#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 2.26 0.16 7.33 2.02 -1.26 -5.05 117.35 122.81 1i0h s TYR 2 Ca 0.00 1.48 0.06 0.00 -0.37 0.00 0.00 57.07 58.24 1i0h s TYR 2 Cb 0.00 -3.62 -0.04 0.00 -0.40 0.00 0.00 41.96 37.90 1i0h s TYR 2 CO 0.00 -2.60 -0.13 0.95 -1.57 0.00 0.00 175.55 172.21 1i0h s THR 3 N -1.46 1.42 -0.05 -0.71 -4.23 -1.26 -4.95 115.64 104.40 1i0h s THR 3 Ca 0.78 -2.03 -0.30 0.00 -1.18 0.00 0.00 61.69 58.97 1i0h s THR 3 Cb -0.35 -1.84 -0.05 0.00 1.34 0.00 0.00 72.50 71.60 1i0h s THR 3 CO 0.38 -0.60 1.53 -0.22 -0.54 0.00 0.00 174.62 175.17 1i0h s LEU 4 N -3.03 4.30 0.24 4.79 2.96 -1.26 -4.98 118.68 121.70 1i0h s LEU 4 Ca 0.17 2.13 -0.30 0.00 -0.22 0.00 0.00 54.13 55.91 1i0h s LEU 4 Cb -0.01 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 43.05 1i0h s LEU 4 CO 0.03 -0.85 1.09 -2.16 -1.32 0.00 0.00 176.35 173.14 1i0h s PRO 5 N 3.50 4.64 0.48 0.98 0.04 -1.26 -5.01 135.00 138.38 1i0h s PRO 5 Ca 0.68 1.75 -0.24 0.00 0.04 0.00 0.00 61.00 63.24 1i0h s PRO 5 Cb -0.31 -3.23 -0.07 0.00 0.04 0.00 0.00 34.50 30.93 1i0h s PRO 5 CO 0.26 0.18 1.32 -1.13 0.04 0.00 0.00 177.00 177.67 1i0h n SER 6 N 1.66 2.64 -4.80 6.66 3.41 -1.26 -4.99 113.62 116.94 1i0h n SER 6 Ca 0.00 1.04 -0.31 0.00 -0.26 0.00 0.00 58.87 59.34 1i0h n SER 6 Cb 0.45 -1.54 0.05 0.00 -0.26 0.00 0.00 64.21 62.92 1i0h n SER 6 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1i0h s LEU 7 N -2.53 3.20 0.00 1.04 1.43 -1.26 -4.95 118.68 115.62 1i0h s LEU 7 Ca 0.66 1.75 0.21 0.00 -1.03 0.00 0.00 54.13 55.71 1i0h s LEU 7 Cb -0.46 -4.51 1.23 0.00 0.03 0.00 0.00 46.19 42.48 1i0h s LEU 7 CO 0.54 -1.57 1.77 -2.65 0.23 0.00 0.00 176.35 174.66 1i0h n PRO 8 N -2.97 0.96 -3.86 1.29 -0.02 -1.26 -4.89 135.00 124.25 1i0h n PRO 8 Ca 0.08 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.49 1i0h n PRO 8 Cb 0.53 -1.34 -0.02 0.00 -0.02 0.00 0.00 33.50 32.66 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 -0.13 0.71 6.00 -0.85 -1.26 -5.16 117.35 114.65 1i0h s TYR 9 Ca 0.31 -0.34 -0.13 0.00 -0.52 0.00 0.00 57.07 56.39 1i0h s TYR 9 Cb 0.14 0.69 0.03 0.00 0.38 0.00 0.00 41.96 43.20 1i0h s TYR 9 CO 0.24 -1.26 1.10 0.00 -1.52 0.00 0.00 175.55 174.12 1i0h s ALA 10 N -3.79 2.36 0.58 9.51 0.00 -1.26 -4.93 121.76 124.23 1i0h s ALA 10 Ca 0.12 0.43 0.28 0.00 0.00 0.00 0.00 51.96 52.79 1i0h s ALA 10 Cb -0.06 -3.30 1.67 0.00 0.00 0.00 0.00 23.12 21.43 1i0h s ALA 10 CO 0.08 -1.51 2.16 1.88 0.00 0.00 0.00 175.76 178.36 1i0h h TYR 11 N -0.50 0.00 -0.52 0.00 0.05 -1.97 -0.92 116.97 113.10 1i0h h TYR 11 Ca -0.45 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.33 1i0h h TYR 11 Cb 1.24 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.98 1i0h h TYR 11 CO 0.56 0.00 0.00 -0.40 -1.05 0.00 0.00 178.16 177.27 1i0h n ASP 12 N -3.91 2.85 0.09 3.88 5.75 -1.26 -4.28 116.55 119.66 1i0h n ASP 12 Ca -0.00 -1.99 0.11 0.00 -0.01 0.00 0.00 54.79 52.90 1i0h n ASP 12 Cb 0.23 -0.35 0.44 0.00 -1.03 0.00 0.00 41.12 40.41 1i0h n ASP 12 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1i0h n ALA 13 N 1.06 1.75 0.10 2.12 0.00 -0.35 -2.04 120.51 123.15 1i0h n ALA 13 Ca 0.18 0.03 0.07 0.00 0.00 0.00 0.00 53.44 53.72 1i0h n ALA 13 Cb 0.45 -1.36 0.14 0.00 0.00 0.00 0.00 19.45 18.68 1i0h n ALA 13 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1i0h n LEU 14 N -2.03 2.80 -4.75 0.00 4.77 -1.26 -4.61 117.00 111.93 1i0h n LEU 14 Ca 0.03 -1.60 -0.37 0.00 -0.03 0.00 0.00 56.01 54.04 1i0h n LEU 14 Cb 0.24 -0.18 0.04 0.00 -2.33 0.00 0.00 43.42 41.19 1i0h n LEU 14 CO 0.20 0.64 0.91 -1.61 -1.33 0.00 0.00 177.39 176.19 1i0h s GLU 15 N -1.08 3.07 -0.16 3.23 0.41 -0.87 -0.86 118.70 122.45 1i0h s GLU 15 Ca 0.25 2.02 0.07 0.00 -0.41 0.00 0.00 54.97 56.90 1i0h s GLU 15 Cb 0.14 -2.11 0.45 0.00 -1.78 0.00 0.00 34.13 30.84 1i0h s GLU 15 CO 0.20 -1.18 1.27 -0.35 -0.49 0.00 0.00 175.26 174.70 1i0h n PRO 16 N -1.27 2.96 -0.08 0.39 -0.04 -1.26 -4.90 135.00 130.80 1i0h n PRO 16 Ca 0.12 -1.78 -0.11 0.00 -0.04 0.00 0.00 63.50 61.68 1i0h n PRO 16 Cb 0.47 -1.89 -0.05 0.00 -0.04 0.00 0.00 33.50 31.99 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 0.22 0.88 -4.45 0.54 8.25 -0.04 -4.87 115.22 115.74 1i0h n HIS 17 Ca 0.19 0.38 -0.34 0.00 -0.26 0.00 0.00 57.72 57.69 1i0h n HIS 17 Cb 0.86 -0.87 -0.12 0.00 1.12 0.00 0.00 29.99 30.98 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 -2.33 3.02 0.29 4.41 0.40 -0.81 -4.96 117.98 118.00 1i0h s PHE 18 Ca -0.21 -0.16 -0.28 0.00 -0.60 0.00 0.00 56.93 55.68 1i0h s PHE 18 Cb 0.04 -1.88 -0.09 0.00 0.51 0.00 0.00 43.02 41.59 1i0h s PHE 18 CO 0.36 0.11 0.99 0.16 0.70 0.00 0.00 175.22 177.54 1i0h s ASP 19 N -0.06 7.40 0.20 1.36 -4.77 -1.26 -3.48 116.67 116.05 1i0h s ASP 19 Ca 0.02 2.00 -0.12 0.00 -3.30 0.00 0.00 52.55 51.15 1i0h s ASP 19 Cb -0.13 -2.60 0.24 0.00 -1.09 0.00 0.00 42.92 39.33 1i0h s ASP 19 CO 0.03 -0.03 1.71 0.50 0.70 0.00 0.00 175.17 178.08 1i0h h LYS 20 N 3.67 0.24 -0.35 2.11 3.64 -1.92 -2.33 116.57 121.63 1i0h h LYS 20 Ca -0.46 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1i0h h LYS 20 Cb 1.20 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.95 1i0h h LYS 20 CO 0.66 0.16 0.21 0.37 -2.27 0.00 0.00 179.45 178.58 1i0h h GLN 21 N 0.25 0.48 -0.36 1.90 4.15 -1.93 -1.56 115.11 118.05 1i0h h GLN 21 Ca 0.28 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.67 1i0h h GLN 21 Cb 0.39 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.96 1i0h h GLN 21 CO -0.36 0.37 0.22 1.15 -1.93 0.00 0.00 178.83 178.28 1i0h h THR 22 N 0.46 1.05 -0.81 2.39 2.02 -1.92 -0.87 112.91 115.23 1i0h h THR 22 Ca 0.13 -0.15 0.11 0.00 0.77 0.00 0.00 66.41 67.26 1i0h h THR 22 Cb 0.02 0.57 -0.08 0.00 -1.74 0.00 0.00 68.15 66.92 1i0h h THR 22 CO -0.02 0.08 0.45 0.24 0.37 0.00 0.00 175.52 176.63 1i0h h MET 23 N 0.44 0.70 -0.22 6.66 2.86 -1.00 0.27 114.93 124.64 1i0h h MET 23 Ca 0.14 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.68 1i0h h MET 23 Cb -0.01 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 1i0h h MET 23 CO -0.06 0.46 -0.10 1.49 1.06 0.00 0.00 176.91 179.77 1i0h h GLU 24 N 0.72 0.45 -0.15 1.72 4.81 -0.77 -1.70 114.58 119.65 1i0h h GLU 24 Ca 0.41 -0.19 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1i0h h GLU 24 Cb 0.44 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 1i0h h GLU 24 CO -0.28 0.72 0.03 0.82 -0.73 0.00 0.00 179.01 179.57 1i0h h ILE 25 N 0.15 1.22 -0.82 2.32 2.04 -0.76 -0.95 117.51 120.71 1i0h h ILE 25 Ca 0.05 -0.70 0.07 0.00 1.00 0.00 0.00 64.86 65.27 1i0h h ILE 25 Cb 0.58 1.40 -0.06 0.00 -0.74 0.00 0.00 36.82 38.00 1i0h h ILE 25 CO 0.03 0.21 0.49 -0.74 0.00 0.00 0.00 178.15 178.14 1i0h h HIS 26 N 0.03 0.91 0.30 1.37 2.76 -0.48 0.83 115.15 120.88 1i0h h HIS 26 Ca 0.05 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.23 1i0h h HIS 26 Cb 0.30 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 28.97 1i0h h HIS 26 CO 0.02 0.45 -0.15 1.25 -1.30 0.00 0.00 177.93 178.20 1i0h h HIS 27 N 0.89 -0.38 0.00 5.26 -0.00 -1.27 -0.94 115.15 118.71 1i0h h HIS 27 Ca 0.36 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.72 1i0h h HIS 27 Cb 0.20 0.12 0.00 0.00 -0.00 0.00 0.00 27.41 27.73 1i0h h HIS 27 CO -0.04 -0.08 -0.01 1.79 -0.00 0.00 0.00 177.93 179.58 1i0h h THR 28 N -1.01 0.00 0.00 6.26 1.35 -1.06 -2.95 112.91 115.50 1i0h h THR 28 Ca -0.04 -0.99 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 1i0h h THR 28 Cb 0.46 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.87 1i0h h THR 28 CO 0.07 0.00 -0.12 0.29 -0.25 0.00 0.00 175.52 175.51 1i0h n LYS 29 N -3.08 0.06 0.00 4.72 4.76 0.27 -4.38 118.16 120.52 1i0h n LYS 29 Ca 0.04 0.02 -0.12 0.00 -2.87 0.00 0.00 58.31 55.38 1i0h n LYS 29 Cb 0.53 -0.45 -0.08 0.00 -1.84 0.00 0.00 35.03 33.19 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 0.06 -0.45 2.13 3.86 -1.39 -1.08 115.15 118.17 1i0h h HIS 30 Ca 0.00 -0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.16 1i0h h HIS 30 Cb 0.12 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.55 1i0h h HIS 30 CO -0.05 0.25 0.11 1.25 0.86 0.00 0.00 177.93 180.35 1i0h h HIS 31 N -0.15 0.75 -0.90 2.45 -0.00 -1.21 -2.59 115.15 113.50 1i0h h HIS 31 Ca 0.01 -0.09 0.13 0.00 -0.00 0.00 0.00 60.37 60.42 1i0h h HIS 31 Cb 0.22 -0.21 -0.09 0.00 -0.00 0.00 0.00 27.41 27.33 1i0h h HIS 31 CO -0.00 0.69 0.52 0.37 -0.00 0.00 0.00 177.93 179.51 1i0h h GLN 32 N 0.59 0.76 -0.68 5.26 5.75 -1.39 -1.51 115.11 123.89 1i0h h GLN 32 Ca 0.14 -0.05 -0.05 0.00 -0.15 0.00 0.00 58.65 58.54 1i0h h GLN 32 Cb 0.32 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.67 1i0h h GLN 32 CO 0.00 0.50 0.23 1.15 -2.65 0.00 0.00 178.83 178.06 1i0h h THR 33 N 0.79 1.24 -0.54 2.39 2.02 -0.82 -0.39 112.91 117.60 1i0h h THR 33 Ca 0.47 -0.82 -0.05 0.00 0.77 0.00 0.00 66.41 66.78 1i0h h THR 33 Cb 0.56 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1i0h h THR 33 CO -0.31 0.32 0.16 1.88 0.37 0.00 0.00 175.52 177.94 1i0h h TYR 34 N 1.00 0.87 -0.38 3.16 0.05 -1.01 -0.03 116.97 120.62 1i0h h TYR 34 Ca 0.22 -0.09 0.05 0.00 0.05 0.00 0.00 58.73 58.96 1i0h h TYR 34 Cb 0.26 -0.25 -0.05 0.00 1.01 0.00 0.00 36.73 37.70 1i0h h TYR 34 CO 0.02 0.75 0.10 0.28 -1.05 0.00 0.00 178.16 178.26 1i0h h VAL 35 N 0.74 0.84 -0.30 -2.88 2.07 -0.90 0.81 116.25 116.63 1i0h h VAL 35 Ca 0.17 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.56 1i0h h VAL 35 Cb 0.30 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1i0h h VAL 35 CO -0.00 0.04 0.02 0.78 0.02 0.00 0.00 177.57 178.43 1i0h h ASN 36 N 0.24 0.51 0.42 0.57 2.35 -0.76 -0.90 115.58 118.01 1i0h h ASN 36 Ca 0.18 -0.29 -0.17 0.00 -0.55 0.00 0.00 56.30 55.46 1i0h h ASN 36 Cb 0.19 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 1i0h h ASN 36 CO -0.22 0.68 -0.73 0.78 -1.65 0.00 0.00 177.43 176.29 1i0h h ASN 37 N 0.33 0.31 -0.33 5.81 2.35 -0.84 -1.21 115.58 122.01 1i0h h ASN 37 Ca 0.09 -0.21 -0.02 0.00 -0.55 0.00 0.00 56.30 55.61 1i0h h ASN 37 Cb 0.41 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 1i0h h ASN 37 CO 0.01 0.94 0.13 0.00 -1.65 0.00 0.00 177.43 176.86 1i0h h ALA 38 N 1.06 0.42 -0.85 -0.83 0.00 -0.74 -2.43 119.26 115.88 1i0h h ALA 38 Ca -0.03 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.79 1i0h h ALA 38 Cb 1.29 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 1i0h h ALA 38 CO 0.12 0.03 0.55 -0.91 0.00 0.00 0.00 179.25 179.03 1i0h h ASN 39 N 0.38 0.90 -0.68 0.00 2.35 -0.99 -0.58 115.58 116.97 1i0h h ASN 39 Ca 0.11 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 1i0h h ASN 39 Cb 0.19 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.33 1i0h h ASN 39 CO -0.01 0.61 0.38 0.00 -1.65 0.00 0.00 177.43 176.76 1i0h h ALA 40 N 1.36 0.87 0.00 -0.83 0.00 -1.05 -2.14 119.26 117.47 1i0h h ALA 40 Ca 0.35 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1i0h h ALA 40 Cb 0.04 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1i0h h ALA 40 CO -0.13 0.37 -0.08 0.00 0.00 0.00 0.00 179.25 179.41 1i0h h ALA 41 N 1.19 0.98 0.00 0.00 0.00 -0.92 -3.14 119.26 117.36 1i0h h ALA 41 Ca 0.24 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1i0h h ALA 41 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1i0h h ALA 41 CO -0.04 0.10 -0.63 1.28 0.00 0.00 0.00 179.25 179.96 1i0h n LEU 42 N -3.16 0.63 -0.29 0.00 4.77 -0.28 -4.33 117.00 114.35 1i0h n LEU 42 Ca 0.02 0.16 0.07 0.00 -0.03 0.00 0.00 56.01 56.23 1i0h n LEU 42 Cb 0.44 -0.19 0.29 0.00 -2.33 0.00 0.00 43.42 41.63 1i0h n LEU 42 CO 0.32 -0.01 1.23 -0.08 -1.33 0.00 0.00 177.39 177.53 1i0h h GLU 43 N 0.00 0.87 -0.02 3.23 4.81 -1.35 -0.08 114.58 122.03 1i0h h GLU 43 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1i0h h GLU 43 Cb 0.69 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.87 1i0h h GLU 43 CO 0.00 0.57 0.00 -1.13 -0.73 0.00 0.00 179.01 177.72 1i0h n SER 44 N -4.54 0.20 -3.39 1.04 3.41 -1.26 -4.28 113.62 104.80 1i0h n SER 44 Ca 0.16 -1.41 -0.26 0.00 -0.26 0.00 0.00 58.87 57.10 1i0h n SER 44 Cb 0.31 -0.01 -0.08 0.00 -0.26 0.00 0.00 64.21 64.17 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 -0.68 2.88 0.04 1.04 4.77 -0.04 -4.94 117.00 120.07 1i0h n LEU 45 Ca 0.15 -5.26 0.21 0.00 -0.03 0.00 0.00 56.01 51.08 1i0h n LEU 45 Cb 0.10 -0.36 0.73 0.00 -2.33 0.00 0.00 43.42 41.56 1i0h n LEU 45 CO 0.12 2.05 1.19 -0.65 -1.33 0.00 0.00 177.39 178.76 1i0h h PRO 46 N 4.20 0.00 0.00 3.23 0.11 -1.75 0.43 132.00 138.22 1i0h h PRO 46 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1i0h h PRO 46 Cb 0.72 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.83 1i0h h PRO 46 CO 0.74 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.68 1i0h n GLU 47 N -4.09 0.48 0.00 1.05 0.00 -1.26 -3.68 120.64 113.14 1i0h n GLU 47 Ca 0.09 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.27 1i0h n GLU 47 Cb 0.61 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.55 1i0h n GLU 47 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1i0h n PHE 48 N -1.23 0.00 0.26 -1.84 3.72 -0.04 -4.86 117.46 113.46 1i0h n PHE 48 Ca 0.14 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.65 1i0h n PHE 48 Cb 0.19 0.00 0.69 0.00 -0.94 0.00 0.00 39.48 39.42 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 0.00 1.55 -0.22 4.37 0.00 -1.13 -2.77 119.26 121.05 1i0h h ALA 49 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1i0h h ALA 49 Cb 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1i0h h ALA 49 CO 0.00 0.13 0.00 0.09 0.00 0.00 0.00 179.25 179.47 1i0h n ASN 50 N -4.00 2.59 -4.82 0.00 3.02 -1.26 -4.42 115.26 106.36 1i0h n ASN 50 Ca -0.02 -1.79 -0.33 0.00 -0.03 0.00 0.00 54.58 52.41 1i0h n ASN 50 Cb 0.19 -0.15 -0.03 0.00 -0.61 0.00 0.00 39.78 39.19 1i0h n ASN 50 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1i0h s LEU 51 N -1.01 3.69 0.38 3.41 1.43 -1.05 -5.01 118.68 120.53 1i0h s LEU 51 Ca 0.21 1.73 -0.27 0.00 -1.03 0.00 0.00 54.13 54.77 1i0h s LEU 51 Cb 0.12 -4.53 -0.11 0.00 0.03 0.00 0.00 46.19 41.70 1i0h s LEU 51 CO 0.16 -0.74 1.24 -2.65 0.23 0.00 0.00 176.35 174.60 1i0h n PRO 52 N -1.41 1.93 0.07 1.29 -0.02 -1.26 -4.80 135.00 130.80 1i0h n PRO 52 Ca 0.08 0.68 0.05 0.00 -2.02 0.00 0.00 63.50 62.29 1i0h n PRO 52 Cb 0.53 -2.30 0.47 0.00 -0.02 0.00 0.00 33.50 32.19 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 2.23 1.08 0.00 -1.45 3.04 -1.96 0.07 116.25 119.26 1i0h h VAL 53 Ca -0.46 -0.17 -0.05 0.00 -1.01 0.00 0.00 66.70 65.00 1i0h h VAL 53 Cb 1.30 0.65 -0.01 0.00 -2.01 0.00 0.00 31.29 31.22 1i0h h VAL 53 CO 0.61 0.08 -0.24 1.05 -1.01 0.00 0.00 177.57 178.06 1i0h h GLU 54 N 0.41 0.00 -0.02 4.17 9.09 -1.92 -1.79 114.58 124.51 1i0h h GLU 54 Ca 0.11 0.00 -0.14 0.00 0.05 0.00 0.00 59.36 59.38 1i0h h GLU 54 Cb -0.03 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.08 1i0h h GLU 54 CO -0.02 0.24 -0.52 1.49 0.05 0.00 0.00 179.01 180.25 1i0h h GLU 55 N 0.00 0.39 -0.98 1.06 4.81 -1.41 -3.34 114.58 115.12 1i0h h GLU 55 Ca -0.00 -0.39 0.03 0.00 -0.13 0.00 0.00 59.36 58.87 1i0h h GLU 55 Cb 0.72 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.15 1i0h h GLU 55 CO 0.03 1.05 0.64 1.25 -0.73 0.00 0.00 179.01 181.26 1i0h h LEU 56 N -0.12 1.08 0.00 1.64 5.85 -0.52 -1.74 115.31 121.50 1i0h h LEU 56 Ca -0.06 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1i0h h LEU 56 Cb 1.22 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.00 1i0h h LEU 56 CO 0.10 0.75 0.00 2.30 -0.34 0.00 0.00 178.44 181.25 1i0h n ILE 57 N -4.43 0.49 1.43 4.05 -5.35 -0.73 -0.78 119.36 114.04 1i0h n ILE 57 Ca 0.13 0.12 0.14 0.00 -0.27 0.00 0.00 62.75 62.87 1i0h n ILE 57 Cb 0.08 -0.82 0.48 0.00 -1.74 0.00 0.00 39.64 37.64 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 -1.31 0.00 -0.44 7.28 -2.24 -0.66 -3.85 114.28 113.06 1i0h n THR 58 Ca 0.08 -0.23 0.04 0.00 -2.27 0.00 0.00 64.05 61.66 1i0h n THR 58 Cb 0.15 0.51 0.05 0.00 -2.10 0.00 0.00 70.33 68.95 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 0.04 2.25 0.23 -0.78 5.02 0.03 -4.81 118.16 120.15 1i0h n LYS 59 Ca 0.17 -1.85 0.08 0.00 -2.02 0.00 0.00 58.31 54.69 1i0h n LYS 59 Cb 0.36 -1.16 0.61 0.00 -0.02 0.00 0.00 35.03 34.83 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 0.00 0.04 0.00 -0.35 3.38 -1.74 -0.03 115.31 116.61 1i0h h LEU 60 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i0h h LEU 60 Cb 0.71 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1i0h h LEU 60 CO 0.00 0.04 0.00 0.47 0.09 0.00 0.00 178.44 179.04 1i0h n ASP 61 N -4.52 0.00 0.09 -0.43 8.00 -1.26 -2.34 116.55 116.08 1i0h n ASP 61 Ca -0.02 0.28 0.12 0.00 0.71 0.00 0.00 54.79 55.88 1i0h n ASP 61 Cb 0.09 -0.41 0.20 0.00 -0.02 0.00 0.00 41.12 40.99 1i0h n ASP 61 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1i0h h GLN 62 N 0.00 0.00 -7.37 -1.24 1.08 -1.38 -3.48 115.11 102.73 1i0h h GLN 62 Ca 0.00 0.00 -0.50 0.00 -1.45 0.00 0.00 58.65 56.70 1i0h h GLN 62 Cb 0.29 0.00 0.12 0.00 -0.05 0.00 0.00 27.48 27.84 1i0h h GLN 62 CO 0.00 0.00 0.32 -0.51 -0.95 0.00 0.00 178.83 177.69 1i0h s LEU 63 N -4.58 2.70 0.59 1.46 1.43 -0.99 -5.01 118.68 114.28 1i0h s LEU 63 Ca 0.06 1.48 -0.20 0.00 -1.03 0.00 0.00 54.13 54.44 1i0h s LEU 63 Cb 0.12 -4.12 -0.03 0.00 0.03 0.00 0.00 46.19 42.19 1i0h s LEU 63 CO 0.70 -2.00 1.31 -2.84 0.23 0.00 0.00 176.35 173.75 1i0h s PRO 64 N -5.05 2.90 0.28 1.29 0.02 -1.26 -4.88 135.00 128.29 1i0h s PRO 64 Ca 0.61 2.11 0.01 0.00 0.02 0.00 0.00 61.00 63.75 1i0h s PRO 64 Cb -0.15 -2.05 0.69 0.00 0.02 0.00 0.00 34.50 33.00 1i0h s PRO 64 CO 0.55 -1.34 1.65 0.00 -0.33 0.00 0.00 177.00 177.52 1i0h h ALA 65 N 1.04 1.24 0.00 -1.55 0.00 -1.96 -1.04 119.26 116.98 1i0h h ALA 65 Ca -0.51 0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1i0h h ALA 65 Cb 1.31 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.43 1i0h h ALA 65 CO 0.55 -0.46 0.00 -0.40 0.00 0.00 0.00 179.25 178.94 1i0h n ASP 66 N -5.23 0.00 -0.00 0.00 5.75 -1.26 -3.20 116.55 112.60 1i0h n ASP 66 Ca 0.21 -0.90 0.04 0.00 -0.01 0.00 0.00 54.79 54.13 1i0h n ASP 66 Cb 0.67 -0.03 -0.06 0.00 -1.03 0.00 0.00 41.12 40.67 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 -1.03 2.98 -0.15 0.11 4.76 -0.40 -4.73 118.16 119.70 1i0h n LYS 67 Ca 0.23 -0.02 -0.08 0.00 -2.87 0.00 0.00 58.31 55.56 1i0h n LYS 67 Cb 0.12 -1.01 0.00 0.00 -1.84 0.00 0.00 35.03 32.30 1i0h n LYS 67 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 1i0h h LYS 68 N 0.00 0.64 -0.05 1.97 1.57 -1.51 -2.22 116.57 116.97 1i0h h LYS 68 Ca 0.00 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.64 1i0h h LYS 68 Cb 0.27 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1i0h h LYS 68 CO 0.00 0.53 -0.17 1.15 -0.57 0.00 0.00 179.45 180.39 1i0h h THR 69 N 0.58 1.45 -0.39 -0.16 2.02 -1.85 -0.69 112.91 113.88 1i0h h THR 69 Ca 0.15 -1.60 -0.04 0.00 0.77 0.00 0.00 66.41 65.69 1i0h h THR 69 Cb 0.10 2.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.87 1i0h h THR 69 CO -0.02 0.44 0.06 1.62 0.37 0.00 0.00 175.52 178.00 1i0h h VAL 70 N -0.34 1.19 0.11 3.16 3.04 -1.85 -1.03 116.25 120.52 1i0h h VAL 70 Ca -0.01 -0.70 -0.29 0.00 -1.01 0.00 0.00 66.70 64.69 1i0h h VAL 70 Cb 0.81 0.83 -0.01 0.00 -2.01 0.00 0.00 31.29 30.91 1i0h h VAL 70 CO 0.04 0.25 -1.41 -0.07 -1.01 0.00 0.00 177.57 175.37 1i0h h LEU 71 N 0.56 0.35 -0.57 3.16 3.38 -1.44 -0.88 115.31 119.89 1i0h h LEU 71 Ca 0.13 -0.45 0.11 0.00 0.09 0.00 0.00 57.88 57.76 1i0h h LEU 71 Cb 0.26 -0.11 -0.11 0.00 0.09 0.00 0.00 40.66 40.79 1i0h h LEU 71 CO 0.00 1.37 -0.15 -0.09 0.09 0.00 0.00 178.44 179.66 1i0h h ARG 72 N 0.06 -0.01 -0.15 1.13 2.43 -0.88 0.19 114.38 117.16 1i0h h ARG 72 Ca -0.19 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 58.91 1i0h h ARG 72 Cb 1.98 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 31.53 1i0h h ARG 72 CO 0.17 -0.01 -0.15 -0.91 -1.51 0.00 0.00 179.97 177.56 1i0h h ASN 73 N -0.01 0.39 0.16 -3.80 2.35 -1.19 -1.77 115.58 111.71 1i0h h ASN 73 Ca 0.27 -0.49 -0.36 0.00 -0.55 0.00 0.00 56.30 55.18 1i0h h ASN 73 Cb 0.42 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.65 1i0h h ASN 73 CO -0.59 0.80 -2.05 0.59 -1.65 0.00 0.00 177.43 174.53 1i0h n ASN 74 N -4.54 1.82 -0.06 5.81 3.02 -0.34 -1.57 115.26 119.40 1i0h n ASN 74 Ca -0.06 0.17 -0.07 0.00 -0.03 0.00 0.00 54.58 54.59 1i0h n ASN 74 Cb 0.37 -0.58 0.11 0.00 -0.61 0.00 0.00 39.78 39.07 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 0.24 0.92 -0.31 5.41 0.00 -0.80 -0.92 119.26 123.81 1i0h h ALA 75 Ca -0.43 -0.37 0.06 0.00 0.00 0.00 0.00 54.91 54.16 1i0h h ALA 75 Cb 2.02 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 19.61 1i0h h ALA 75 CO 0.05 0.62 -0.03 0.78 0.00 0.00 0.00 179.25 180.67 1i0h h GLY 76 N 0.98 0.27 0.93 0.00 0.00 -1.21 0.61 103.07 104.65 1i0h h GLY 76 Ca 0.08 0.06 0.02 0.00 0.00 0.00 0.00 47.33 47.49 1i0h h GLY 76 CO 0.06 -0.09 0.45 -1.33 0.00 0.00 0.00 176.54 175.63 1i0h h GLY 77 N 0.05 1.00 0.84 4.60 0.00 -0.96 0.72 103.07 109.33 1i0h h GLY 77 Ca 0.15 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 1i0h h GLY 77 CO -0.27 0.32 -0.02 0.84 0.00 0.00 0.00 176.54 177.40 1i0h h HIS 78 N 0.90 0.49 -0.43 5.60 6.17 -0.77 -1.60 115.15 125.51 1i0h h HIS 78 Ca 0.27 -0.09 0.00 0.00 0.71 0.00 0.00 60.37 61.26 1i0h h HIS 78 Cb -0.04 -0.12 -0.02 0.00 2.52 0.00 0.00 27.41 29.74 1i0h h HIS 78 CO -0.03 0.63 0.28 0.00 0.71 0.00 0.00 177.93 179.52 1i0h h ALA 79 N 0.79 0.55 -0.33 5.26 0.00 -0.59 -1.57 119.26 123.37 1i0h h ALA 79 Ca 0.07 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1i0h h ALA 79 Cb 0.45 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1i0h h ALA 79 CO 0.02 0.01 -0.19 -0.91 0.00 0.00 0.00 179.25 178.17 1i0h h ASN 80 N 0.58 0.74 -0.38 0.00 2.35 -0.76 -1.68 115.58 116.42 1i0h h ASN 80 Ca 0.16 -0.42 -0.12 0.00 -0.55 0.00 0.00 56.30 55.37 1i0h h ASN 80 Cb -0.05 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.10 1i0h h ASN 80 CO -0.03 1.00 -0.19 0.45 -1.65 0.00 0.00 177.43 177.01 1i0h h HIS 81 N 0.48 0.98 -0.53 1.19 3.86 -1.24 0.07 115.15 119.96 1i0h h HIS 81 Ca 0.07 -0.22 0.04 0.00 -1.16 0.00 0.00 60.37 59.10 1i0h h HIS 81 Cb 0.74 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.92 1i0h h HIS 81 CO 0.06 0.98 0.28 0.77 0.86 0.00 0.00 177.93 180.88 1i0h h SER 82 N 0.76 0.40 -0.20 2.45 0.02 -1.12 -0.76 113.55 115.11 1i0h h SER 82 Ca 0.11 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1i0h h SER 82 Cb 0.72 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1i0h h SER 82 CO 0.06 0.28 0.07 0.25 -1.14 0.00 0.00 176.83 176.34 1i0h h LEU 83 N 0.53 0.28 -0.44 5.07 6.46 -1.10 -3.12 115.31 122.99 1i0h h LEU 83 Ca 0.23 -0.19 0.08 0.00 -0.12 0.00 0.00 57.88 57.88 1i0h h LEU 83 Cb 0.13 -0.07 -0.07 0.00 -0.73 0.00 0.00 40.66 39.92 1i0h h LEU 83 CO -0.15 0.40 0.01 0.15 -0.62 0.00 0.00 178.44 178.22 1i0h h PHE 84 N 0.15 -0.01 -0.81 1.25 3.57 -0.41 0.80 116.94 121.47 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 0.21 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.99 1i0h h PHE 84 CO -0.00 -0.08 0.42 -1.49 -2.23 0.00 0.00 178.31 174.93 1i0h h TRP 85 N 0.12 1.14 0.00 0.41 -0.00 -1.16 -0.94 115.95 115.51 1i0h h TRP 85 Ca 0.22 -0.04 0.00 0.00 -0.00 0.00 0.00 58.89 59.07 1i0h h TRP 85 Cb 0.32 -0.36 0.00 0.00 -0.00 0.00 0.00 29.16 29.12 1i0h h TRP 85 CO -0.28 0.81 0.00 0.87 -0.00 0.00 0.00 178.44 179.84 1i0h h LYS 86 N 1.14 0.00 -0.46 0.49 1.57 -1.36 -3.09 116.57 114.86 1i0h h LYS 86 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1i0h h LYS 86 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1i0h h LYS 86 CO -0.04 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.25 1i0h n GLY 87 N 0.72 1.14 3.32 3.86 0.00 0.22 -4.79 105.19 109.65 1i0h n GLY 87 Ca 0.03 -0.50 -0.31 0.00 0.00 0.00 0.00 46.02 45.24 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 -1.00 2.14 -0.29 0.99 1.43 -1.05 -0.43 118.68 120.46 1i0h s LEU 88 Ca 0.31 -0.45 -0.18 0.00 -1.03 0.00 0.00 54.13 52.77 1i0h s LEU 88 Cb 0.16 -1.38 0.16 0.00 0.03 0.00 0.00 46.19 45.16 1i0h s LEU 88 CO 0.21 0.29 1.10 -0.75 0.23 0.00 0.00 176.35 177.44 1i0h s LYS 89 N -0.46 0.28 0.74 1.70 2.20 0.12 -4.69 119.74 119.63 1i0h s LYS 89 Ca 0.05 0.44 -0.11 0.00 -0.36 0.00 0.00 55.97 55.99 1i0h s LYS 89 Cb -0.11 0.08 0.03 0.00 -1.51 0.00 0.00 37.83 36.32 1i0h s LYS 89 CO 0.01 -0.05 1.08 0.15 -0.36 0.00 0.00 175.35 176.17 1i0h s LYS 90 N 0.95 2.58 -0.65 4.03 1.02 -1.26 -4.31 119.74 122.10 1i0h s LYS 90 Ca -0.05 0.76 -0.04 0.00 0.02 0.00 0.00 55.97 56.66 1i0h s LYS 90 Cb -0.04 -1.96 0.00 0.00 -0.52 0.00 0.00 37.83 35.31 1i0h s LYS 90 CO -0.12 -1.30 0.56 0.41 -0.92 0.00 0.00 175.35 173.98 1i0h n GLY 91 N -2.16 0.21 3.49 -3.33 0.00 -1.26 -5.05 105.19 97.09 1i0h n GLY 91 Ca 0.07 -0.22 -0.24 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.16 2.19 -0.03 2.61 -4.23 -1.26 -5.06 115.64 106.69 1i0h s THR 92 Ca 0.25 -2.26 0.01 0.00 -1.18 0.00 0.00 61.69 58.52 1i0h s THR 92 Cb -0.11 -2.47 0.02 0.00 1.34 0.00 0.00 72.50 71.28 1i0h s THR 92 CO 0.35 -0.31 -0.05 -0.89 -0.54 0.00 0.00 174.62 173.18 1i0h s THR 93 N -2.67 0.56 -0.03 3.99 2.01 -1.26 -4.88 115.64 113.35 1i0h s THR 93 Ca 0.31 -0.18 -0.30 0.00 0.31 0.00 0.00 61.69 61.83 1i0h s THR 93 Cb 0.00 -0.55 -0.07 0.00 0.01 0.00 0.00 72.50 71.89 1i0h s THR 93 CO 0.15 0.21 1.79 -0.22 -0.69 0.00 0.00 174.62 175.86 1i0h s LEU 94 N 0.64 4.31 0.00 4.42 2.96 -1.26 -4.76 118.68 124.99 1i0h s LEU 94 Ca -0.09 2.36 -0.08 0.00 -0.22 0.00 0.00 54.13 56.10 1i0h s LEU 94 Cb -0.12 -3.53 0.03 0.00 0.50 0.00 0.00 46.19 43.07 1i0h s LEU 94 CO 0.00 -1.03 0.43 0.00 -1.32 0.00 0.00 176.35 174.43 1i0h n GLN 95 N 7.38 0.45 0.00 1.98 10.64 -1.26 -4.87 117.38 131.70 1i0h n GLN 95 Ca 0.19 -0.93 0.00 0.00 -1.83 0.00 0.00 57.00 54.43 1i0h n GLN 95 Cb 0.42 1.19 0.00 0.00 -0.86 0.00 0.00 30.24 30.99 1i0h n GLN 95 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1i0h n GLY 96 N -0.29 1.00 0.37 2.61 0.00 -1.26 -2.30 105.19 105.32 1i0h n GLY 96 Ca -0.03 -0.65 0.06 0.00 0.00 0.00 0.00 46.02 45.39 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 6.56 0.95 -0.38 1.61 3.32 -1.99 -2.31 116.42 124.19 1i0h h ASP 97 Ca 0.00 0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 1i0h h ASP 97 Cb 0.00 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1i0h h ASP 97 CO 0.00 0.55 -0.02 0.25 -1.72 0.00 0.00 179.24 178.31 1i0h h LEU 98 N 1.05 0.68 -0.49 1.55 5.85 -1.92 -0.36 115.31 121.67 1i0h h LEU 98 Ca 0.46 -0.32 0.06 0.00 0.84 0.00 0.00 57.88 58.92 1i0h h LEU 98 Cb 0.36 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 1i0h h LEU 98 CO -0.22 0.83 0.20 0.50 -0.34 0.00 0.00 178.44 179.41 1i0h h LYS 99 N 0.50 0.38 -0.41 1.25 3.64 -1.17 -0.26 116.57 120.50 1i0h h LYS 99 Ca 0.11 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.39 1i0h h LYS 99 Cb 0.49 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 1i0h h LYS 99 CO 0.02 0.25 -0.06 0.00 -2.27 0.00 0.00 179.45 177.39 1i0h h ALA 100 N 1.31 1.13 -0.46 5.00 0.00 -1.02 -0.76 119.26 124.45 1i0h h ALA 100 Ca 0.23 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1i0h h ALA 100 Cb 0.21 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1i0h h ALA 100 CO -0.21 0.55 -0.20 0.00 0.00 0.00 0.00 179.25 179.39 1i0h h ALA 101 N 1.29 0.78 -0.58 0.00 0.00 -0.63 0.10 119.26 120.22 1i0h h ALA 101 Ca 0.12 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 1i0h h ALA 101 Cb 0.49 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1i0h h ALA 101 CO 0.03 0.66 0.18 0.82 0.00 0.00 0.00 179.25 180.93 1i0h h ILE 102 N 0.80 1.24 -0.76 0.00 2.04 -0.64 0.23 117.51 120.42 1i0h h ILE 102 Ca 0.11 -0.83 -0.02 0.00 1.00 0.00 0.00 64.86 65.12 1i0h h ILE 102 Cb 0.75 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 1i0h h ILE 102 CO 0.06 0.31 0.40 -0.33 0.00 0.00 0.00 178.15 178.59 1i0h h GLU 103 N 0.82 1.08 -0.14 2.37 5.08 -0.93 -0.16 114.58 122.71 1i0h h GLU 103 Ca 0.19 -0.14 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1i0h h GLU 103 Cb 0.29 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 1i0h h GLU 103 CO -0.00 0.82 -0.03 -0.09 -1.00 0.00 0.00 179.01 178.70 1i0h h ARG 104 N 1.06 0.00 0.00 2.33 2.43 -0.47 0.12 114.38 119.86 1i0h h ARG 104 Ca 0.27 -0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 59.27 1i0h h ARG 104 Cb 0.07 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 1i0h h ARG 104 CO -0.04 0.00 -1.15 -0.44 -1.51 0.00 0.00 179.97 176.83 1i0h h ASP 105 N 0.00 0.00 -0.00 -3.80 3.32 -0.67 -3.35 116.42 111.93 1i0h h ASP 105 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1i0h h ASP 105 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1i0h h ASP 105 CO -0.14 0.65 -0.38 0.49 -1.72 0.00 0.00 179.24 178.13 1i0h n PHE 106 N -3.05 0.00 0.00 4.55 3.72 -0.10 -4.98 117.46 117.60 1i0h n PHE 106 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 1i0h n PHE 106 Cb 0.84 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.38 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 1.17 2.84 3.53 1.37 0.00 0.03 -4.61 105.19 109.52 1i0h n GLY 107 Ca 0.02 -0.48 -0.09 0.00 0.00 0.00 0.00 46.02 45.46 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 0.30 -0.42 0.19 1.61 1.04 -1.23 -4.80 113.70 110.39 1i0h s SER 108 Ca 0.00 -0.10 -0.11 0.00 0.48 0.00 0.00 55.95 56.22 1i0h s SER 108 Cb 0.00 0.52 0.12 0.00 0.10 0.00 0.00 66.02 66.77 1i0h s SER 108 CO 0.00 -0.88 1.82 0.58 0.98 0.00 0.00 173.24 175.74 1i0h h VAL 109 N 2.00 1.21 -0.26 5.02 2.07 -1.91 -2.35 116.25 122.03 1i0h h VAL 109 Ca -0.27 -0.51 -0.07 0.00 0.82 0.00 0.00 66.70 66.67 1i0h h VAL 109 Cb 1.27 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1i0h h VAL 109 CO 0.33 0.23 -0.13 0.44 0.02 0.00 0.00 177.57 178.46 1i0h h ASP 110 N 0.95 0.42 -0.49 0.57 3.32 -1.97 0.10 116.42 119.33 1i0h h ASP 110 Ca 0.24 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 1i0h h ASP 110 Cb 0.02 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1i0h h ASP 110 CO -0.04 0.58 0.19 0.78 -1.72 0.00 0.00 179.24 179.03 1i0h h ASN 111 N 0.40 0.67 -0.42 6.45 2.35 -1.80 -0.97 115.58 122.26 1i0h h ASN 111 Ca 0.08 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 1i0h h ASN 111 Cb 0.47 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 1i0h h ASN 111 CO 0.03 0.66 0.23 0.15 -1.65 0.00 0.00 177.43 176.84 1i0h h PHE 112 N 0.64 0.57 -0.70 1.19 3.57 -0.81 -1.28 116.94 120.13 1i0h h PHE 112 Ca 0.16 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 1i0h h PHE 112 Cb 0.20 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 1i0h h PHE 112 CO 0.00 0.44 0.40 0.87 -2.23 0.00 0.00 178.31 177.79 1i0h h LYS 113 N 0.54 0.96 -0.54 1.11 1.57 -0.63 -0.08 116.57 119.50 1i0h h LYS 113 Ca 0.15 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1i0h h LYS 113 Cb 0.06 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 1i0h h LYS 113 CO -0.02 0.70 0.22 0.00 -0.57 0.00 0.00 179.45 179.78 1i0h h ALA 114 N 1.20 0.70 -0.84 3.86 0.00 -1.00 0.52 119.26 123.70 1i0h h ALA 114 Ca 0.25 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1i0h h ALA 114 Cb 0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1i0h h ALA 114 CO -0.04 0.31 0.42 1.49 0.00 0.00 0.00 179.25 181.42 1i0h h GLU 115 N 0.73 1.21 -0.36 0.00 4.81 -0.89 -0.42 114.58 119.65 1i0h h GLU 115 Ca 0.18 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 59.16 1i0h h GLU 115 Cb 0.19 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1i0h h GLU 115 CO -0.02 0.92 -0.07 0.35 -0.73 0.00 0.00 179.01 179.46 1i0h h PHE 116 N 1.19 0.77 -1.00 0.92 3.57 -0.64 -1.26 116.94 120.50 1i0h h PHE 116 Ca 0.29 -0.16 0.01 0.00 3.53 0.00 0.00 57.97 61.64 1i0h h PHE 116 Cb 0.10 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 38.60 1i0h h PHE 116 CO 0.01 0.83 0.67 0.93 -2.23 0.00 0.00 178.31 178.52 1i0h h GLU 117 N 0.49 1.31 -0.28 1.11 5.08 -0.65 0.45 114.58 122.08 1i0h h GLU 117 Ca 0.09 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 1i0h h GLU 117 Cb 0.57 -0.30 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1i0h h GLU 117 CO 0.03 0.87 -0.00 0.87 -1.00 0.00 0.00 179.01 179.78 1i0h h LYS 118 N 1.35 0.50 -0.62 2.33 1.57 -0.92 -1.06 116.57 119.73 1i0h h LYS 118 Ca 0.37 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.93 1i0h h LYS 118 Cb -0.14 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.10 1i0h h LYS 118 CO -0.09 0.65 0.15 0.00 -0.57 0.00 0.00 179.45 179.60 1i0h h ALA 119 N 0.83 0.81 -0.54 3.86 0.00 -0.96 -0.89 119.26 122.37 1i0h h ALA 119 Ca 0.08 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1i0h h ALA 119 Cb 0.43 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1i0h h ALA 119 CO 0.01 0.52 -0.02 0.00 0.00 0.00 0.00 179.25 179.76 1i0h h ALA 120 N 1.04 0.94 0.00 0.00 0.00 -0.88 -2.81 119.26 117.56 1i0h h ALA 120 Ca 0.19 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 1i0h h ALA 120 Cb 0.36 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1i0h h ALA 120 CO 0.00 0.63 -0.70 0.00 0.00 0.00 0.00 179.25 179.18 1i0h h ALA 121 N 1.10 0.83 -0.01 0.00 0.00 -0.97 -3.31 119.26 116.91 1i0h h ALA 121 Ca 0.15 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1i0h h ALA 121 Cb 0.54 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1i0h h ALA 121 CO 0.03 0.88 -0.11 -1.13 0.00 0.00 0.00 179.25 178.92 1i0h n SER 122 N -3.69 1.59 -4.55 0.00 3.41 -0.36 -4.72 113.62 105.30 1i0h n SER 122 Ca -0.01 -1.38 -0.38 0.00 -0.26 0.00 0.00 58.87 56.84 1i0h n SER 122 Cb 0.69 0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.68 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 -2.19 2.79 0.07 4.33 6.06 -1.08 -4.97 118.95 123.96 1i0h s ARG 123 Ca 0.31 0.27 -0.29 0.00 -2.50 0.00 0.00 55.73 53.52 1i0h s ARG 123 Cb 0.20 -4.42 -0.05 0.00 0.06 0.00 0.00 34.95 30.75 1i0h s ARG 123 CO 0.40 -2.62 0.92 0.12 -2.50 0.00 0.00 175.30 171.62 1i0h s PHE 124 N 8.18 3.76 0.00 5.12 5.36 -1.26 -4.75 117.98 134.38 1i0h s PHE 124 Ca 0.58 1.70 0.00 0.00 -0.96 0.00 0.00 56.93 58.25 1i0h s PHE 124 Cb -0.11 -3.02 0.00 0.00 -0.34 0.00 0.00 43.02 39.56 1i0h s PHE 124 CO 0.17 0.17 0.00 0.41 -1.46 0.00 0.00 175.22 174.51 1i0h n GLY 125 N 2.44 -0.30 3.87 13.12 0.00 -1.26 -4.91 105.19 118.14 1i0h n GLY 125 Ca 0.02 -1.19 -0.33 0.00 0.00 0.00 0.00 46.02 44.52 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 6.65 0.00 1.61 0.01 -1.26 -4.81 113.70 111.90 1i0h s SER 126 Ca 0.00 0.91 0.00 0.00 1.31 0.00 0.00 55.95 58.17 1i0h s SER 126 Cb 0.00 -2.22 0.00 0.00 0.21 0.00 0.00 66.02 64.01 1i0h s SER 126 CO 0.00 -0.00 0.00 0.61 0.41 0.00 0.00 173.24 174.26 1i0h n GLY 127 N 0.17 -0.58 2.93 3.44 0.00 -1.26 -0.67 105.19 109.22 1i0h n GLY 127 Ca -0.02 -0.96 -0.11 0.00 0.00 0.00 0.00 46.02 44.93 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 -3.00 0.15 -0.09 1.61 0.52 -0.67 -0.55 118.94 116.91 1i0h s TRP 128 Ca 0.00 -0.25 -0.02 0.00 0.02 0.00 0.00 56.10 55.85 1i0h s TRP 128 Cb 0.00 -0.10 -0.03 0.00 -1.15 0.00 0.00 33.47 32.18 1i0h s TRP 128 CO 0.00 -0.09 -0.01 0.00 0.02 0.00 0.00 176.95 176.88 1i0h s ALA 129 N -0.68 3.25 0.04 0.98 0.00 -0.52 -0.90 121.76 123.92 1i0h s ALA 129 Ca -0.07 -0.81 0.05 0.00 0.00 0.00 0.00 51.96 51.12 1i0h s ALA 129 Cb -0.05 -1.47 -0.02 0.00 0.00 0.00 0.00 23.12 21.58 1i0h s ALA 129 CO -0.00 0.56 -0.14 -1.58 0.00 0.00 0.00 175.76 174.59 1i0h s TRP 130 N -0.78 1.21 -0.27 0.00 0.52 0.80 -0.62 118.94 119.80 1i0h s TRP 130 Ca 0.12 -0.36 -0.13 0.00 0.02 0.00 0.00 56.10 55.76 1i0h s TRP 130 Cb -0.11 -0.72 -0.04 0.00 -1.15 0.00 0.00 33.47 31.44 1i0h s TRP 130 CO 0.02 0.03 0.26 -1.17 0.02 0.00 0.00 176.95 176.12 1i0h s LEU 131 N -1.14 4.04 0.24 2.99 2.96 -0.74 -1.70 118.68 125.34 1i0h s LEU 131 Ca 0.01 0.13 0.12 0.00 -0.22 0.00 0.00 54.13 54.17 1i0h s LEU 131 Cb -0.08 -2.25 -0.05 0.00 0.50 0.00 0.00 46.19 44.32 1i0h s LEU 131 CO 0.01 -0.09 -0.21 0.68 -1.32 0.00 0.00 176.35 175.42 1i0h s VAL 132 N 1.81 2.39 -0.42 1.68 -7.23 0.44 -0.08 120.40 118.99 1i0h s VAL 132 Ca 0.10 -2.26 -0.13 0.00 -1.81 0.00 0.00 61.98 57.89 1i0h s VAL 132 Cb -0.16 -2.22 0.05 0.00 0.56 0.00 0.00 36.38 34.61 1i0h s VAL 132 CO 0.10 -0.30 0.30 -0.22 -0.31 0.00 0.00 175.10 174.66 1i0h s LEU 133 N -3.18 5.17 -0.43 1.32 2.96 0.53 -0.67 118.68 124.38 1i0h s LEU 133 Ca 0.26 -1.15 -0.08 0.00 -0.22 0.00 0.00 54.13 52.94 1i0h s LEU 133 Cb -0.06 -2.10 0.09 0.00 0.50 0.00 0.00 46.19 44.62 1i0h s LEU 133 CO 0.13 -0.51 0.27 -0.75 -1.32 0.00 0.00 176.35 174.17 1i0h s LYS 134 N 1.60 2.49 6.05 1.98 2.20 0.41 -1.40 119.74 133.06 1i0h s LYS 134 Ca 0.04 -1.59 0.00 0.00 -0.36 0.00 0.00 55.97 54.06 1i0h s LYS 134 Cb -0.21 -3.79 0.00 0.00 -1.51 0.00 0.00 37.83 32.32 1i0h s LYS 134 CO 0.07 -1.03 0.00 0.41 -0.36 0.00 0.00 175.35 174.44 1i0h n GLY 135 N 4.87 3.44 0.05 5.54 0.00 -1.26 -1.23 105.19 116.59 1i0h n GLY 135 Ca -0.09 0.25 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1i0h n GLY 135 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1i0h n ASP 136 N 8.12 0.61 -4.30 1.61 -0.08 -1.26 -4.94 116.55 116.31 1i0h n ASP 136 Ca 0.00 -0.38 -0.31 0.00 -1.51 0.00 0.00 54.79 52.58 1i0h n ASP 136 Cb 0.00 0.24 -0.16 0.00 2.34 0.00 0.00 41.12 43.54 1i0h n ASP 136 CO 0.00 0.00 0.00 -0.75 0.12 0.00 0.00 177.20 176.57 1i0h s LYS 137 N -2.91 2.40 0.38 -0.67 2.20 -0.37 -5.11 119.74 115.67 1i0h s LYS 137 Ca 0.13 -0.90 -0.25 0.00 -0.36 0.00 0.00 55.97 54.60 1i0h s LYS 137 Cb 0.18 -2.14 -0.09 0.00 -1.51 0.00 0.00 37.83 34.27 1i0h s LYS 137 CO 0.67 0.46 1.03 -0.51 -0.36 0.00 0.00 175.35 176.63 1i0h s LEU 138 N -0.35 4.20 0.02 5.43 1.43 -1.26 -0.45 118.68 127.71 1i0h s LEU 138 Ca 0.02 2.00 -0.14 0.00 -1.03 0.00 0.00 54.13 54.98 1i0h s LEU 138 Cb -0.12 -4.13 0.02 0.00 0.03 0.00 0.00 46.19 41.99 1i0h s LEU 138 CO 0.02 -0.38 0.30 0.00 0.23 0.00 0.00 176.35 176.52 1i0h s ALA 139 N -1.64 -0.70 -0.22 4.21 0.00 0.15 -4.89 121.76 118.67 1i0h s ALA 139 Ca 0.55 0.10 -0.09 0.00 0.00 0.00 0.00 51.96 52.52 1i0h s ALA 139 Cb -0.21 0.24 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 1i0h s ALA 139 CO 0.27 -0.36 0.11 0.08 0.00 0.00 0.00 175.76 175.86 1i0h s VAL 140 N -2.14 4.91 0.17 0.00 1.01 -1.26 -0.42 120.40 122.67 1i0h s VAL 140 Ca -0.08 0.02 0.02 0.00 0.00 0.00 0.00 61.98 61.94 1i0h s VAL 140 Cb -0.02 -3.27 -0.05 0.00 0.00 0.00 0.00 36.38 33.04 1i0h s VAL 140 CO -0.01 0.38 0.00 0.68 0.00 0.00 0.00 175.10 176.15 1i0h s VAL 141 N 1.00 0.66 0.18 2.92 -7.23 -0.69 -5.00 120.40 112.25 1i0h s VAL 141 Ca 0.05 -1.98 0.07 0.00 -1.81 0.00 0.00 61.98 58.32 1i0h s VAL 141 Cb -0.14 -2.12 -0.04 0.00 0.56 0.00 0.00 36.38 34.63 1i0h s VAL 141 CO 0.03 -0.47 -0.14 -0.94 -0.31 0.00 0.00 175.10 173.28 1i0h s SER 142 N -3.17 2.35 0.14 4.85 1.04 -1.26 -0.14 113.70 117.52 1i0h s SER 142 Ca 0.24 -0.98 0.05 0.00 0.48 0.00 0.00 55.95 55.75 1i0h s SER 142 Cb 0.06 -0.10 -0.04 0.00 0.10 0.00 0.00 66.02 66.03 1i0h s SER 142 CO 0.04 -0.19 -0.11 0.42 0.98 0.00 0.00 173.24 174.38 1i0h s THR 143 N -2.84 1.25 0.31 2.02 -4.23 -0.08 -4.74 115.64 107.33 1i0h s THR 143 Ca 0.19 -1.97 -0.18 0.00 -1.18 0.00 0.00 61.69 58.55 1i0h s THR 143 Cb -0.01 -1.76 -0.09 0.00 1.34 0.00 0.00 72.50 71.98 1i0h s THR 143 CO 0.05 -0.64 0.78 0.00 -0.54 0.00 0.00 174.62 174.26 1i0h s ALA 144 N -2.95 3.30 0.00 3.99 0.00 -1.26 -1.67 121.76 123.16 1i0h s ALA 144 Ca 0.15 0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.26 1i0h s ALA 144 Cb 0.00 -2.86 0.00 0.00 0.00 0.00 0.00 23.12 20.26 1i0h s ALA 144 CO 0.02 0.29 0.00 0.09 0.00 0.00 0.00 175.76 176.16 1i0h n ASN 145 N -0.08 0.00 -1.37 0.00 3.02 0.16 -1.00 115.26 115.98 1i0h n ASN 145 Ca 0.02 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.60 1i0h n ASN 145 Cb 0.53 0.00 0.28 0.00 -0.61 0.00 0.00 39.78 39.98 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 3.20 -1.86 3.52 1.13 -1.26 -4.08 117.38 132.02 1i0h n GLN 146 Ca 0.00 -3.01 -0.35 0.00 -1.94 0.00 0.00 57.00 51.70 1i0h n GLN 146 Cb 0.00 -2.00 0.05 0.00 0.11 0.00 0.00 30.24 28.40 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 -1.65 5.03 0.04 1.08 1.01 -0.17 -4.07 116.67 117.94 1i0h s ASP 147 Ca 0.48 2.25 0.05 0.00 0.71 0.00 0.00 52.55 56.04 1i0h s ASP 147 Cb 0.39 -2.58 -0.02 0.00 1.01 0.00 0.00 42.92 41.72 1i0h s ASP 147 CO 0.10 -1.69 -0.14 -0.55 0.21 0.00 0.00 175.17 173.09 1i0h s SER 148 N -1.96 1.64 0.64 0.27 0.15 -1.26 -4.74 113.70 108.43 1i0h s SER 148 Ca 0.73 -0.47 0.35 0.00 0.70 0.00 0.00 55.95 57.27 1i0h s SER 148 Cb -0.27 -0.10 1.97 0.00 -1.71 0.00 0.00 66.02 65.91 1i0h s SER 148 CO 0.37 0.02 2.18 -0.65 1.20 0.00 0.00 173.24 176.36 1i0h h PRO 149 N 4.87 0.00 0.00 5.44 0.11 -1.84 -0.56 132.00 140.02 1i0h h PRO 149 Ca -0.38 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 1i0h h PRO 149 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 1i0h h PRO 149 CO 0.43 0.00 -0.03 -0.07 -0.21 0.00 0.00 178.00 178.12 1i0h h LEU 150 N 0.00 0.00 -0.16 2.35 3.38 -1.88 -1.76 115.31 117.25 1i0h h LEU 150 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1i0h h LEU 150 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1i0h h LEU 150 CO -0.00 0.03 0.00 0.23 0.09 0.00 0.00 178.44 178.79 1i0h n MET 151 N -3.22 0.13 0.00 1.13 2.81 -0.22 -4.30 117.12 113.46 1i0h n MET 151 Ca -0.01 0.21 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 1i0h n MET 151 Cb 0.20 -1.68 0.00 0.00 -0.71 0.00 0.00 33.22 31.03 1i0h n MET 151 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1i0h n GLY 152 N 0.83 -0.12 0.17 3.03 0.00 -0.66 -4.51 105.19 103.93 1i0h n GLY 152 Ca 0.05 -1.79 -0.13 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 0.51 -0.40 1.61 4.39 -1.74 -1.09 114.58 117.86 1i0h h GLU 153 Ca 0.00 -0.27 -0.04 0.00 0.34 0.00 0.00 59.36 59.39 1i0h h GLU 153 Cb 0.00 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 1i0h h GLU 153 CO 0.00 0.85 0.09 0.00 -1.16 0.00 0.00 179.01 178.79 1i0h h ALA 154 N 0.65 1.40 0.00 3.43 0.00 -1.86 0.23 119.26 123.12 1i0h h ALA 154 Ca 0.03 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 1i0h h ALA 154 Cb 0.76 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1i0h h ALA 154 CO 0.05 0.43 -0.64 0.82 0.00 0.00 0.00 179.25 179.91 1i0h h ILE 155 N 0.58 1.31 0.00 0.00 2.04 -1.78 -3.41 117.51 116.25 1i0h h ILE 155 Ca 0.13 -2.23 0.00 0.00 1.00 0.00 0.00 64.86 63.76 1i0h h ILE 155 Cb 0.24 2.72 0.00 0.00 -0.74 0.00 0.00 36.82 39.04 1i0h h ILE 155 CO -0.00 0.44 -1.37 -1.54 0.00 0.00 0.00 178.15 175.68 1i0h n SER 156 N -4.52 0.59 0.00 1.72 3.41 -0.42 -4.95 113.62 109.44 1i0h n SER 156 Ca -0.21 -0.55 0.00 0.00 -0.26 0.00 0.00 58.87 57.85 1i0h n SER 156 Cb 0.57 1.35 0.00 0.00 -0.26 0.00 0.00 64.21 65.87 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 1.40 0.74 3.20 5.00 0.00 0.82 -4.62 105.19 111.73 1i0h n GLY 157 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.05 0.93 0.30 4.61 0.00 -1.26 -4.94 121.76 118.35 1i0h s ALA 158 Ca 0.00 -1.54 -0.12 0.00 0.00 0.00 0.00 51.96 50.30 1i0h s ALA 158 Cb 0.00 1.15 0.01 0.00 0.00 0.00 0.00 23.12 24.28 1i0h s ALA 158 CO 0.00 -0.56 0.57 -1.54 0.00 0.00 0.00 175.76 174.23 1i0h s SER 159 N -3.10 0.11 0.00 0.00 1.04 -1.26 -2.25 113.70 108.24 1i0h s SER 159 Ca 0.31 -1.03 0.00 0.00 0.48 0.00 0.00 55.95 55.71 1i0h s SER 159 Cb 0.07 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.86 1i0h s SER 159 CO 0.07 -1.31 0.00 0.61 0.98 0.00 0.00 173.24 173.60 1i0h n GLY 160 N -0.46 2.28 3.63 7.32 0.00 -1.25 -4.83 105.19 111.88 1i0h n GLY 160 Ca -0.03 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.53 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 -2.31 3.26 0.16 1.61 5.36 -0.49 -4.03 117.98 121.54 1i0h s PHE 161 Ca 0.00 1.03 -0.31 0.00 -0.96 0.00 0.00 56.93 56.68 1i0h s PHE 161 Cb 0.00 -3.14 -0.11 0.00 -0.34 0.00 0.00 43.02 39.43 1i0h s PHE 161 CO 0.00 -0.48 1.71 -2.14 -1.46 0.00 0.00 175.22 172.85 1i0h s PRO 162 N 2.93 4.16 -0.21 10.12 0.02 -1.26 -0.34 135.00 150.41 1i0h s PRO 162 Ca 0.35 2.52 -0.14 0.00 0.02 0.00 0.00 61.00 63.74 1i0h s PRO 162 Cb -0.15 -3.29 -0.19 0.00 0.02 0.00 0.00 34.50 30.89 1i0h s PRO 162 CO 0.10 -0.74 0.06 -0.89 -0.33 0.00 0.00 177.00 175.19 1i0h n ILE 163 N 4.27 1.58 -3.93 2.83 2.08 0.88 -4.91 119.36 122.18 1i0h n ILE 163 Ca 0.16 -0.31 -0.09 0.00 0.56 0.00 0.00 62.75 63.07 1i0h n ILE 163 Cb 0.37 -1.87 -0.03 0.00 -0.75 0.00 0.00 39.64 37.37 1i0h n ILE 163 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1i0h s MET 164 N -2.46 1.78 0.13 0.38 0.23 -1.10 -4.44 119.30 113.83 1i0h s MET 164 Ca -0.31 -1.23 -0.23 0.00 -1.03 0.00 0.00 55.69 52.89 1i0h s MET 164 Cb 0.09 0.54 0.07 0.00 -1.53 0.00 0.00 34.83 34.00 1i0h s MET 164 CO 0.60 -0.79 0.59 0.20 -2.03 0.00 0.00 175.02 173.60 1i0h s GLY 165 N -3.01 -0.58 -0.14 3.16 0.00 -1.26 -1.78 107.32 103.70 1i0h s GLY 165 Ca 0.18 0.56 0.02 0.00 0.00 0.00 0.00 44.72 45.48 1i0h s GLY 165 CO 0.10 0.23 -0.20 -2.27 0.00 0.00 0.00 173.10 170.96 1i0h s LEU 166 N -2.54 2.01 -0.14 0.66 2.96 0.20 -4.89 118.68 116.95 1i0h s LEU 166 Ca -0.01 -0.57 -0.29 0.00 -0.22 0.00 0.00 54.13 53.04 1i0h s LEU 166 Cb -0.01 -1.37 -0.02 0.00 0.50 0.00 0.00 46.19 45.29 1i0h s LEU 166 CO -0.10 0.05 1.35 -0.62 -1.32 0.00 0.00 176.35 175.71 1i0h s ASP 167 N 0.96 6.88 -0.16 3.68 -1.08 -1.26 -1.44 116.67 124.25 1i0h s ASP 167 Ca -0.04 1.82 0.17 0.00 -0.52 0.00 0.00 52.55 53.98 1i0h s ASP 167 Cb -0.15 -2.54 0.42 0.00 -1.46 0.00 0.00 42.92 39.20 1i0h s ASP 167 CO -0.04 -0.79 1.30 1.33 0.52 0.00 0.00 175.17 177.49 1i0h n VAL 168 N 5.36 2.13 -1.72 1.11 0.24 0.29 -4.86 118.33 120.88 1i0h n VAL 168 Ca 0.15 -2.13 -0.39 0.00 -2.04 0.00 0.00 64.34 59.93 1i0h n VAL 168 Cb 0.44 -0.25 0.04 0.00 -1.47 0.00 0.00 33.84 32.60 1i0h n VAL 168 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 1i0h n TRP 169 N -0.96 2.13 -0.11 6.34 7.02 -1.13 -4.40 117.44 126.32 1i0h n TRP 169 Ca 0.20 0.44 0.08 0.00 -1.02 0.00 0.00 57.50 57.20 1i0h n TRP 169 Cb 0.79 -2.34 0.42 0.00 -2.42 0.00 0.00 31.31 27.75 1i0h n TRP 169 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 1i0h h GLU 170 N 1.46 0.58 -0.05 -0.99 5.08 -1.94 -1.32 114.58 117.39 1i0h h GLU 170 Ca -0.50 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 57.84 1i0h h GLU 170 Cb 1.31 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 1i0h h GLU 170 CO 0.57 0.38 0.08 1.12 -1.00 0.00 0.00 179.01 180.16 1i0h h HIS 171 N 0.59 0.00 0.00 4.33 2.07 -1.99 -0.66 115.15 119.49 1i0h h HIS 171 Ca 0.27 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.79 1i0h h HIS 171 Cb 0.30 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.28 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 1.90 1.00 0.00 6.11 0.00 -1.57 -3.37 119.26 123.33 1i0h h ALA 172 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1i0h h ALA 172 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 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 -2.86 0.00 0.02 0.00 0.18 -0.67 -4.93 117.16 108.91 1i0h n TYR 173 Ca 0.03 -0.01 -0.13 0.00 1.88 0.00 0.00 57.90 59.67 1i0h n TYR 173 Cb 0.38 -0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 39.26 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 -0.03 -0.46 -3.48 3.57 -1.32 0.13 116.94 115.35 1i0h h PHE 174 Ca 0.00 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.55 1i0h h PHE 174 Cb 0.65 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.35 1i0h h PHE 174 CO 0.00 0.24 0.20 -0.07 -2.23 0.00 0.00 178.31 176.45 1i0h h LEU 175 N -0.30 0.26 0.06 0.59 3.38 -1.86 0.11 115.31 117.54 1i0h h LEU 175 Ca -0.00 0.04 -0.34 0.00 0.09 0.00 0.00 57.88 57.67 1i0h h LEU 175 Cb 0.29 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 1i0h h LEU 175 CO 0.01 0.19 -1.93 1.17 0.09 0.00 0.00 178.44 177.96 1i0h n LYS 176 N -4.95 0.69 0.00 1.13 4.81 -1.22 -4.56 118.16 114.06 1i0h n LYS 176 Ca 0.04 0.25 0.04 0.00 -0.87 0.00 0.00 58.31 57.77 1i0h n LYS 176 Cb 0.15 -1.72 -0.01 0.00 0.02 0.00 0.00 35.03 33.47 1i0h n LYS 176 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1i0h n PHE 177 N -3.23 0.00 0.00 5.64 3.01 0.43 -5.06 117.46 118.25 1i0h n PHE 177 Ca -0.27 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.19 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 -0.39 0.00 -0.05 -1.08 6.02 0.36 -0.54 117.38 121.70 1i0h n GLN 178 Ca 0.03 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.14 1i0h n GLN 178 Cb 0.16 0.00 0.40 0.00 1.02 0.00 0.00 30.24 31.82 1i0h n GLN 178 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1i0h n ASN 179 N 4.71 1.87 -3.63 1.08 5.15 -1.26 -4.39 115.26 118.78 1i0h n ASN 179 Ca 0.00 -1.67 -0.41 0.00 -0.60 0.00 0.00 54.58 51.90 1i0h n ASN 179 Cb 0.00 -0.06 -0.01 0.00 -0.53 0.00 0.00 39.78 39.18 1i0h n ASN 179 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1i0h n ARG 180 N 0.45 3.63 -0.36 1.20 1.74 0.30 -4.77 116.66 118.85 1i0h n ARG 180 Ca 0.17 -2.97 0.05 0.00 -0.77 0.00 0.00 57.85 54.33 1i0h n ARG 180 Cb 0.39 -2.94 0.20 0.00 -1.02 0.00 0.00 32.46 29.09 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 5.42 1.04 -0.38 5.56 2.43 -1.83 -1.88 114.38 124.75 1i0h h ARG 181 Ca 0.61 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.76 1i0h h ARG 181 Cb 0.49 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1i0h h ARG 181 CO 1.71 0.69 0.25 -1.35 -1.51 0.00 0.00 179.97 179.76 1i0h h PRO 182 N 1.07 0.30 -0.41 0.20 0.11 -1.97 -0.11 132.00 131.19 1i0h h PRO 182 Ca 0.46 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 66.45 1i0h h PRO 182 Cb 0.32 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.35 1i0h h PRO 182 CO -0.22 0.20 -0.14 -0.44 -0.21 0.00 0.00 178.00 177.19 1i0h h ASP 183 N 0.31 0.83 -0.51 -2.05 3.32 -1.75 -1.91 116.42 114.66 1i0h h ASP 183 Ca 0.16 -0.38 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 1i0h h ASP 183 Cb 0.25 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 1i0h h ASP 183 CO -0.03 1.02 0.26 0.22 -1.72 0.00 0.00 179.24 178.98 1i0h h TYR 184 N 0.63 0.72 -0.96 4.55 3.20 -1.16 -2.44 116.97 121.51 1i0h h TYR 184 Ca 0.10 -0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.96 1i0h h TYR 184 Cb 0.68 -0.23 -0.05 0.00 1.54 0.00 0.00 36.73 38.67 1i0h h TYR 184 CO 0.05 0.56 0.63 0.82 -1.64 0.00 0.00 178.16 178.58 1i0h h ILE 185 N 0.68 1.21 -0.47 1.81 2.04 -0.94 -1.82 117.51 120.02 1i0h h ILE 185 Ca 0.18 -0.43 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 1i0h h ILE 185 Cb 0.10 -0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 35.99 1i0h h ILE 185 CO -0.02 0.23 0.23 0.11 0.00 0.00 0.00 178.15 178.69 1i0h h LYS 186 N 1.26 0.67 0.00 2.37 1.57 -1.15 -2.43 116.57 118.86 1i0h h LYS 186 Ca 0.37 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 59.02 1i0h h LYS 186 Cb -0.07 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.11 1i0h h LYS 186 CO -0.10 0.57 -0.12 0.93 -0.57 0.00 0.00 179.45 180.16 1i0h h GLU 187 N 0.62 0.00 -0.94 3.15 4.39 -0.90 -2.68 114.58 118.21 1i0h h GLU 187 Ca 0.16 0.00 0.17 0.00 0.34 0.00 0.00 59.36 60.03 1i0h h GLU 187 Cb 0.11 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 28.68 1i0h h GLU 187 CO -0.02 0.12 0.60 0.35 -1.16 0.00 0.00 179.01 178.90 1i0h h PHE 188 N 0.00 0.86 -0.02 4.33 3.57 -0.83 -0.69 116.94 124.16 1i0h h PHE 188 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1i0h h PHE 188 Cb 0.23 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 38.70 1i0h h PHE 188 CO 0.00 0.26 0.02 -1.49 -2.23 0.00 0.00 178.31 174.87 1i0h h TRP 189 N 0.68 0.00 0.00 0.41 -0.00 -1.57 0.55 115.95 116.02 1i0h h TRP 189 Ca 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.39 1i0h h TRP 189 Cb 0.86 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.02 1i0h h TRP 189 CO -0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 178.44 177.53 1i0h h ASN 190 N 0.00 0.00 0.00 -3.49 2.35 -1.29 -3.35 115.58 109.79 1i0h h ASN 190 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1i0h h ASN 190 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 1i0h h ASN 190 CO -0.00 0.00 0.00 1.33 -1.65 0.00 0.00 177.43 177.11 1i0h n VAL 191 N -2.50 0.00 -2.13 2.81 0.24 -0.14 -4.66 118.33 111.95 1i0h n VAL 191 Ca 0.05 -0.35 -0.42 0.00 -2.04 0.00 0.00 64.34 61.58 1i0h n VAL 191 Cb 0.44 1.25 -0.03 0.00 -1.47 0.00 0.00 33.84 34.03 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 -0.10 3.07 -0.79 3.34 0.11 -0.00 -0.70 120.40 125.32 1i0h s VAL 192 Ca 0.00 0.83 -0.23 0.00 -2.93 0.00 0.00 61.98 59.65 1i0h s VAL 192 Cb 0.00 -3.53 0.06 0.00 -1.53 0.00 0.00 36.38 31.38 1i0h s VAL 192 CO 0.00 0.10 1.17 0.21 -3.33 0.00 0.00 175.10 173.25 1i0h s ASN 193 N 0.67 6.30 0.40 3.54 3.84 0.42 -4.56 114.94 125.55 1i0h s ASN 193 Ca 0.61 -1.08 0.28 0.00 0.21 0.00 0.00 52.86 52.88 1i0h s ASN 193 Cb -0.38 -2.48 0.99 0.00 -0.55 0.00 0.00 41.25 38.83 1i0h s ASN 193 CO 0.36 -1.51 1.81 -0.50 -2.79 0.00 0.00 177.10 174.47 1i0h h TRP 194 N 9.63 0.00 -0.07 0.43 4.06 -1.87 -1.63 115.95 126.49 1i0h h TRP 194 Ca -0.13 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.80 1i0h h TRP 194 Cb 1.05 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.20 1i0h h TRP 194 CO 1.10 0.00 -0.06 -0.44 -3.56 0.00 0.00 178.44 175.49 1i0h h ASP 195 N 0.00 0.17 -0.58 -3.49 3.32 -1.88 -0.97 116.42 113.00 1i0h h ASP 195 Ca 0.00 -0.46 -0.10 0.00 0.02 0.00 0.00 57.03 56.49 1i0h h ASP 195 Cb 0.59 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.07 1i0h h ASP 195 CO 0.00 0.60 -0.03 -0.08 -1.72 0.00 0.00 179.24 178.01 1i0h h GLU 196 N -0.25 1.05 -0.55 3.56 4.57 -1.84 -0.89 114.58 120.23 1i0h h GLU 196 Ca 0.01 -0.34 0.06 0.00 -1.18 0.00 0.00 59.36 57.91 1i0h h GLU 196 Cb 0.54 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.99 1i0h h GLU 196 CO 0.01 1.04 0.25 0.00 -1.18 0.00 0.00 179.01 179.13 1i0h h ALA 197 N 1.01 0.71 -0.89 2.92 0.00 -1.28 0.59 119.26 122.32 1i0h h ALA 197 Ca 0.16 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1i0h h ALA 197 Cb 0.58 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1i0h h ALA 197 CO 0.03 -0.12 0.48 0.00 0.00 0.00 0.00 179.25 179.65 1i0h h ALA 198 N 1.33 1.18 -0.29 0.00 0.00 -0.82 0.11 119.26 120.76 1i0h h ALA 198 Ca 0.26 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1i0h h ALA 198 Cb 0.22 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1i0h h ALA 198 CO -0.21 0.66 0.13 0.00 0.00 0.00 0.00 179.25 179.82 1i0h h ALA 199 N 1.29 0.38 -0.60 0.00 0.00 -0.52 -0.10 119.26 119.71 1i0h h ALA 199 Ca 0.31 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1i0h h ALA 199 Cb 0.03 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1i0h h ALA 199 CO -0.05 -0.03 0.18 0.00 0.00 0.00 0.00 179.25 179.35 1i0h h ARG 200 N 0.33 0.94 -0.99 0.00 3.08 -0.69 -1.77 114.38 115.28 1i0h h ARG 200 Ca 0.10 -0.21 0.01 0.00 0.07 0.00 0.00 59.98 59.95 1i0h h ARG 200 Cb 0.16 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.03 1i0h h ARG 200 CO -0.01 0.84 0.64 0.35 -1.07 0.00 0.00 179.97 180.72 1i0h h PHE 201 N 0.86 1.26 -0.37 3.04 3.57 -0.61 -1.21 116.94 123.48 1i0h h PHE 201 Ca 0.19 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.63 1i0h h PHE 201 Cb 0.30 -0.42 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 1i0h h PHE 201 CO 0.02 0.81 -0.13 0.00 -2.23 0.00 0.00 178.31 176.78 1i0h h ALA 202 N 1.35 1.10 0.07 2.41 0.00 -0.56 -3.01 119.26 120.63 1i0h h ALA 202 Ca 0.36 -0.30 -0.25 0.00 0.00 0.00 0.00 54.91 54.72 1i0h h ALA 202 Cb -0.13 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.51 1i0h h ALA 202 CO -0.08 0.56 -1.11 0.00 0.00 0.00 0.00 179.25 178.62 1i0h h ALA 203 N 1.28 0.21 0.00 0.00 0.00 -0.91 -3.47 119.26 116.37 1i0h h ALA 203 Ca 0.10 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1i0h h ALA 203 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1i0h h ALA 203 CO 0.04 0.88 0.00 1.63 0.00 0.00 0.00 179.25 181.79 1i0h n LYS 204 N -3.65 0.00 0.00 0.00 5.02 -0.50 -5.11 118.16 113.93 1i0h n LYS 204 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 1i0h n LYS 204 Cb 0.94 -2.31 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 1i0h n LYS 204 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51