 1.84 -0.01 1.29 -0.02 -1.26 -4.76 135.00 132.32 1i0h n PRO 52 Ca 0.03 0.65 0.07 0.00 -2.02 0.00 0.00 63.50 62.23 1i0h n PRO 52 Cb 0.45 -2.24 0.47 0.00 -0.02 0.00 0.00 33.50 32.16 1i0h n PRO 52 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1i0h h VAL 53 N 2.16 1.03 0.00 -1.45 3.04 -1.96 0.28 116.25 119.35 1i0h h VAL 53 Ca -0.46 -0.16 -0.00 0.00 -1.01 0.00 0.00 66.70 65.07 1i0h h VAL 53 Cb 1.30 0.52 -0.00 0.00 -2.01 0.00 0.00 31.29 31.10 1i0h h VAL 53 CO 0.60 0.08 -0.02 -0.33 -1.01 0.00 0.00 177.57 176.90 1i0h h GLU 54 N 0.47 0.00 0.13 4.17 3.07 -1.92 -2.30 114.58 118.20 1i0h h GLU 54 Ca 0.18 0.00 -0.35 0.00 -0.50 0.00 0.00 59.36 58.69 1i0h h GLU 54 Cb 0.14 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.04 1i0h h GLU 54 CO -0.04 0.02 -1.88 1.49 -1.40 0.00 0.00 179.01 177.20 1i0h h GLU 55 N 0.00 0.28 -0.93 2.33 4.81 -1.36 -3.36 114.58 116.34 1i0h h GLU 55 Ca -0.00 -0.49 0.09 0.00 -0.13 0.00 0.00 59.36 58.83 1i0h h GLU 55 Cb 0.54 0.18 -0.07 0.00 0.63 0.00 0.00 28.75 30.03 1i0h h GLU 55 CO 0.00 1.19 0.58 1.25 -0.73 0.00 0.00 179.01 181.30 1i0h h LEU 56 N 0.08 0.88 0.00 1.64 7.12 -0.77 -0.76 115.31 123.50 1i0h h LEU 56 Ca -0.38 0.03 0.00 0.00 0.13 0.00 0.00 57.88 57.66 1i0h h LEU 56 Cb 2.05 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 42.03 1i0h h LEU 56 CO 0.12 0.52 0.00 2.30 -0.13 0.00 0.00 178.44 181.25 1i0h n ILE 57 N -4.62 0.33 1.49 4.05 -5.35 -0.90 -0.87 119.36 113.50 1i0h n ILE 57 Ca 0.15 0.08 0.14 0.00 -0.27 0.00 0.00 62.75 62.86 1i0h n ILE 57 Cb 0.26 -0.69 0.55 0.00 -1.74 0.00 0.00 39.64 38.02 1i0h n ILE 57 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1i0h n THR 58 N -1.38 0.00 -1.75 7.28 -2.24 -0.30 -3.76 114.28 112.12 1i0h n THR 58 Ca 0.09 -0.18 0.05 0.00 -2.27 0.00 0.00 64.05 61.74 1i0h n THR 58 Cb 0.23 0.32 0.09 0.00 -2.10 0.00 0.00 70.33 68.87 1i0h n THR 58 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1i0h n LYS 59 N -0.22 0.75 0.23 -0.78 5.02 -0.04 -4.83 118.16 118.28 1i0h n LYS 59 Ca 0.18 -2.23 0.07 0.00 -2.02 0.00 0.00 58.31 54.31 1i0h n LYS 59 Cb 0.32 -0.94 0.54 0.00 -0.02 0.00 0.00 35.03 34.93 1i0h n LYS 59 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1i0h h LEU 60 N 0.47 0.00 -2.25 -0.35 3.38 -1.72 -0.63 115.31 114.21 1i0h h LEU 60 Ca -0.05 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.97 1i0h h LEU 60 Cb 1.30 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.05 1i0h h LEU 60 CO 0.02 0.21 0.22 0.44 0.09 0.00 0.00 178.44 179.42 1i0h h ASP 61 N 0.00 0.00 0.82 -0.43 3.32 -1.91 -2.49 116.42 115.73 1i0h h ASP 61 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1i0h h ASP 61 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 1i0h h ASP 61 CO 0.03 0.00 -0.53 0.00 -1.72 0.00 0.00 179.24 177.02 1i0h n GLN 62 N -3.63 0.21 -1.44 3.56 6.02 -0.24 -4.92 117.38 116.94 1i0h n GLN 62 Ca 0.01 0.07 -0.31 0.00 -0.01 0.00 0.00 57.00 56.76 1i0h n GLN 62 Cb 0.33 -1.64 0.07 0.00 1.02 0.00 0.00 30.24 30.02 1i0h n GLN 62 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1i0h s LEU 63 N -3.89 3.10 0.55 1.08 1.43 -0.94 -5.01 118.68 115.01 1i0h s LEU 63 Ca 0.08 1.74 -0.21 0.00 -1.03 0.00 0.00 54.13 54.71 1i0h s LEU 63 Cb 0.15 -4.51 -0.05 0.00 0.03 0.00 0.00 46.19 41.81 1i0h s LEU 63 CO 0.70 -1.74 1.30 -2.65 0.23 0.00 0.00 176.35 174.19 1i0h n PRO 64 N -3.27 1.57 -0.30 1.29 -0.02 -1.26 -4.83 135.00 128.18 1i0h n PRO 64 Ca 0.08 0.58 0.12 0.00 -2.02 0.00 0.00 63.50 62.27 1i0h n PRO 64 Cb 0.53 -2.51 0.29 0.00 -0.02 0.00 0.00 33.50 31.79 1i0h n PRO 64 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1i0h h ALA 65 N 1.29 1.36 -0.02 3.55 0.00 -1.96 0.77 119.26 124.25 1i0h h ALA 65 Ca -0.50 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1i0h h ALA 65 Cb 1.31 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1i0h h ALA 65 CO 0.56 -0.36 0.00 -0.40 0.00 0.00 0.00 179.25 179.06 1i0h n ASP 66 N -5.08 0.29 -0.00 0.00 5.75 -1.26 -2.84 116.55 113.41 1i0h n ASP 66 Ca 0.21 -1.33 0.06 0.00 -0.01 0.00 0.00 54.79 53.72 1i0h n ASP 66 Cb 0.63 -0.01 -0.08 0.00 -1.03 0.00 0.00 41.12 40.63 1i0h n ASP 66 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1i0h n LYS 67 N -0.66 1.85 -0.02 0.11 4.76 0.24 -4.76 118.16 119.67 1i0h n LYS 67 Ca 0.18 -0.05 -0.11 0.00 -2.87 0.00 0.00 58.31 55.46 1i0h n LYS 67 Cb 0.13 -1.17 -0.05 0.00 -1.84 0.00 0.00 35.03 32.09 1i0h n LYS 67 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1i0h h LYS 68 N 0.00 0.18 -0.07 1.97 3.64 -1.35 -2.61 116.57 118.33 1i0h h LYS 68 Ca 0.00 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 1i0h h LYS 68 Cb 0.41 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1i0h h LYS 68 CO 0.00 0.20 -0.09 1.15 -2.27 0.00 0.00 179.45 178.44 1i0h h THR 69 N 0.10 1.39 -0.37 1.00 2.02 -1.86 -0.41 112.91 114.79 1i0h h THR 69 Ca 0.04 -1.32 -0.02 0.00 0.77 0.00 0.00 66.41 65.88 1i0h h THR 69 Cb 0.08 2.11 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 1i0h h THR 69 CO -0.01 0.37 0.14 1.62 0.37 0.00 0.00 175.52 178.01 1i0h h VAL 70 N -0.28 1.15 0.07 3.16 3.04 -1.86 -0.92 116.25 120.61 1i0h h VAL 70 Ca 0.01 -0.46 -0.29 0.00 -1.01 0.00 0.00 66.70 64.95 1i0h h VAL 70 Cb 0.64 0.71 -0.02 0.00 -2.01 0.00 0.00 31.29 30.61 1i0h h VAL 70 CO 0.02 0.18 -1.51 -0.07 -1.01 0.00 0.00 177.57 175.18 1i0h h LEU 71 N 0.52 0.23 -0.44 3.16 3.38 -1.45 -1.30 115.31 119.42 1i0h h LEU 71 Ca 0.13 -0.35 0.08 0.00 0.09 0.00 0.00 57.88 57.83 1i0h h LEU 71 Cb 0.11 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 1i0h h LEU 71 CO -0.01 1.29 0.05 -0.09 0.09 0.00 0.00 178.44 179.77 1i0h h ARG 72 N 0.04 0.17 -0.16 1.13 2.43 -0.77 0.18 114.38 117.40 1i0h h ARG 72 Ca -0.22 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 58.88 1i0h h ARG 72 Cb 1.97 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 31.48 1i0h h ARG 72 CO 0.13 0.11 -0.10 -0.91 -1.51 0.00 0.00 179.97 177.69 1i0h h ASN 73 N 0.17 0.37 0.11 -3.80 2.35 -1.18 -1.77 115.58 111.83 1i0h h ASN 73 Ca 0.22 -0.43 -0.37 0.00 -0.55 0.00 0.00 56.30 55.17 1i0h h ASN 73 Cb 0.29 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 1i0h h ASN 73 CO -0.32 0.72 -2.06 0.59 -1.65 0.00 0.00 177.43 174.72 1i0h n ASN 74 N -4.60 2.10 -0.18 5.81 3.02 -0.49 -1.55 115.26 119.37 1i0h n ASN 74 Ca -0.06 0.16 -0.08 0.00 -0.03 0.00 0.00 54.58 54.58 1i0h n ASN 74 Cb 0.32 -0.80 0.06 0.00 -0.61 0.00 0.00 39.78 38.76 1i0h n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i0h h ALA 75 N 0.05 0.90 -0.44 5.41 0.00 -0.81 -0.63 119.26 123.75 1i0h h ALA 75 Ca -0.45 -0.31 0.05 0.00 0.00 0.00 0.00 54.91 54.21 1i0h h ALA 75 Cb 2.00 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 19.53 1i0h h ALA 75 CO 0.06 0.65 0.17 0.78 0.00 0.00 0.00 179.25 180.91 1i0h h GLY 76 N 0.99 0.58 1.01 0.00 0.00 -1.20 0.43 103.07 104.87 1i0h h GLY 76 Ca 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1i0h h GLY 76 CO 0.03 0.04 0.47 -1.33 0.00 0.00 0.00 176.54 175.75 1i0h h GLY 77 N 0.35 1.05 0.89 4.60 0.00 -0.95 0.19 103.07 109.21 1i0h h GLY 77 Ca 0.20 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 1i0h h GLY 77 CO -0.19 0.40 0.01 0.84 0.00 0.00 0.00 176.54 177.61 1i0h h HIS 78 N 1.00 0.60 -0.35 5.60 6.17 -0.78 -1.44 115.15 125.95 1i0h h HIS 78 Ca 0.27 -0.10 -0.01 0.00 0.71 0.00 0.00 60.37 61.24 1i0h h HIS 78 Cb -0.08 -0.16 -0.02 0.00 2.52 0.00 0.00 27.41 29.67 1i0h h HIS 78 CO -0.02 0.67 0.20 0.00 0.71 0.00 0.00 177.93 179.49 1i0h h ALA 79 N 0.85 0.45 -0.41 5.26 0.00 -0.64 -1.84 119.26 122.92 1i0h h ALA 79 Ca 0.09 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1i0h h ALA 79 Cb 0.42 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1i0h h ALA 79 CO 0.01 -0.03 -0.02 -0.91 0.00 0.00 0.00 179.25 178.30 1i0h h ASN 80 N 0.45 0.73 -0.08 0.00 2.35 -0.83 -1.85 115.58 116.35 1i0h h ASN 80 Ca 0.12 -0.32 -0.13 0.00 -0.55 0.00 0.00 56.30 55.43 1i0h h ASN 80 Cb 0.04 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1i0h h ASN 80 CO -0.02 0.88 -0.37 0.45 -1.65 0.00 0.00 177.43 176.71 1i0h h HIS 81 N 0.57 0.69 -0.83 1.19 3.86 -1.24 -0.33 115.15 119.07 1i0h h HIS 81 Ca 0.11 -0.19 0.00 0.00 -1.16 0.00 0.00 60.37 59.14 1i0h h HIS 81 Cb 0.51 -0.15 -0.04 0.00 1.06 0.00 0.00 27.41 28.79 1i0h h HIS 81 CO 0.04 0.88 0.53 0.77 0.86 0.00 0.00 177.93 181.01 1i0h h SER 82 N 0.49 0.97 -0.20 2.45 0.02 -1.11 -1.26 113.55 114.92 1i0h h SER 82 Ca 0.05 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1i0h h SER 82 Cb 0.87 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.16 1i0h h SER 82 CO 0.07 0.72 0.06 0.25 -1.14 0.00 0.00 176.83 176.79 1i0h h LEU 83 N 1.13 0.29 -0.43 5.07 6.46 -1.11 -3.16 115.31 123.56 1i0h h LEU 83 Ca 0.30 -0.21 0.08 0.00 -0.12 0.00 0.00 57.88 57.93 1i0h h LEU 83 Cb -0.10 -0.08 -0.07 0.00 -0.73 0.00 0.00 40.66 39.69 1i0h h LEU 83 CO -0.06 0.42 0.04 0.15 -0.62 0.00 0.00 178.44 178.37 1i0h h PHE 84 N 0.14 0.05 -0.61 1.25 3.57 -0.49 -0.59 116.94 120.26 1i0h h PHE 84 Ca 0.06 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.57 1i0h h PHE 84 Cb 0.24 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 1i0h h PHE 84 CO 0.00 -0.05 0.31 -1.49 -2.23 0.00 0.00 178.31 174.85 1i0h h TRP 85 N 0.15 0.86 0.00 0.41 -0.00 -1.27 -0.97 115.95 115.13 1i0h h TRP 85 Ca 0.21 -0.03 -0.00 0.00 -0.00 0.00 0.00 58.89 59.07 1i0h h TRP 85 Cb 0.29 -0.27 -0.00 0.00 -0.00 0.00 0.00 29.16 29.19 1i0h h TRP 85 CO -0.25 0.64 -0.02 0.87 -0.00 0.00 0.00 178.44 179.68 1i0h h LYS 86 N 0.83 0.00 -0.43 0.49 1.57 -1.41 -3.06 116.57 114.56 1i0h h LYS 86 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1i0h h LYS 86 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1i0h h LYS 86 CO -0.03 0.02 0.00 0.41 -0.57 0.00 0.00 179.45 179.28 1i0h n GLY 87 N -0.22 1.07 3.21 3.86 0.00 -0.27 -4.78 105.19 108.06 1i0h n GLY 87 Ca -0.00 -0.49 -0.27 0.00 0.00 0.00 0.00 46.02 45.25 1i0h n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i0h s LEU 88 N -1.05 2.02 -0.28 0.99 1.43 -1.16 -0.72 118.68 119.91 1i0h s LEU 88 Ca 0.31 -0.39 -0.26 0.00 -1.03 0.00 0.00 54.13 52.76 1i0h s LEU 88 Cb 0.16 -1.08 0.17 0.00 0.03 0.00 0.00 46.19 45.46 1i0h s LEU 88 CO 0.21 0.23 1.27 -0.75 0.23 0.00 0.00 176.35 177.55 1i0h s LYS 89 N -0.34 0.24 0.54 1.70 2.20 0.54 -4.71 119.74 119.91 1i0h s LYS 89 Ca 0.04 0.21 -0.11 0.00 -0.36 0.00 0.00 55.97 55.76 1i0h s LYS 89 Cb -0.09 0.11 -0.05 0.00 -1.51 0.00 0.00 37.83 36.29 1i0h s LYS 89 CO 0.00 -0.04 0.94 0.15 -0.36 0.00 0.00 175.35 176.04 1i0h s LYS 90 N -0.19 3.69 0.00 4.03 1.02 -1.26 -4.29 119.74 122.73 1i0h s LYS 90 Ca 0.06 0.65 0.00 0.00 0.02 0.00 0.00 55.97 56.69 1i0h s LYS 90 Cb -0.04 -2.19 0.00 0.00 -0.52 0.00 0.00 37.83 35.08 1i0h s LYS 90 CO -0.10 -0.36 0.00 0.41 -0.92 0.00 0.00 175.35 174.38 1i0h n GLY 91 N -2.21 0.75 3.90 -3.33 0.00 -1.26 -5.04 105.19 97.99 1i0h n GLY 91 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1i0h n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i0h s THR 92 N -2.65 4.69 -0.09 2.61 -4.23 -1.26 -5.09 115.64 109.62 1i0h s THR 92 Ca 0.00 0.27 0.01 0.00 -1.18 0.00 0.00 61.69 60.78 1i0h s THR 92 Cb 0.00 -3.80 0.02 0.00 1.34 0.00 0.00 72.50 70.06 1i0h s THR 92 CO 0.00 -0.83 -0.09 -0.89 -0.54 0.00 0.00 174.62 172.27 1i0h s THR 93 N -2.84 1.00 0.10 3.99 2.01 -1.26 -4.91 115.64 113.73 1i0h s THR 93 Ca 0.49 -0.32 -0.31 0.00 0.31 0.00 0.00 61.69 61.86 1i0h s THR 93 Cb -0.10 -0.99 -0.09 0.00 0.01 0.00 0.00 72.50 71.33 1i0h s THR 93 CO 0.46 0.35 1.68 -0.22 -0.69 0.00 0.00 174.62 176.20 1i0h s LEU 94 N 1.31 4.37 0.37 4.42 2.96 -1.26 -4.83 118.68 126.02 1i0h s LEU 94 Ca -0.03 2.58 -0.15 0.00 -0.22 0.00 0.00 54.13 56.31 1i0h s LEU 94 Cb -0.14 -3.57 0.05 0.00 0.50 0.00 0.00 46.19 43.03 1i0h s LEU 94 CO -0.04 -0.90 0.75 0.00 -1.32 0.00 0.00 176.35 174.84 1i0h s GLN 95 N 2.35 2.16 4.08 1.98 -2.07 -1.26 -4.87 119.66 122.02 1i0h s GLN 95 Ca 0.75 -1.42 0.00 0.00 -1.82 0.00 0.00 55.36 52.87 1i0h s GLN 95 Cb -0.42 0.61 0.00 0.00 -1.09 0.00 0.00 33.01 32.11 1i0h s GLN 95 CO 0.33 -1.00 0.00 0.41 -1.32 0.00 0.00 175.29 173.71 1i0h n GLY 96 N -0.52 1.02 0.38 2.60 0.00 -1.26 -2.36 105.19 105.04 1i0h n GLY 96 Ca -0.07 -0.67 -0.02 0.00 0.00 0.00 0.00 46.02 45.26 1i0h n GLY 96 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1i0h h ASP 97 N 8.95 1.15 -0.26 1.61 3.32 -1.99 -1.82 116.42 127.39 1i0h h ASP 97 Ca 0.00 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 56.98 1i0h h ASP 97 Cb 0.00 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 1i0h h ASP 97 CO 0.00 0.83 -0.00 0.25 -1.72 0.00 0.00 179.24 178.59 1i0h h LEU 98 N 1.35 0.45 -0.47 1.55 5.85 -1.92 -0.16 115.31 121.96 1i0h h LEU 98 Ca 0.37 -0.31 0.07 0.00 0.84 0.00 0.00 57.88 58.84 1i0h h LEU 98 Cb -0.15 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.71 1i0h h LEU 98 CO -0.08 0.65 0.15 0.50 -0.34 0.00 0.00 178.44 179.32 1i0h h LYS 99 N 0.24 0.31 -0.43 1.25 3.64 -1.14 -1.03 116.57 119.40 1i0h h LYS 99 Ca 0.07 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.38 1i0h h LYS 99 Cb 0.42 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1i0h h LYS 99 CO 0.01 0.20 0.04 0.00 -2.27 0.00 0.00 179.45 177.44 1i0h h ALA 100 N 1.32 1.27 -0.23 5.00 0.00 -1.09 -0.21 119.26 125.32 1i0h h ALA 100 Ca 0.23 -0.21 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 1i0h h ALA 100 Cb 0.25 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1i0h h ALA 100 CO -0.24 0.50 -0.57 0.00 0.00 0.00 0.00 179.25 178.93 1i0h h ALA 101 N 1.41 0.56 -0.54 0.00 0.00 -0.53 0.43 119.26 120.59 1i0h h ALA 101 Ca 0.14 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 1i0h h ALA 101 Cb 0.34 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1i0h h ALA 101 CO 0.01 0.69 0.28 0.82 0.00 0.00 0.00 179.25 181.05 1i0h h ILE 102 N 0.55 1.19 -0.46 0.00 2.04 -0.91 0.22 117.51 120.15 1i0h h ILE 102 Ca 0.01 -0.51 -0.07 0.00 1.00 0.00 0.00 64.86 65.29 1i0h h ILE 102 Cb 1.15 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 1i0h h ILE 102 CO 0.12 0.21 -0.01 -0.33 0.00 0.00 0.00 178.15 178.14 1i0h h GLU 103 N 0.73 0.75 -0.26 2.37 5.08 -0.80 -0.57 114.58 121.88 1i0h h GLU 103 Ca 0.19 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1i0h h GLU 103 Cb 0.08 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1i0h h GLU 103 CO -0.03 0.77 0.09 -0.09 -1.00 0.00 0.00 179.01 178.74 1i0h h ARG 104 N 0.70 0.39 0.00 2.33 2.43 -0.53 0.06 114.38 119.77 1i0h h ARG 104 Ca 0.14 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1i0h h ARG 104 Cb 0.44 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1i0h h ARG 104 CO 0.02 0.46 -0.97 -0.25 -1.51 0.00 0.00 179.97 177.71 1i0h n ASP 105 N -4.75 0.82 -0.05 -3.80 8.00 0.03 -4.06 116.55 112.74 1i0h n ASP 105 Ca -0.03 0.28 0.01 0.00 0.71 0.00 0.00 54.79 55.76 1i0h n ASP 105 Cb 0.15 0.44 -0.00 0.00 -0.02 0.00 0.00 41.12 41.69 1i0h n ASP 105 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1i0h n PHE 106 N -2.58 0.00 0.00 1.24 3.72 -0.24 -4.99 117.46 114.61 1i0h n PHE 106 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1i0h n PHE 106 Cb 0.53 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.07 1i0h n PHE 106 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1i0h n GLY 107 N 0.59 2.53 3.55 1.37 0.00 0.01 -4.53 105.19 108.70 1i0h n GLY 107 Ca 0.01 -0.46 -0.08 0.00 0.00 0.00 0.00 46.02 45.49 1i0h n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i0h s SER 108 N 0.16 -0.38 0.19 1.61 1.04 -1.24 -4.81 113.70 110.27 1i0h s SER 108 Ca 0.00 -0.12 -0.11 0.00 0.48 0.00 0.00 55.95 56.20 1i0h s SER 108 Cb 0.00 0.49 0.11 0.00 0.10 0.00 0.00 66.02 66.72 1i0h s SER 108 CO 0.00 -0.83 1.77 0.58 0.98 0.00 0.00 173.24 175.75 1i0h h VAL 109 N 2.00 1.23 -0.64 5.02 2.07 -1.91 -2.28 116.25 121.74 1i0h h VAL 109 Ca -0.26 -0.66 -0.03 0.00 0.82 0.00 0.00 66.70 66.57 1i0h h VAL 109 Cb 1.26 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 1i0h h VAL 109 CO 0.31 0.27 0.26 0.44 0.02 0.00 0.00 177.57 178.88 1i0h h ASP 110 N 0.94 0.84 -0.37 0.57 3.32 -1.96 0.56 116.42 120.33 1i0h h ASP 110 Ca 0.23 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1i0h h ASP 110 Cb 0.13 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1i0h h ASP 110 CO -0.03 0.75 0.24 0.78 -1.72 0.00 0.00 179.24 179.26 1i0h h ASN 111 N 0.91 0.43 -0.27 6.45 2.35 -1.78 -1.21 115.58 122.46 1i0h h ASN 111 Ca 0.22 -0.03 0.05 0.00 -0.55 0.00 0.00 56.30 55.98 1i0h h ASN 111 Cb 0.16 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.38 1i0h h ASN 111 CO -0.02 0.33 -0.00 0.15 -1.65 0.00 0.00 177.43 176.24 1i0h h PHE 112 N 0.49 -0.02 -0.92 1.19 3.57 -0.79 -1.36 116.94 119.10 1i0h h PHE 112 Ca 0.13 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.66 1i0h h PHE 112 Cb -0.03 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 38.71 1i0h h PHE 112 CO -0.04 -0.05 0.58 0.87 -2.23 0.00 0.00 178.31 177.44 1i0h h LYS 113 N 0.08 1.23 -0.49 1.11 1.57 -0.51 0.53 116.57 120.10 1i0h h LYS 113 Ca 0.13 -0.09 -0.09 0.00 -1.87 0.00 0.00 60.65 58.72 1i0h h LYS 113 Cb 0.17 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 1i0h h LYS 113 CO -0.22 0.84 -0.08 0.00 -0.57 0.00 0.00 179.45 179.42 1i0h h ALA 114 N 1.38 0.95 -0.33 3.86 0.00 -0.83 0.45 119.26 124.74 1i0h h ALA 114 Ca 0.33 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1i0h h ALA 114 Cb -0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1i0h h ALA 114 CO -0.07 0.62 -0.25 1.49 0.00 0.00 0.00 179.25 181.04 1i0h h GLU 115 N 0.79 0.76 -0.30 0.00 4.81 -0.50 -1.28 114.58 118.86 1i0h h GLU 115 Ca 0.14 -0.37 -0.01 0.00 -0.13 0.00 0.00 59.36 58.98 1i0h h GLU 115 Cb 0.58 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 1i0h h GLU 115 CO 0.04 0.99 0.14 0.35 -0.73 0.00 0.00 179.01 179.80 1i0h h PHE 116 N 0.53 0.45 -0.75 0.92 3.57 -0.69 -1.07 116.94 119.90 1i0h h PHE 116 Ca 0.06 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 1i0h h PHE 116 Cb 0.82 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.38 1i0h h PHE 116 CO 0.07 0.41 0.41 0.93 -2.23 0.00 0.00 178.31 177.90 1i0h h GLU 117 N 0.35 1.06 -0.63 1.11 5.08 -0.85 0.54 114.58 121.24 1i0h h GLU 117 Ca 0.10 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1i0h h GLU 117 Cb 0.14 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 1i0h h GLU 117 CO -0.01 0.79 0.36 -0.22 -1.00 0.00 0.00 179.01 178.93 1i0h h LYS 118 N 1.05 0.86 -0.54 2.33 3.64 -1.02 0.15 116.57 123.04 1i0h h LYS 118 Ca 0.26 -0.09 -0.08 0.00 -1.27 0.00 0.00 60.65 59.48 1i0h h LYS 118 Cb 0.05 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 1i0h h LYS 118 CO -0.04 0.64 0.04 0.00 -2.27 0.00 0.00 179.45 177.82 1i0h h ALA 119 N 1.18 0.73 -0.52 5.00 0.00 -0.69 -1.20 119.26 123.76 1i0h h ALA 119 Ca 0.22 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1i0h h ALA 119 Cb 0.02 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1i0h h ALA 119 CO -0.04 0.51 -0.07 0.00 0.00 0.00 0.00 179.25 179.65 1i0h h ALA 120 N 0.97 0.90 0.00 0.00 0.00 -0.60 -2.88 119.26 117.66 1i0h h ALA 120 Ca 0.16 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 1i0h h ALA 120 Cb 0.48 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1i0h h ALA 120 CO 0.02 0.64 -0.76 0.00 0.00 0.00 0.00 179.25 179.14 1i0h h ALA 121 N 1.07 0.66 -0.04 0.00 0.00 -0.53 -3.30 119.26 117.12 1i0h h ALA 121 Ca 0.14 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1i0h h ALA 121 Cb 0.60 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1i0h h ALA 121 CO 0.04 0.96 0.00 -1.13 0.00 0.00 0.00 179.25 179.11 1i0h n SER 122 N -3.52 2.25 -4.55 0.00 3.41 -0.47 -4.76 113.62 105.98 1i0h n SER 122 Ca -0.00 -1.75 -0.38 0.00 -0.26 0.00 0.00 58.87 56.48 1i0h n SER 122 Cb 0.77 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.67 1i0h n SER 122 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1i0h s ARG 123 N -1.97 2.89 0.02 4.33 6.06 -1.10 -4.97 118.95 124.22 1i0h s ARG 123 Ca 0.33 0.03 -0.28 0.00 -2.50 0.00 0.00 55.73 53.31 1i0h s ARG 123 Cb 0.20 -4.52 -0.04 0.00 0.06 0.00 0.00 34.95 30.65 1i0h s ARG 123 CO 0.32 -2.59 0.89 0.12 -2.50 0.00 0.00 175.30 171.54 1i0h s PHE 124 N 7.74 3.69 0.00 5.12 5.36 -1.26 -4.72 117.98 133.91 1i0h s PHE 124 Ca 0.55 1.60 0.00 0.00 -0.96 0.00 0.00 56.93 58.12 1i0h s PHE 124 Cb -0.09 -3.00 0.00 0.00 -0.34 0.00 0.00 43.02 39.59 1i0h s PHE 124 CO 0.13 0.10 0.00 0.41 -1.46 0.00 0.00 175.22 174.39 1i0h n GLY 125 N 2.72 -0.19 3.86 13.12 0.00 -1.26 -4.92 105.19 118.52 1i0h n GLY 125 Ca 0.03 -1.18 -0.34 0.00 0.00 0.00 0.00 46.02 44.53 1i0h n GLY 125 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1i0h s SER 126 N -4.00 6.73 0.00 1.61 0.01 -1.26 -4.83 113.70 111.96 1i0h s SER 126 Ca 0.00 1.00 0.00 0.00 1.31 0.00 0.00 55.95 58.26 1i0h s SER 126 Cb 0.00 -2.26 0.00 0.00 0.21 0.00 0.00 66.02 63.97 1i0h s SER 126 CO 0.00 0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.28 1i0h n GLY 127 N 0.35 -0.51 2.99 3.44 0.00 -1.26 -0.81 105.19 109.39 1i0h n GLY 127 Ca -0.03 -0.95 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 1i0h n GLY 127 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1i0h s TRP 128 N -3.02 0.13 -0.03 1.61 0.52 -0.69 -0.98 118.94 116.48 1i0h s TRP 128 Ca 0.00 -0.26 0.03 0.00 0.02 0.00 0.00 56.10 55.89 1i0h s TRP 128 Cb 0.00 -0.10 -0.03 0.00 -1.15 0.00 0.00 33.47 32.19 1i0h s TRP 128 CO 0.00 -0.16 -0.09 0.00 0.02 0.00 0.00 176.95 176.72 1i0h s ALA 129 N -1.03 2.90 0.03 0.98 0.00 -0.40 -1.16 121.76 123.09 1i0h s ALA 129 Ca -0.11 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 50.91 1i0h s ALA 129 Cb -0.07 -1.11 -0.02 0.00 0.00 0.00 0.00 23.12 21.92 1i0h s ALA 129 CO -0.00 0.58 -0.10 -1.58 0.00 0.00 0.00 175.76 174.66 1i0h s TRP 130 N -0.86 0.85 -0.32 0.00 0.52 0.45 -0.47 118.94 119.10 1i0h s TRP 130 Ca 0.14 -0.37 -0.13 0.00 0.02 0.00 0.00 56.10 55.77 1i0h s TRP 130 Cb -0.11 -0.51 -0.03 0.00 -1.15 0.00 0.00 33.47 31.68 1i0h s TRP 130 CO 0.04 -0.02 0.25 -1.17 0.02 0.00 0.00 176.95 176.06 1i0h s LEU 131 N -1.15 4.38 0.20 2.99 2.96 -0.74 -1.77 118.68 125.55 1i0h s LEU 131 Ca -0.03 -0.28 0.10 0.00 -0.22 0.00 0.00 54.13 53.69 1i0h s LEU 131 Cb -0.08 -2.16 -0.04 0.00 0.50 0.00 0.00 46.19 44.41 1i0h s LEU 131 CO 0.01 -0.20 -0.13 0.68 -1.32 0.00 0.00 176.35 175.38 1i0h s VAL 132 N 1.77 2.94 -0.25 1.68 -7.23 0.06 -0.29 120.40 119.08 1i0h s VAL 132 Ca 0.07 -1.86 -0.09 0.00 -1.81 0.00 0.00 61.98 58.30 1i0h s VAL 132 Cb -0.17 -2.47 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 1i0h s VAL 132 CO 0.11 -0.17 0.11 -0.22 -0.31 0.00 0.00 175.10 174.61 1i0h s LEU 133 N -2.96 3.66 -0.53 1.32 2.96 0.15 -0.90 118.68 122.38 1i0h s LEU 133 Ca 0.25 -0.11 -0.08 0.00 -0.22 0.00 0.00 54.13 53.97 1i0h s LEU 133 Cb -0.08 -1.99 0.14 0.00 0.50 0.00 0.00 46.19 44.76 1i0h s LEU 133 CO 0.14 -0.02 0.39 -0.54 -1.32 0.00 0.00 176.35 175.01 1i0h s LYS 134 N 1.54 2.56 0.57 1.98 1.02 -0.20 -1.24 119.74 125.97 1i0h s LYS 134 Ca 0.06 -1.98 0.00 0.00 0.02 0.00 0.00 55.97 54.08 1i0h s LYS 134 Cb -0.15 -3.91 0.00 0.00 -0.52 0.00 0.00 37.83 33.25 1i0h s LYS 134 CO 0.06 -1.19 0.00 0.41 -0.92 0.00 0.00 175.35 173.71 1i0h n GLY 135 N 4.53 0.45 0.00 -3.33 0.00 -1.26 -1.87 105.19 103.71 1i0h n GLY 135 Ca -0.02 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.72 1i0h n GLY 135 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1i0h n ASP 136 N 1.88 0.70 -4.08 1.61 9.92 -1.26 -4.94 116.55 120.37 1i0h n ASP 136 Ca 0.00 -1.16 -0.26 0.00 -0.53 0.00 0.00 54.79 52.84 1i0h n ASP 136 Cb 0.00 0.00 -0.16 0.00 -0.64 0.00 0.00 41.12 40.32 1i0h n ASP 136 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1i0h s LYS 137 N -0.16 1.84 0.44 -1.24 2.20 -0.78 -5.11 119.74 116.92 1i0h s LYS 137 Ca 0.00 -0.52 -0.22 0.00 -0.36 0.00 0.00 55.97 54.87 1i0h s LYS 137 Cb 0.00 -1.52 -0.08 0.00 -1.51 0.00 0.00 37.83 34.71 1i0h s LYS 137 CO 0.00 0.11 1.06 -0.51 -0.36 0.00 0.00 175.35 175.66 1i0h s LEU 138 N 0.41 4.00 0.04 5.43 1.43 -1.26 -1.03 118.68 127.70 1i0h s LEU 138 Ca -0.11 2.04 -0.16 0.00 -1.03 0.00 0.00 54.13 54.86 1i0h s LEU 138 Cb -0.14 -4.35 0.03 0.00 0.03 0.00 0.00 46.19 41.76 1i0h s LEU 138 CO 0.04 -0.68 0.36 0.00 0.23 0.00 0.00 176.35 176.30 1i0h s ALA 139 N -1.77 -0.87 -0.22 4.21 0.00 -0.08 -4.93 121.76 118.11 1i0h s ALA 139 Ca 0.63 0.19 -0.09 0.00 0.00 0.00 0.00 51.96 52.68 1i0h s ALA 139 Cb -0.21 0.32 -0.04 0.00 0.00 0.00 0.00 23.12 23.19 1i0h s ALA 139 CO 0.25 -0.43 0.12 0.08 0.00 0.00 0.00 175.76 175.78 1i0h s VAL 140 N -2.45 5.02 0.20 0.00 1.01 -1.26 -0.76 120.40 122.15 1i0h s VAL 140 Ca -0.06 0.06 0.01 0.00 0.00 0.00 0.00 61.98 61.99 1i0h s VAL 140 Cb -0.01 -3.32 -0.05 0.00 0.00 0.00 0.00 36.38 33.01 1i0h s VAL 140 CO -0.02 0.38 0.05 0.68 0.00 0.00 0.00 175.10 176.18 1i0h s VAL 141 N 0.93 0.52 0.11 2.92 -7.23 -0.73 -5.00 120.40 111.93 1i0h s VAL 141 Ca 0.06 -1.98 0.02 0.00 -1.81 0.00 0.00 61.98 58.27 1i0h s VAL 141 Cb -0.13 -2.30 -0.04 0.00 0.56 0.00 0.00 36.38 34.46 1i0h s VAL 141 CO 0.03 -0.29 -0.07 -0.94 -0.31 0.00 0.00 175.10 173.52 1i0h s SER 142 N -3.20 1.32 0.12 4.85 1.04 -1.26 -0.41 113.70 116.16 1i0h s SER 142 Ca 0.29 -1.02 0.04 0.00 0.48 0.00 0.00 55.95 55.75 1i0h s SER 142 Cb 0.07 0.07 -0.04 0.00 0.10 0.00 0.00 66.02 66.22 1i0h s SER 142 CO 0.07 -0.43 -0.11 0.42 0.98 0.00 0.00 173.24 174.17 1i0h s THR 143 N -3.54 1.11 0.28 2.02 -4.23 -0.31 -4.74 115.64 106.22 1i0h s THR 143 Ca 0.14 -1.85 -0.20 0.00 -1.18 0.00 0.00 61.69 58.59 1i0h s THR 143 Cb 0.05 -1.62 -0.09 0.00 1.34 0.00 0.00 72.50 72.18 1i0h s THR 143 CO -0.03 -0.63 0.79 0.00 -0.54 0.00 0.00 174.62 174.21 1i0h s ALA 144 N -2.82 3.33 0.00 3.99 0.00 -1.26 -1.70 121.76 123.29 1i0h s ALA 144 Ca 0.11 0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.31 1i0h s ALA 144 Cb -0.01 -2.91 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1i0h s ALA 144 CO 0.01 0.28 0.00 0.09 0.00 0.00 0.00 175.76 176.14 1i0h n ASN 145 N 0.39 0.00 -1.35 0.00 3.02 0.01 -1.01 115.26 116.31 1i0h n ASN 145 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1i0h n ASN 145 Cb 0.51 0.00 0.26 0.00 -0.61 0.00 0.00 39.78 39.94 1i0h n ASN 145 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i0h n GLN 146 N 14.00 2.92 -1.84 3.52 1.13 -1.26 -4.05 117.38 131.79 1i0h n GLN 146 Ca 0.00 -3.02 -0.34 0.00 -1.94 0.00 0.00 57.00 51.70 1i0h n GLN 146 Cb 0.00 -1.97 0.04 0.00 0.11 0.00 0.00 30.24 28.42 1i0h n GLN 146 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1i0h s ASP 147 N -1.78 5.06 0.06 1.08 1.01 -0.18 -4.03 116.67 117.89 1i0h s ASP 147 Ca 0.47 2.18 0.06 0.00 0.71 0.00 0.00 52.55 55.97 1i0h s ASP 147 Cb 0.39 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.72 1i0h s ASP 147 CO 0.08 -1.67 -0.17 -0.55 0.21 0.00 0.00 175.17 173.07 1i0h s SER 148 N -2.12 2.00 0.66 0.27 0.15 -1.26 -4.74 113.70 108.65 1i0h s SER 148 Ca 0.72 -0.56 0.43 0.00 0.70 0.00 0.00 55.95 57.23 1i0h s SER 148 Cb -0.25 -0.11 2.33 0.00 -1.71 0.00 0.00 66.02 66.28 1i0h s SER 148 CO 0.38 0.03 2.34 1.55 1.20 0.00 0.00 173.24 178.74 1i0h h PRO 149 N 4.55 0.00 0.00 5.44 0.13 -1.84 -0.03 132.00 140.25 1i0h h PRO 149 Ca -0.41 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1i0h h PRO 149 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1i0h h PRO 149 CO 0.42 0.00 -0.01 -0.07 -0.23 0.00 0.00 178.00 178.11 1i0h h LEU 150 N 0.00 0.00 -0.78 1.56 3.38 -1.88 -1.86 115.31 115.73 1i0h h LEU 150 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i0h h LEU 150 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1i0h h LEU 150 CO 0.00 0.01 0.00 0.24 0.09 0.00 0.00 178.44 178.78 1i0h h MET 151 N 0.00 0.00 0.00 1.13 2.86 -1.08 -3.37 114.93 114.47 1i0h h MET 151 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1i0h h MET 151 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1i0h h MET 151 CO 0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 1i0h n GLY 152 N 0.47 0.23 0.17 8.32 0.00 -0.70 -4.52 105.19 109.17 1i0h n GLY 152 Ca 0.02 -1.81 -0.09 0.00 0.00 0.00 0.00 46.02 44.15 1i0h n GLY 152 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1i0h h GLU 153 N 0.00 0.52 -0.55 1.61 4.39 -1.69 -0.06 114.58 118.79 1i0h h GLU 153 Ca 0.00 -0.08 0.07 0.00 0.34 0.00 0.00 59.36 59.69 1i0h h GLU 153 Cb 0.00 -0.09 -0.06 0.00 -0.10 0.00 0.00 28.75 28.50 1i0h h GLU 153 CO 0.00 0.48 0.25 0.00 -1.16 0.00 0.00 179.01 178.57 1i0h h ALA 154 N 1.02 0.71 0.07 3.43 0.00 -1.86 0.56 119.26 123.18 1i0h h ALA 154 Ca 0.12 0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.94 1i0h h ALA 154 Cb 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1i0h h ALA 154 CO -0.01 -0.13 -0.68 0.82 0.00 0.00 0.00 179.25 179.24 1i0h h ILE 155 N 0.46 1.47 0.00 0.00 2.04 -1.77 -3.40 117.51 116.30 1i0h h ILE 155 Ca 0.26 -2.41 0.00 0.00 1.00 0.00 0.00 64.86 63.71 1i0h h ILE 155 Cb 0.24 3.08 0.00 0.00 -0.74 0.00 0.00 36.82 39.40 1i0h h ILE 155 CO -0.22 0.64 -1.12 -1.54 0.00 0.00 0.00 178.15 175.91 1i0h n SER 156 N -4.29 0.88 0.00 1.72 3.41 -0.04 -4.96 113.62 110.34 1i0h n SER 156 Ca -0.16 -0.59 0.00 0.00 -0.26 0.00 0.00 58.87 57.85 1i0h n SER 156 Cb 0.70 1.26 0.00 0.00 -0.26 0.00 0.00 64.21 65.91 1i0h n SER 156 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i0h n GLY 157 N 1.44 0.48 3.41 5.00 0.00 0.18 -4.67 105.19 111.02 1i0h n GLY 157 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 1i0h n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i0h s ALA 158 N -2.10 0.25 0.29 4.61 0.00 -1.26 -4.93 121.76 118.63 1i0h s ALA 158 Ca 0.00 -1.13 -0.16 0.00 0.00 0.00 0.00 51.96 50.67 1i0h s ALA 158 Cb 0.00 1.11 0.02 0.00 0.00 0.00 0.00 23.12 24.25 1i0h s ALA 158 CO 0.00 -0.72 0.64 -1.54 0.00 0.00 0.00 175.76 174.14 1i0h s SER 159 N -3.05 -0.06 0.00 0.00 1.04 -1.26 -2.00 113.70 108.38 1i0h s SER 159 Ca 0.26 -0.89 0.00 0.00 0.48 0.00 0.00 55.95 55.80 1i0h s SER 159 Cb 0.03 0.70 0.00 0.00 0.10 0.00 0.00 66.02 66.85 1i0h s SER 159 CO 0.08 -1.34 0.00 0.61 0.98 0.00 0.00 173.24 173.56 1i0h n GLY 160 N -0.46 2.53 3.68 7.32 0.00 -1.25 -4.87 105.19 112.14 1i0h n GLY 160 Ca -0.04 -1.97 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 1i0h n GLY 160 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1i0h s PHE 161 N -2.75 3.46 -0.41 1.61 5.36 -0.37 -3.97 117.98 120.91 1i0h s PHE 161 Ca 0.00 1.38 -0.29 0.00 -0.96 0.00 0.00 56.93 57.06 1i0h s PHE 161 Cb 0.00 -3.07 0.02 0.00 -0.34 0.00 0.00 43.02 39.63 1i0h s PHE 161 CO 0.00 -0.23 1.23 -1.25 -1.46 0.00 0.00 175.22 173.51 1i0h s PRO 162 N 2.06 3.77 0.05 10.12 0.04 -1.26 -0.68 135.00 149.11 1i0h s PRO 162 Ca 0.42 0.85 -0.19 0.00 0.04 0.00 0.00 61.00 62.13 1i0h s PRO 162 Cb -0.17 -3.91 -0.14 0.00 0.04 0.00 0.00 34.50 30.32 1i0h s PRO 162 CO 0.14 -1.32 1.34 0.82 0.04 0.00 0.00 177.00 178.02 1i0h h ILE 163 N 6.17 1.34 -3.33 0.56 1.08 -0.99 -3.48 117.51 118.87 1i0h h ILE 163 Ca -0.24 -1.45 -0.04 0.00 -0.39 0.00 0.00 64.86 62.74 1i0h h ILE 163 Cb 1.08 1.87 -0.05 0.00 -3.07 0.00 0.00 36.82 36.65 1i0h h ILE 163 CO 1.09 0.44 0.09 0.00 -0.69 0.00 0.00 178.15 179.08 1i0h s MET 164 N -4.18 1.89 0.18 2.37 0.23 -1.15 -4.44 119.30 114.20 1i0h s MET 164 Ca -0.13 -1.31 -0.24 0.00 -1.03 0.00 0.00 55.69 52.97 1i0h s MET 164 Cb 0.06 0.56 0.05 0.00 -1.53 0.00 0.00 34.83 33.97 1i0h s MET 164 CO 0.78 -0.84 0.85 0.20 -2.03 0.00 0.00 175.02 173.98 1i0h s GLY 165 N -3.04 -0.24 -0.10 3.16 0.00 -1.26 -1.79 107.32 104.04 1i0h s GLY 165 Ca 0.18 0.10 0.01 0.00 0.00 0.00 0.00 44.72 45.01 1i0h s GLY 165 CO 0.11 0.02 -0.12 -2.27 0.00 0.00 0.00 173.10 170.84 1i0h s LEU 166 N -2.88 1.52 -0.11 0.66 2.96 0.38 -4.89 118.68 116.32 1i0h s LEU 166 Ca 0.10 -0.36 -0.30 0.00 -0.22 0.00 0.00 54.13 53.36 1i0h s LEU 166 Cb -0.03 -0.96 -0.03 0.00 0.50 0.00 0.00 46.19 45.68 1i0h s LEU 166 CO 0.02 -0.03 1.32 -0.62 -1.32 0.00 0.00 176.35 175.71 1i0h s ASP 167 N 1.21 6.92 -0.17 3.68 2.15 -1.26 -1.28 116.67 127.92 1i0h s ASP 167 Ca -0.03 1.83 0.17 0.00 0.43 0.00 0.00 52.55 54.95 1i0h s ASP 167 Cb -0.14 -2.54 0.40 0.00 -0.30 0.00 0.00 42.92 40.34 1i0h s ASP 167 CO -0.04 -0.75 1.28 1.33 -0.17 0.00 0.00 175.17 176.82 1i0h n VAL 168 N 5.17 2.11 -1.88 1.11 0.24 -0.15 -4.89 118.33 120.04 1i0h n VAL 168 Ca 0.14 -2.24 -0.38 0.00 -2.04 0.00 0.00 64.34 59.81 1i0h n VAL 168 Cb 0.45 -0.25 0.03 0.00 -1.47 0.00 0.00 33.84 32.59 1i0h n VAL 168 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 1i0h s TRP 169 N -2.92 2.43 0.46 6.34 0.52 -1.14 -4.39 118.94 120.23 1i0h s TRP 169 Ca 0.37 1.39 0.11 0.00 0.02 0.00 0.00 56.10 57.99 1i0h s TRP 169 Cb 0.32 -3.74 1.03 0.00 -1.15 0.00 0.00 33.47 29.93 1i0h s TRP 169 CO 0.04 -2.64 2.09 0.93 0.02 0.00 0.00 176.95 177.39 1i0h h GLU 170 N 1.72 0.31 -0.02 4.98 5.08 -1.94 -1.11 114.58 123.60 1i0h h GLU 170 Ca -0.51 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 57.84 1i0h h GLU 170 Cb 1.28 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 1i0h h GLU 170 CO 0.58 0.21 0.04 1.12 -1.00 0.00 0.00 179.01 179.96 1i0h h HIS 171 N 0.32 0.00 0.00 4.33 2.07 -1.99 0.57 115.15 120.44 1i0h h HIS 171 Ca 0.08 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.60 1i0h h HIS 171 Cb -0.03 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.95 1i0h h HIS 171 CO 0.00 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.86 1i0h h ALA 172 N 1.94 1.00 0.00 6.11 0.00 -1.54 -3.38 119.26 123.39 1i0h h ALA 172 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1i0h h ALA 172 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1i0h h ALA 172 CO -0.00 0.00 0.00 2.48 0.00 0.00 0.00 179.25 181.73 1i0h n TYR 173 N -2.55 0.00 -0.17 0.00 0.18 -0.63 -4.92 117.16 109.08 1i0h n TYR 173 Ca 0.04 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.72 1i0h n TYR 173 Cb 0.41 0.00 -0.00 0.00 -0.38 0.00 0.00 39.34 39.37 1i0h n TYR 173 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 1i0h h PHE 174 N 0.00 0.94 -0.36 -3.48 3.57 -1.11 0.76 116.94 117.25 1i0h h PHE 174 Ca 0.00 -0.17 -0.02 0.00 3.53 0.00 0.00 57.97 61.31 1i0h h PHE 174 Cb 0.41 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 1i0h h PHE 174 CO 0.00 0.90 0.16 -0.07 -2.23 0.00 0.00 178.31 177.06 1i0h h LEU 175 N 0.71 0.49 0.08 0.59 3.38 -1.86 0.31 115.31 119.00 1i0h h LEU 175 Ca 0.13 -0.15 -0.32 0.00 0.09 0.00 0.00 57.88 57.64 1i0h h LEU 175 Cb 0.53 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1i0h h LEU 175 CO 0.03 0.50 -1.72 0.50 0.09 0.00 0.00 178.44 177.84 1i0h h LYS 176 N 0.44 0.17 -0.00 1.13 3.64 -1.93 -3.41 116.57 116.61 1i0h h LYS 176 Ca 0.12 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1i0h h LYS 176 Cb 0.16 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1i0h h LYS 176 CO -0.01 0.94 -0.13 1.19 -2.27 0.00 0.00 179.45 179.16 1i0h n PHE 177 N -3.32 0.00 0.00 1.91 3.01 0.25 -5.07 117.46 114.23 1i0h n PHE 177 Ca -0.21 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.25 1i0h n PHE 177 Cb 1.05 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.52 1i0h n PHE 177 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1i0h n GLN 178 N -0.72 0.00 -0.27 -1.08 3.00 0.10 -0.34 117.38 118.06 1i0h n GLN 178 Ca 0.01 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.09 1i0h n GLN 178 Cb 0.08 0.00 0.23 0.00 0.00 0.00 0.00 30.24 30.55 1i0h n GLN 178 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1i0h n ASN 179 N 5.45 2.81 -3.58 1.08 6.94 -1.26 -4.35 115.26 122.34 1i0h n ASN 179 Ca 0.00 -2.01 -0.41 0.00 -0.02 0.00 0.00 54.58 52.15 1i0h n ASN 179 Cb 0.00 -0.35 -0.01 0.00 -2.36 0.00 0.00 39.78 37.06 1i0h n ASN 179 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1i0h n ARG 180 N 1.03 4.02 -0.30 -3.83 1.74 0.54 -4.74 116.66 115.10 1i0h n ARG 180 Ca 0.17 -3.20 0.04 0.00 -0.77 0.00 0.00 57.85 54.10 1i0h n ARG 180 Cb 0.44 -2.80 0.19 0.00 -1.02 0.00 0.00 32.46 29.27 1i0h n ARG 180 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1i0h h ARG 181 N 5.12 0.78 -0.57 5.56 2.43 -1.83 -1.00 114.38 124.87 1i0h h ARG 181 Ca 0.63 -0.05 0.11 0.00 -0.81 0.00 0.00 59.98 59.86 1i0h h ARG 181 Cb 0.42 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 1i0h h ARG 181 CO 1.61 0.52 0.39 -1.35 -1.51 0.00 0.00 179.97 179.63 1i0h h PRO 182 N 0.80 0.30 -0.25 0.20 0.11 -1.96 0.36 132.00 131.56 1i0h h PRO 182 Ca 0.42 -0.02 -0.18 0.00 0.11 0.00 0.00 66.00 66.33 1i0h h PRO 182 Cb 0.42 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.46 1i0h h PRO 182 CO -0.26 0.20 -0.56 -0.44 -0.21 0.00 0.00 178.00 176.73 1i0h h ASP 183 N 0.31 0.87 -0.41 -2.05 3.32 -1.59 -1.69 116.42 115.18 1i0h h ASP 183 Ca 0.27 -0.47 -0.01 0.00 0.02 0.00 0.00 57.03 56.84 1i0h h ASP 183 Cb 0.64 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1i0h h ASP 183 CO -0.06 1.24 0.22 0.22 -1.72 0.00 0.00 179.24 179.14 1i0h h TYR 184 N 0.59 0.56 -0.89 4.55 3.20 -1.11 -2.24 116.97 121.64 1i0h h TYR 184 Ca 0.01 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.89 1i0h h TYR 184 Cb 1.15 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 39.19 1i0h h TYR 184 CO 0.06 0.43 0.59 0.82 -1.64 0.00 0.00 178.16 178.42 1i0h h ILE 185 N 0.53 1.18 -0.51 1.81 2.04 -0.84 -1.09 117.51 120.62 1i0h h ILE 185 Ca 0.14 -0.39 0.01 0.00 1.00 0.00 0.00 64.86 65.62 1i0h h ILE 185 Cb 0.06 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.04 1i0h h ILE 185 CO -0.02 0.21 0.33 0.11 0.00 0.00 0.00 178.15 178.77 1i0h h LYS 186 N 1.14 0.65 0.00 2.37 1.57 -1.05 -2.00 116.57 119.25 1i0h h LYS 186 Ca 0.34 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 59.04 1i0h h LYS 186 Cb -0.03 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 1i0h h LYS 186 CO -0.09 0.43 -0.20 0.93 -0.57 0.00 0.00 179.45 179.94 1i0h h GLU 187 N 0.67 0.00 -0.43 3.15 4.39 -0.71 -2.48 114.58 119.16 1i0h h GLU 187 Ca 0.19 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.95 1i0h h GLU 187 Cb -0.05 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 1i0h h GLU 187 CO -0.06 0.20 0.29 0.35 -1.16 0.00 0.00 179.01 178.64 1i0h h PHE 188 N 0.00 0.35 0.00 4.33 3.57 -0.45 -0.58 116.94 124.17 1i0h h PHE 188 Ca -0.00 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 1i0h h PHE 188 Cb 0.49 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.11 1i0h h PHE 188 CO 0.00 0.19 -0.10 -1.49 -2.23 0.00 0.00 178.31 174.68 1i0h h TRP 189 N 0.35 0.00 0.00 0.41 -0.00 -1.47 0.15 115.95 115.39 1i0h h TRP 189 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.08 1i0h h TRP 189 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.45 1i0h h TRP 189 CO -0.00 0.10 0.00 -0.91 -0.00 0.00 0.00 178.44 177.63 1i0h h ASN 190 N 0.00 0.00 0.00 -3.49 2.35 -1.26 -3.35 115.58 109.83 1i0h h ASN 190 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1i0h h ASN 190 Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.67 1i0h h ASN 190 CO 0.01 0.00 0.00 1.33 -1.65 0.00 0.00 177.43 177.12 1i0h n VAL 191 N -2.43 0.00 -1.79 2.81 0.24 -0.43 -4.51 118.33 112.22 1i0h n VAL 191 Ca 0.04 -0.31 -0.42 0.00 -2.04 0.00 0.00 64.34 61.62 1i0h n VAL 191 Cb 0.40 1.34 -0.03 0.00 -1.47 0.00 0.00 33.84 34.08 1i0h n VAL 191 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1i0h s VAL 192 N -0.08 2.47 -0.89 3.34 0.11 0.40 -0.34 120.40 125.42 1i0h s VAL 192 Ca 0.00 0.17 -0.23 0.00 -2.93 0.00 0.00 61.98 58.99 1i0h s VAL 192 Cb 0.00 -3.11 0.06 0.00 -1.53 0.00 0.00 36.38 31.80 1i0h s VAL 192 CO 0.00 0.01 1.30 0.21 -3.33 0.00 0.00 175.10 173.28 1i0h s ASN 193 N 1.95 6.40 0.57 3.54 3.84 0.11 -4.60 114.94 126.75 1i0h s ASN 193 Ca 0.76 -1.25 0.36 0.00 0.21 0.00 0.00 52.86 52.94 1i0h s ASN 193 Cb -0.46 -2.52 1.58 0.00 -0.55 0.00 0.00 41.25 39.30 1i0h s ASN 193 CO 0.34 -1.51 2.06 -0.50 -2.79 0.00 0.00 177.10 174.70 1i0h h TRP 194 N 9.67 0.00 -0.29 0.43 4.06 -1.88 -2.07 115.95 125.87 1i0h h TRP 194 Ca 0.02 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 60.86 1i0h h TRP 194 Cb 1.03 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.18 1i0h h TRP 194 CO 1.19 0.01 -0.22 -0.44 -3.56 0.00 0.00 178.44 175.41 1i0h h ASP 195 N 0.00 0.70 -0.35 -3.49 3.32 -1.88 0.37 116.42 115.09 1i0h h ASP 195 Ca -0.00 -0.45 -0.12 0.00 0.02 0.00 0.00 57.03 56.48 1i0h h ASP 195 Cb 0.41 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1i0h h ASP 195 CO 0.00 1.00 -0.27 -0.08 -1.72 0.00 0.00 179.24 178.18 1i0h h GLU 196 N 0.42 0.80 -0.85 3.56 4.57 -1.78 -1.25 114.58 120.05 1i0h h GLU 196 Ca 0.06 -0.39 0.04 0.00 -1.18 0.00 0.00 59.36 57.88 1i0h h GLU 196 Cb 0.77 -0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.31 1i0h h GLU 196 CO 0.06 1.02 0.54 0.00 -1.18 0.00 0.00 179.01 179.45 1i0h h ALA 197 N 0.76 1.12 -0.66 2.92 0.00 -1.34 -0.18 119.26 121.88 1i0h h ALA 197 Ca 0.07 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1i0h h ALA 197 Cb 0.84 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1i0h h ALA 197 CO 0.07 0.37 0.10 0.00 0.00 0.00 0.00 179.25 179.79 1i0h h ALA 198 N 1.36 0.93 -0.50 0.00 0.00 -0.70 -0.32 119.26 120.01 1i0h h ALA 198 Ca 0.34 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1i0h h ALA 198 Cb 0.02 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1i0h h ALA 198 CO -0.12 0.66 0.04 0.00 0.00 0.00 0.00 179.25 179.84 1i0h h ALA 199 N 1.08 0.68 -0.56 0.00 0.00 -0.62 0.73 119.26 120.56 1i0h h ALA 199 Ca 0.20 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1i0h h ALA 199 Cb 0.44 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1i0h h ALA 199 CO 0.01 0.45 0.00 0.00 0.00 0.00 0.00 179.25 179.71 1i0h h ARG 200 N 0.73 0.95 -0.52 0.00 3.08 -0.84 -1.87 114.38 115.91 1i0h h ARG 200 Ca 0.15 -0.28 -0.03 0.00 0.07 0.00 0.00 59.98 59.89 1i0h h ARG 200 Cb 0.46 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 1i0h h ARG 200 CO 0.02 0.94 0.21 0.35 -1.07 0.00 0.00 179.97 180.42 1i0h h PHE 201 N 0.88 0.79 -0.65 3.04 3.57 -0.83 -2.66 116.94 121.08 1i0h h PHE 201 Ca 0.16 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 1i0h h PHE 201 Cb 0.51 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.98 1i0h h PHE 201 CO 0.03 0.65 0.37 0.00 -2.23 0.00 0.00 178.31 177.13 1i0h h ALA 202 N 1.06 1.44 0.00 2.41 0.00 -0.49 0.13 119.26 123.81 1i0h h ALA 202 Ca 0.18 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1i0h h ALA 202 Cb 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1i0h h ALA 202 CO -0.02 0.47 -0.39 0.00 0.00 0.00 0.00 179.25 179.32 1i0h h ALA 203 N 1.52 1.05 0.00 0.00 0.00 -1.06 -3.35 119.26 117.42 1i0h h ALA 203 Ca 0.23 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1i0h h ALA 203 Cb -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1i0h h ALA 203 CO -0.04 0.49 -1.00 1.63 0.00 0.00 0.00 179.25 180.33 1i0h n LYS 204 N -3.64 1.52 0.00 0.00 4.76 -0.86 -5.12 118.16 114.83 1i0h n LYS 204 Ca -0.01 -0.04 0.05 0.00 -2.87 0.00 0.00 58.31 55.45 1i0h n LYS 204 Cb 0.50 -1.04 0.32 0.00 -1.84 0.00 0.00 35.03 32.97 1i0h n LYS 204 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39