#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y67 s TYR 3 N 0.00 2.70 0.15 0.00 2.02 -1.26 -5.06 117.35 115.89 1y67 s TYR 3 Ca 0.00 1.53 0.06 0.00 -0.37 0.00 0.00 57.07 58.29 1y67 s TYR 3 Cb 0.00 -3.36 -0.04 0.00 -0.40 0.00 0.00 41.96 38.16 1y67 s TYR 3 CO 0.00 -1.66 -0.13 0.95 -1.57 0.00 0.00 175.55 173.14 1y67 s THR 4 N -1.66 1.34 -0.10 -0.71 -4.23 -1.26 -4.93 115.64 104.09 1y67 s THR 4 Ca 0.70 -1.93 -0.30 0.00 -1.18 0.00 0.00 61.69 58.98 1y67 s THR 4 Cb -0.27 -1.74 -0.03 0.00 1.34 0.00 0.00 72.50 71.81 1y67 s THR 4 CO 0.31 -0.57 1.33 -0.22 -0.54 0.00 0.00 174.62 174.92 1y67 s LEU 5 N -2.87 4.25 0.44 4.79 2.96 -1.26 -5.01 118.68 121.97 1y67 s LEU 5 Ca 0.14 1.87 -0.22 0.00 -0.22 0.00 0.00 54.13 55.70 1y67 s LEU 5 Cb -0.01 -3.55 -0.09 0.00 0.50 0.00 0.00 46.19 43.04 1y67 s LEU 5 CO 0.03 -0.74 1.05 -2.16 -1.32 0.00 0.00 176.35 173.21 1y67 s PRO 6 N 3.09 4.00 0.46 0.98 0.04 -1.26 -5.03 135.00 137.29 1y67 s PRO 6 Ca 0.59 1.47 -0.21 0.00 0.04 0.00 0.00 61.00 62.89 1y67 s PRO 6 Cb -0.26 -2.36 -0.08 0.00 0.04 0.00 0.00 34.50 31.84 1y67 s PRO 6 CO 0.20 -0.28 1.05 1.14 0.04 0.00 0.00 177.00 179.16 1y67 s GLN 7 N -2.79 3.88 0.52 4.56 -2.07 -1.26 -5.03 119.66 117.47 1y67 s GLN 7 Ca 0.62 1.43 -0.20 0.00 -1.82 0.00 0.00 55.36 55.39 1y67 s GLN 7 Cb -0.20 -2.23 -0.06 0.00 -1.09 0.00 0.00 33.01 29.42 1y67 s GLN 7 CO 0.25 -0.37 1.14 -0.51 -1.32 0.00 0.00 175.29 174.48 1y67 s LEU 8 N -3.24 3.82 0.00 2.60 1.02 -1.26 -4.93 118.68 116.69 1y67 s LEU 8 Ca 0.65 2.22 0.13 0.00 0.02 0.00 0.00 54.13 57.14 1y67 s LEU 8 Cb -0.19 -4.48 0.77 0.00 0.02 0.00 0.00 46.19 42.31 1y67 s LEU 8 CO 0.23 -1.14 1.20 -2.65 0.02 0.00 0.00 176.35 174.01 1y67 n PRO 9 N -1.07 0.49 -3.77 1.29 -0.02 -1.26 -4.86 135.00 125.80 1y67 n PRO 9 Ca 0.10 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.52 1y67 n PRO 9 Cb 0.50 -1.41 -0.02 0.00 -0.02 0.00 0.00 33.50 32.55 1y67 n PRO 9 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1y67 s TYR 10 N -2.00 -0.22 0.82 6.00 -0.85 -1.26 -5.04 117.35 114.80 1y67 s TYR 10 Ca 0.19 -0.16 -0.11 0.00 -0.52 0.00 0.00 57.07 56.48 1y67 s TYR 10 Cb 0.09 0.67 0.08 0.00 0.38 0.00 0.00 41.96 43.18 1y67 s TYR 10 CO 0.15 -1.05 1.09 0.00 -1.52 0.00 0.00 175.55 174.22 1y67 s ALA 11 N -3.69 1.98 0.50 9.51 0.00 -1.26 -4.94 121.76 123.86 1y67 s ALA 11 Ca 0.10 0.15 0.24 0.00 0.00 0.00 0.00 51.96 52.45 1y67 s ALA 11 Cb -0.04 -3.25 1.46 0.00 0.00 0.00 0.00 23.12 21.29 1y67 s ALA 11 CO 0.03 -2.00 2.13 1.88 0.00 0.00 0.00 175.76 177.80 1y67 h TYR 12 N -1.30 0.00 -0.36 0.00 0.05 -1.97 -2.17 116.97 111.23 1y67 h TYR 12 Ca -0.46 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.32 1y67 h TYR 12 Cb 1.25 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.99 1y67 h TYR 12 CO 0.52 0.08 0.00 -0.40 -1.05 0.00 0.00 178.16 177.31 1y67 n ASP 13 N -3.98 2.84 0.25 3.88 5.75 -1.26 -3.99 116.55 120.04 1y67 n ASP 13 Ca -0.03 -1.91 0.12 0.00 -0.01 0.00 0.00 54.79 52.96 1y67 n ASP 13 Cb 0.17 -0.23 0.67 0.00 -1.03 0.00 0.00 41.12 40.69 1y67 n ASP 13 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1y67 h ALA 14 N 4.28 1.23 -0.54 2.12 0.00 -1.74 -2.93 119.26 121.68 1y67 h ALA 14 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1y67 h ALA 14 Cb 0.79 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1y67 h ALA 14 CO 0.00 0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.71 1y67 n LEU 15 N -3.59 3.68 -4.77 0.00 4.77 -1.26 -4.55 117.00 111.29 1y67 n LEU 15 Ca -0.01 -1.71 -0.36 0.00 -0.03 0.00 0.00 56.01 53.89 1y67 n LEU 15 Cb 0.28 -0.35 0.01 0.00 -2.33 0.00 0.00 43.42 41.03 1y67 n LEU 15 CO 0.31 0.85 0.83 -1.61 -1.33 0.00 0.00 177.39 176.43 1y67 s GLU 16 N -1.28 3.32 0.00 3.23 0.41 -1.11 -1.39 118.70 121.88 1y67 s GLU 16 Ca 0.43 1.76 0.12 0.00 -0.41 0.00 0.00 54.97 56.87 1y67 s GLU 16 Cb 0.24 -2.09 0.42 0.00 -1.78 0.00 0.00 34.13 30.92 1y67 s GLU 16 CO 0.32 -0.91 1.32 -0.35 -0.49 0.00 0.00 175.26 175.15 1y67 n PRO 17 N -1.18 1.67 -0.09 0.39 -0.04 -1.26 -4.85 135.00 129.63 1y67 n PRO 17 Ca 0.11 -1.04 -0.12 0.00 -0.04 0.00 0.00 63.50 62.42 1y67 n PRO 17 Cb 0.49 -1.28 -0.04 0.00 -0.04 0.00 0.00 33.50 32.64 1y67 n PRO 17 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1y67 h HIS 18 N 1.79 0.61 -3.38 0.54 3.86 -1.59 -3.40 115.15 113.58 1y67 h HIS 18 Ca 0.00 -0.14 -0.54 0.00 -1.16 0.00 0.00 60.37 58.53 1y67 h HIS 18 Cb 0.40 -0.15 -0.34 0.00 1.06 0.00 0.00 27.41 28.39 1y67 h HIS 18 CO 0.17 0.77 -0.82 0.42 0.86 0.00 0.00 177.93 179.33 1y67 s ILE 19 N -4.67 1.26 0.42 2.45 1.01 -0.50 -4.86 121.20 116.32 1y67 s ILE 19 Ca -0.13 -0.54 -0.24 0.00 0.00 0.00 0.00 60.65 59.73 1y67 s ILE 19 Cb 0.08 -1.15 -0.08 0.00 0.01 0.00 0.00 42.46 41.31 1y67 s ILE 19 CO 0.78 0.39 1.13 1.51 0.00 0.00 0.00 174.94 178.74 1y67 s ASP 20 N 0.74 6.50 0.28 3.58 -4.77 -1.26 -2.95 116.67 118.78 1y67 s ASP 20 Ca -0.13 2.23 -0.01 0.00 -3.30 0.00 0.00 52.55 51.33 1y67 s ASP 20 Cb -0.16 -2.60 0.44 0.00 -1.09 0.00 0.00 42.92 39.52 1y67 s ASP 20 CO 0.03 -0.68 1.90 0.00 0.70 0.00 0.00 175.17 177.12 1y67 h ALA 21 N 2.42 1.43 -0.15 2.11 0.00 -1.91 -1.64 119.26 121.52 1y67 h ALA 21 Ca -0.49 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1y67 h ALA 21 Cb 1.23 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1y67 h ALA 21 CO 0.62 0.44 0.10 -0.09 0.00 0.00 0.00 179.25 180.31 1y67 h ARG 22 N 1.14 0.20 0.06 0.00 2.43 -1.93 -1.33 114.38 114.96 1y67 h ARG 22 Ca 0.40 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.57 1y67 h ARG 22 Cb 0.13 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 1y67 h ARG 22 CO -0.15 0.16 -0.16 1.15 -1.51 0.00 0.00 179.97 179.47 1y67 h THR 23 N 0.19 0.62 -0.72 0.20 2.02 -1.85 -1.38 112.91 111.99 1y67 h THR 23 Ca 0.05 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.38 1y67 h THR 23 Cb 0.01 0.62 -0.10 0.00 -1.74 0.00 0.00 68.15 66.94 1y67 h THR 23 CO -0.01 0.00 0.22 0.24 0.37 0.00 0.00 175.52 176.34 1y67 h MET 24 N -0.30 0.33 -0.21 6.66 2.86 -1.17 0.34 114.93 123.44 1y67 h MET 24 Ca 0.03 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 1y67 h MET 24 Cb 0.33 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 1y67 h MET 24 CO -0.11 0.22 0.06 1.49 1.06 0.00 0.00 176.91 179.63 1y67 h GLU 25 N 0.34 0.33 -0.20 1.72 4.81 -0.91 -1.73 114.58 118.94 1y67 h GLU 25 Ca 0.40 -0.07 -0.16 0.00 -0.13 0.00 0.00 59.36 59.39 1y67 h GLU 25 Cb 0.63 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1y67 h GLU 25 CO -0.44 0.42 -0.51 0.82 -0.73 0.00 0.00 179.01 178.57 1y67 h ILE 26 N 0.17 1.31 -0.63 2.32 2.04 -0.74 0.97 117.51 122.94 1y67 h ILE 26 Ca 0.07 -1.73 0.06 0.00 1.00 0.00 0.00 64.86 64.25 1y67 h ILE 26 Cb 0.24 1.87 -0.05 0.00 -0.74 0.00 0.00 36.82 38.13 1y67 h ILE 26 CO -0.00 0.54 0.34 -0.74 0.00 0.00 0.00 178.15 178.29 1y67 h HIS 27 N 0.41 0.62 0.14 1.37 2.76 -0.34 -0.01 115.15 120.10 1y67 h HIS 27 Ca -0.01 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 1y67 h HIS 27 Cb 1.12 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 29.90 1y67 h HIS 27 CO 0.09 0.30 -0.07 1.25 -1.30 0.00 0.00 177.93 178.20 1y67 h HIS 28 N 0.63 -0.17 0.00 5.26 -0.00 -1.25 -0.88 115.15 118.75 1y67 h HIS 28 Ca 0.28 -0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.60 1y67 h HIS 28 Cb 0.18 0.06 -0.01 0.00 -0.00 0.00 0.00 27.41 27.64 1y67 h HIS 28 CO -0.09 0.19 -0.30 1.79 -0.00 0.00 0.00 177.93 179.53 1y67 h THR 29 N -0.97 0.35 0.00 6.26 1.35 -0.78 -2.91 112.91 116.22 1y67 h THR 29 Ca -0.02 -1.50 0.00 0.00 -0.55 0.00 0.00 66.41 64.34 1y67 h THR 29 Cb 0.44 2.13 0.00 0.00 -1.73 0.00 0.00 68.15 69.00 1y67 h THR 29 CO 0.03 0.20 -0.36 0.29 -0.25 0.00 0.00 175.52 175.43 1y67 n LYS 30 N -3.12 0.19 0.36 4.72 4.76 -0.06 -4.46 118.16 120.56 1y67 n LYS 30 Ca 0.03 0.08 -0.17 0.00 -2.87 0.00 0.00 58.31 55.37 1y67 n LYS 30 Cb 0.62 -0.77 -0.08 0.00 -1.84 0.00 0.00 35.03 32.95 1y67 n LYS 30 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1y67 h HIS 31 N -0.36 -0.84 -0.57 2.13 3.86 -1.42 -1.52 115.15 116.43 1y67 h HIS 31 Ca 0.00 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.18 1y67 h HIS 31 Cb 0.36 0.28 -0.03 0.00 1.06 0.00 0.00 27.41 29.08 1y67 h HIS 31 CO -0.16 -0.49 0.32 1.25 0.86 0.00 0.00 177.93 179.71 1y67 h HIS 32 N -1.06 0.77 -0.60 2.45 -0.00 -1.20 -2.53 115.15 112.98 1y67 h HIS 32 Ca -0.09 -0.01 0.10 0.00 -0.00 0.00 0.00 60.37 60.36 1y67 h HIS 32 Cb 0.73 -0.25 -0.07 0.00 -0.00 0.00 0.00 27.41 27.82 1y67 h HIS 32 CO -0.01 0.55 0.21 0.37 -0.00 0.00 0.00 177.93 179.06 1y67 h GLN 33 N 0.76 0.37 -0.52 5.26 5.75 -1.52 -1.75 115.11 123.48 1y67 h GLN 33 Ca 0.20 -0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.73 1y67 h GLN 33 Cb 0.03 -0.08 -0.05 0.00 1.07 0.00 0.00 27.48 28.45 1y67 h GLN 33 CO -0.03 0.25 0.24 1.15 -2.65 0.00 0.00 178.83 177.78 1y67 h THR 34 N 0.38 0.92 -0.64 2.39 2.02 -0.87 0.62 112.91 117.74 1y67 h THR 34 Ca 0.31 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 67.32 1y67 h THR 34 Cb 0.39 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 67.18 1y67 h THR 34 CO -0.32 0.09 0.38 1.88 0.37 0.00 0.00 175.52 177.92 1y67 h TYR 35 N 0.47 0.85 0.01 3.16 0.05 -1.01 0.10 116.97 120.60 1y67 h TYR 35 Ca 0.23 -0.01 0.01 0.00 0.05 0.00 0.00 58.73 59.02 1y67 h TYR 35 Cb 0.18 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 37.63 1y67 h TYR 35 CO -0.12 0.58 -0.05 0.28 -1.05 0.00 0.00 178.16 177.80 1y67 h VAL 36 N 0.86 0.87 -0.44 -2.88 2.07 -0.92 -0.59 116.25 115.22 1y67 h VAL 36 Ca 0.23 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.76 1y67 h VAL 36 Cb -0.01 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 1y67 h VAL 36 CO -0.04 0.00 0.28 0.44 0.02 0.00 0.00 177.57 178.26 1y67 h ASP 37 N -0.10 0.46 0.40 0.57 3.32 -0.62 -1.81 116.42 118.64 1y67 h ASP 37 Ca 0.02 -0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.93 1y67 h ASP 37 Cb 0.12 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1y67 h ASP 37 CO -0.05 0.33 -0.59 0.78 -1.72 0.00 0.00 179.24 177.99 1y67 h ASN 38 N 0.56 0.21 -0.35 6.45 2.35 -0.70 -2.66 115.58 121.45 1y67 h ASN 38 Ca 0.17 -0.12 -0.07 0.00 -0.55 0.00 0.00 56.30 55.72 1y67 h ASN 38 Cb -0.03 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 1y67 h ASN 38 CO -0.06 0.76 -0.07 0.00 -1.65 0.00 0.00 177.43 176.41 1y67 h ALA 39 N 1.25 0.47 -1.00 -0.83 0.00 -0.92 -2.55 119.26 115.67 1y67 h ALA 39 Ca -0.00 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.65 1y67 h ALA 39 Cb 1.08 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 1y67 h ALA 39 CO 0.09 0.31 0.65 -0.91 0.00 0.00 0.00 179.25 179.39 1y67 h ASN 40 N 0.45 1.09 -0.74 0.00 2.35 -1.26 -1.52 115.58 115.94 1y67 h ASN 40 Ca 0.09 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.81 1y67 h ASN 40 Cb 0.56 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.65 1y67 h ASN 40 CO 0.03 0.74 0.37 0.11 -1.65 0.00 0.00 177.43 177.04 1y67 h LYS 41 N 1.26 1.06 0.00 0.81 1.57 -1.41 -2.00 116.57 117.86 1y67 h LYS 41 Ca 0.40 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.97 1y67 h LYS 41 Cb 0.01 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 1y67 h LYS 41 CO -0.13 0.82 -0.30 0.00 -0.57 0.00 0.00 179.45 179.27 1y67 h ALA 42 N 1.19 1.19 0.01 3.86 0.00 -0.98 -3.29 119.26 121.23 1y67 h ALA 42 Ca 0.26 -0.27 -0.31 0.00 0.00 0.00 0.00 54.91 54.59 1y67 h ALA 42 Cb 0.09 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1y67 h ALA 42 CO -0.04 0.37 -1.82 1.28 0.00 0.00 0.00 179.25 179.05 1y67 n LEU 43 N -3.72 0.94 -4.53 0.00 4.77 -0.63 -4.68 117.00 109.15 1y67 n LEU 43 Ca -0.01 0.35 -0.47 0.00 -0.03 0.00 0.00 56.01 55.85 1y67 n LEU 43 Cb 0.40 0.09 -0.05 0.00 -2.33 0.00 0.00 43.42 41.53 1y67 n LEU 43 CO 0.35 0.44 1.81 1.21 -1.33 0.00 0.00 177.39 179.87 1y67 n GLU 44 N -3.05 1.56 0.00 3.23 2.13 -0.78 -0.25 120.64 123.49 1y67 n GLU 44 Ca -0.20 0.44 0.00 0.00 0.66 0.00 0.00 57.16 58.06 1y67 n GLU 44 Cb 1.06 -2.84 0.00 0.00 0.27 0.00 0.00 31.44 29.93 1y67 n GLU 44 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1y67 n GLY 45 N 6.05 3.05 3.82 8.31 0.00 -1.26 -5.00 105.19 120.15 1y67 n GLY 45 Ca 0.35 -1.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 1y67 n GLY 45 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1y67 s THR 46 N -0.39 3.98 -1.96 2.61 -4.23 0.66 -4.95 115.64 111.36 1y67 s THR 46 Ca 0.00 0.72 0.06 0.00 -1.18 0.00 0.00 61.69 61.29 1y67 s THR 46 Cb 0.00 -3.40 0.18 0.00 1.34 0.00 0.00 72.50 70.62 1y67 s THR 46 CO 0.00 -0.76 1.14 -1.84 -0.54 0.00 0.00 174.62 172.61 1y67 n GLU 47 N -2.81 1.48 -0.13 3.99 0.28 -1.26 -3.90 120.64 118.29 1y67 n GLU 47 Ca 0.08 -0.72 0.08 0.00 -0.16 0.00 0.00 57.16 56.44 1y67 n GLU 47 Cb 0.53 -1.18 0.15 0.00 1.43 0.00 0.00 31.44 32.38 1y67 n GLU 47 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1y67 n PHE 48 N 0.09 0.35 0.42 -1.84 3.72 -1.26 -4.58 117.46 114.36 1y67 n PHE 48 Ca 0.07 -0.25 0.07 0.00 -0.05 0.00 0.00 57.45 57.29 1y67 n PHE 48 Cb 0.18 -0.01 0.33 0.00 -0.94 0.00 0.00 39.48 39.04 1y67 n PHE 48 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1y67 n ALA 49 N 0.98 1.58 0.61 4.37 0.00 -1.25 -2.99 120.51 123.82 1y67 n ALA 49 Ca 0.14 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.67 1y67 n ALA 49 Cb 0.47 -1.25 -0.05 0.00 0.00 0.00 0.00 19.45 18.62 1y67 n ALA 49 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1y67 n ASP 50 N -1.67 0.61 -4.79 0.00 5.68 -1.26 -4.59 116.55 110.52 1y67 n ASP 50 Ca 0.03 -0.42 -0.36 0.00 -0.50 0.00 0.00 54.79 53.54 1y67 n ASP 50 Cb 0.16 1.06 -0.06 0.00 -1.14 0.00 0.00 41.12 41.14 1y67 n ASP 50 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1y67 s LEU 51 N -3.71 4.16 0.52 -2.12 1.43 -1.16 -5.03 118.68 112.78 1y67 s LEU 51 Ca 0.03 1.84 -0.22 0.00 -1.03 0.00 0.00 54.13 54.75 1y67 s LEU 51 Cb 0.15 -4.22 -0.06 0.00 0.03 0.00 0.00 46.19 42.09 1y67 s LEU 51 CO 0.84 -0.27 1.33 -2.65 0.23 0.00 0.00 176.35 175.83 1y67 n PRO 52 N 0.02 1.73 -0.15 1.29 -0.02 -1.26 -4.80 135.00 131.82 1y67 n PRO 52 Ca 0.04 0.63 0.02 0.00 -2.02 0.00 0.00 63.50 62.18 1y67 n PRO 52 Cb 0.51 -2.53 0.31 0.00 -0.02 0.00 0.00 33.50 31.77 1y67 n PRO 52 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1y67 h VAL 53 N 1.55 1.15 0.00 -1.45 3.04 -1.96 -0.85 116.25 117.73 1y67 h VAL 53 Ca -0.50 -0.29 -0.03 0.00 -1.01 0.00 0.00 66.70 64.86 1y67 h VAL 53 Cb 1.30 0.23 -0.00 0.00 -2.01 0.00 0.00 31.29 30.80 1y67 h VAL 53 CO 0.57 0.15 -0.16 -0.33 -1.01 0.00 0.00 177.57 176.80 1y67 h GLU 54 N 0.85 0.00 0.22 4.17 3.07 -1.93 -2.08 114.58 118.88 1y67 h GLU 54 Ca 0.24 0.00 -0.34 0.00 -0.50 0.00 0.00 59.36 58.76 1y67 h GLU 54 Cb -0.06 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 27.87 1y67 h GLU 54 CO -0.06 0.16 -1.61 1.96 -1.40 0.00 0.00 179.01 178.06 1y67 h GLN 55 N 0.00 0.47 -0.31 2.33 4.20 -1.55 -3.33 115.11 116.92 1y67 h GLN 55 Ca -0.00 -0.81 0.04 0.00 0.06 0.00 0.00 58.65 57.95 1y67 h GLN 55 Cb 0.33 0.30 -0.04 0.00 0.30 0.00 0.00 27.48 28.37 1y67 h GLN 55 CO 0.02 1.38 0.05 1.25 -0.67 0.00 0.00 178.83 180.87 1y67 h LEU 56 N 0.13 -0.00 -0.56 1.46 5.85 -0.94 -2.41 115.31 118.84 1y67 h LEU 56 Ca -0.30 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1y67 h LEU 56 Cb 2.14 0.07 0.00 0.00 0.37 0.00 0.00 40.66 43.24 1y67 h LEU 56 CO 0.23 0.03 0.00 2.30 -0.34 0.00 0.00 178.44 180.67 1y67 n ILE 57 N -5.10 1.06 1.55 4.05 -5.35 -0.82 -0.19 119.36 114.57 1y67 n ILE 57 Ca 0.00 0.36 0.14 0.00 -0.27 0.00 0.00 62.75 62.99 1y67 n ILE 57 Cb 0.14 -1.27 0.58 0.00 -1.74 0.00 0.00 39.64 37.35 1y67 n ILE 57 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1y67 n GLN 58 N -1.95 1.45 -0.61 6.28 6.02 -0.91 -3.87 117.38 123.78 1y67 n GLN 58 Ca 0.02 -0.74 0.06 0.00 -0.01 0.00 0.00 57.00 56.32 1y67 n GLN 58 Cb 0.15 -1.48 0.12 0.00 1.02 0.00 0.00 30.24 30.04 1y67 n GLN 58 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1y67 n GLN 59 N -0.13 0.91 0.27 -1.09 6.02 0.73 -4.82 117.38 119.27 1y67 n GLN 59 Ca 0.19 -2.45 0.15 0.00 -0.01 0.00 0.00 57.00 54.88 1y67 n GLN 59 Cb 0.31 -1.07 0.73 0.00 1.02 0.00 0.00 30.24 31.23 1y67 n GLN 59 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1y67 h LEU 60 N 0.55 0.00 -0.29 1.08 3.38 -1.72 -0.42 115.31 117.88 1y67 h LEU 60 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1y67 h LEU 60 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1y67 h LEU 60 CO 0.02 0.09 0.00 -0.90 0.09 0.00 0.00 178.44 177.74 1y67 n ASP 61 N -3.36 0.35 -0.01 -0.43 5.75 -1.26 -3.41 116.55 114.18 1y67 n ASP 61 Ca -0.01 0.57 0.10 0.00 -0.01 0.00 0.00 54.79 55.44 1y67 n ASP 61 Cb 0.27 -0.65 -0.14 0.00 -1.03 0.00 0.00 41.12 39.57 1y67 n ASP 61 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1y67 n ARG 62 N -1.87 0.63 -1.42 0.11 1.74 -0.17 -5.01 116.66 110.67 1y67 n ARG 62 Ca 0.03 -0.14 -0.31 0.00 -0.77 0.00 0.00 57.85 56.67 1y67 n ARG 62 Cb 0.23 -1.44 0.07 0.00 -1.02 0.00 0.00 32.46 30.30 1y67 n ARG 62 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1y67 s VAL 63 N -3.21 3.56 0.22 1.55 -7.23 -1.19 -4.95 120.40 109.14 1y67 s VAL 63 Ca -0.04 0.53 -0.31 0.00 -1.81 0.00 0.00 61.98 60.35 1y67 s VAL 63 Cb 0.13 -3.10 -0.15 0.00 0.56 0.00 0.00 36.38 33.82 1y67 s VAL 63 CO 0.80 -0.64 1.14 -2.65 -0.31 0.00 0.00 175.10 173.44 1y67 n PRO 64 N -3.27 1.33 -0.19 4.82 -0.02 -1.26 -4.81 135.00 131.60 1y67 n PRO 64 Ca 0.09 0.47 0.02 0.00 -2.02 0.00 0.00 63.50 62.05 1y67 n PRO 64 Cb 0.53 -1.95 0.28 0.00 -0.02 0.00 0.00 33.50 32.34 1y67 n PRO 64 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1y67 h ALA 65 N 3.05 1.52 0.00 3.55 0.00 -1.95 -0.03 119.26 125.41 1y67 h ALA 65 Ca -0.42 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1y67 h ALA 65 Cb 1.33 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1y67 h ALA 65 CO 0.68 0.43 0.00 0.38 0.00 0.00 0.00 179.25 180.73 1y67 h ASP 66 N 0.94 0.00 -0.01 0.00 2.03 -2.02 -3.01 116.42 114.35 1y67 h ASP 66 Ca 0.27 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.57 1y67 h ASP 66 Cb -0.05 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.45 1y67 h ASP 66 CO -0.07 0.00 -0.72 0.29 -1.03 0.00 0.00 179.24 177.71 1y67 n LYS 67 N -2.46 0.92 -0.20 4.15 4.76 -0.05 -4.58 118.16 120.69 1y67 n LYS 67 Ca 0.02 -0.37 -0.05 0.00 -2.87 0.00 0.00 58.31 55.03 1y67 n LYS 67 Cb 0.26 -1.41 0.04 0.00 -1.84 0.00 0.00 35.03 32.08 1y67 n LYS 67 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1y67 h LYS 68 N 0.89 0.70 0.17 1.97 3.64 -1.33 -0.77 116.57 121.84 1y67 h LYS 68 Ca 0.00 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1y67 h LYS 68 Cb 0.55 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1y67 h LYS 68 CO 0.00 0.46 -0.08 0.78 -2.27 0.00 0.00 179.45 178.34 1y67 h GLY 69 N 0.72 -0.24 0.99 5.01 0.00 -1.81 -0.51 103.07 107.23 1y67 h GLY 69 Ca 0.22 0.09 0.01 0.00 0.00 0.00 0.00 47.33 47.66 1y67 h GLY 69 CO -0.08 -0.09 0.64 0.00 0.00 0.00 0.00 176.54 177.02 1y67 h ALA 70 N 0.50 1.24 -0.13 3.60 0.00 -1.79 -2.04 119.26 120.63 1y67 h ALA 70 Ca -0.02 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.67 1y67 h ALA 70 Cb 0.25 -0.39 0.01 0.00 0.00 0.00 0.00 17.79 17.66 1y67 h ALA 70 CO 0.04 0.61 -0.52 -0.07 0.00 0.00 0.00 179.25 179.31 1y67 h LEU 71 N 1.30 0.69 -0.38 0.00 3.38 -1.08 -0.23 115.31 119.00 1y67 h LEU 71 Ca 0.36 -0.62 0.07 0.00 0.09 0.00 0.00 57.88 57.79 1y67 h LEU 71 Cb -0.13 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.35 1y67 h LEU 71 CO -0.08 1.19 -0.07 -0.09 0.09 0.00 0.00 178.44 179.48 1y67 h ARG 72 N 0.23 0.02 -0.07 1.13 2.43 -0.98 0.11 114.38 117.26 1y67 h ARG 72 Ca -0.03 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 1y67 h ARG 72 Cb 1.15 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 1y67 h ARG 72 CO 0.11 0.02 -0.04 -0.91 -1.51 0.00 0.00 179.97 177.64 1y67 h ASN 73 N 0.03 0.15 0.09 -3.80 2.35 -1.36 -2.65 115.58 110.39 1y67 h ASN 73 Ca 0.18 -0.42 -0.33 0.00 -0.55 0.00 0.00 56.30 55.18 1y67 h ASN 73 Cb 0.27 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 1y67 h ASN 73 CO -0.37 0.54 -1.77 0.78 -1.65 0.00 0.00 177.43 174.97 1y67 h ASN 74 N -0.24 0.31 -0.41 5.81 2.35 -0.94 -1.88 115.58 120.58 1y67 h ASN 74 Ca 0.02 -0.82 -0.09 0.00 -0.55 0.00 0.00 56.30 54.85 1y67 h ASN 74 Cb 0.49 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.74 1y67 h ASN 74 CO 0.01 1.75 -0.05 0.00 -1.65 0.00 0.00 177.43 177.49 1y67 h ALA 75 N -0.09 1.00 -0.26 -0.83 0.00 -0.95 -0.44 119.26 117.69 1y67 h ALA 75 Ca -0.40 -0.30 0.05 0.00 0.00 0.00 0.00 54.91 54.26 1y67 h ALA 75 Cb 1.82 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 19.38 1y67 h ALA 75 CO 0.00 0.61 -0.04 0.78 0.00 0.00 0.00 179.25 180.60 1y67 h GLY 76 N 0.98 0.21 1.00 0.00 0.00 -1.26 0.45 103.07 104.45 1y67 h GLY 76 Ca 0.14 0.07 -0.02 0.00 0.00 0.00 0.00 47.33 47.51 1y67 h GLY 76 CO 0.03 -0.09 0.31 -1.33 0.00 0.00 0.00 176.54 175.46 1y67 h GLY 77 N 0.03 0.97 0.99 4.60 0.00 -1.00 0.85 103.07 109.51 1y67 h GLY 77 Ca 0.13 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 1y67 h GLY 77 CO -0.25 0.46 -0.04 0.84 0.00 0.00 0.00 176.54 177.55 1y67 h HIS 78 N 0.87 -0.09 -0.43 5.60 6.17 -0.89 -1.18 115.15 125.20 1y67 h HIS 78 Ca 0.22 -0.00 0.02 0.00 0.71 0.00 0.00 60.37 61.31 1y67 h HIS 78 Cb 0.11 0.03 -0.03 0.00 2.52 0.00 0.00 27.41 30.04 1y67 h HIS 78 CO 0.00 -0.05 0.25 0.00 0.71 0.00 0.00 177.93 178.84 1y67 h ALA 79 N 0.82 0.54 0.08 5.26 0.00 -0.62 -1.53 119.26 123.81 1y67 h ALA 79 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1y67 h ALA 79 Cb 0.09 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1y67 h ALA 79 CO 0.02 -0.07 -0.04 -0.91 0.00 0.00 0.00 179.25 178.24 1y67 h ASN 80 N 0.51 -0.10 -0.36 0.00 2.35 -0.73 -2.64 115.58 114.62 1y67 h ASN 80 Ca 0.17 -0.11 -0.12 0.00 -0.55 0.00 0.00 56.30 55.70 1y67 h ASN 80 Cb 0.01 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 1y67 h ASN 80 CO -0.08 0.05 -0.21 0.45 -1.65 0.00 0.00 177.43 175.98 1y67 h HIS 81 N -0.23 0.96 -0.56 1.19 3.86 -1.19 -0.49 115.15 118.70 1y67 h HIS 81 Ca -0.01 -0.22 0.03 0.00 -1.16 0.00 0.00 60.37 59.00 1y67 h HIS 81 Cb 0.20 -0.23 -0.04 0.00 1.06 0.00 0.00 27.41 28.40 1y67 h HIS 81 CO -0.03 0.98 0.33 0.77 0.86 0.00 0.00 177.93 180.84 1y67 h SER 82 N 0.74 0.54 -0.20 2.45 0.02 -1.26 -1.62 113.55 114.22 1y67 h SER 82 Ca 0.10 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.03 1y67 h SER 82 Cb 0.74 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.17 1y67 h SER 82 CO 0.06 0.38 0.02 -0.03 -1.14 0.00 0.00 176.83 176.12 1y67 h MET 83 N 0.66 0.34 -0.64 3.45 -1.53 -1.31 -3.25 114.93 112.65 1y67 h MET 83 Ca 0.22 -0.10 0.13 0.00 -3.44 0.00 0.00 59.70 56.52 1y67 h MET 83 Cb 0.03 -0.04 -0.12 0.00 -0.55 0.00 0.00 31.60 30.92 1y67 h MET 83 CO -0.10 0.51 -0.16 0.35 0.14 0.00 0.00 176.91 177.65 1y67 h PHE 84 N 0.12 -0.34 -0.71 1.39 3.57 -0.51 -1.58 116.94 118.89 1y67 h PHE 84 Ca 0.06 0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 1y67 h PHE 84 Cb 0.35 0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.30 1y67 h PHE 84 CO 0.03 -0.28 0.42 -1.49 -2.23 0.00 0.00 178.31 174.76 1y67 h TRP 85 N 0.00 0.93 0.00 0.41 -0.00 -1.35 -2.98 115.95 112.97 1y67 h TRP 85 Ca 0.31 -0.00 -0.10 0.00 -0.00 0.00 0.00 58.89 59.10 1y67 h TRP 85 Cb 0.47 -0.31 -0.01 0.00 -0.00 0.00 0.00 29.16 29.31 1y67 h TRP 85 CO -0.52 0.63 -0.49 1.96 -0.00 0.00 0.00 178.44 180.02 1y67 h GLN 86 N 0.97 0.00 -0.08 0.49 4.20 -1.34 -3.21 115.11 116.14 1y67 h GLN 86 Ca 0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.96 1y67 h GLN 86 Cb -0.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.75 1y67 h GLN 86 CO -0.05 0.49 0.00 0.44 -0.67 0.00 0.00 178.83 179.04 1y67 n ILE 87 N -3.25 0.09 -4.00 2.54 -6.64 -0.88 -4.83 119.36 102.39 1y67 n ILE 87 Ca 0.02 -0.28 -0.22 0.00 -1.77 0.00 0.00 62.75 60.50 1y67 n ILE 87 Cb 0.71 0.40 -0.05 0.00 -1.44 0.00 0.00 39.64 39.27 1y67 n ILE 87 CO 0.00 0.00 0.00 -0.04 -1.77 0.00 0.00 176.55 174.74 1y67 s MET 88 N -1.91 2.67 0.01 6.28 -1.94 -1.21 -0.01 119.30 123.19 1y67 s MET 88 Ca 0.36 -1.28 -0.29 0.00 -1.71 0.00 0.00 55.69 52.77 1y67 s MET 88 Cb 0.19 -2.41 0.10 0.00 2.01 0.00 0.00 34.83 34.72 1y67 s MET 88 CO 0.30 0.21 0.95 0.20 -0.01 0.00 0.00 175.02 176.67 1y67 s GLY 89 N -3.89 -0.40 0.26 -0.03 0.00 0.46 -4.60 107.32 99.12 1y67 s GLY 89 Ca 0.37 0.89 -0.14 0.00 0.00 0.00 0.00 44.72 45.84 1y67 s GLY 89 CO 0.25 0.28 0.66 -0.86 0.00 0.00 0.00 173.10 173.43 1y67 s GLN 90 N -3.06 3.99 -1.54 2.90 -2.07 -1.26 -4.38 119.66 114.25 1y67 s GLN 90 Ca 0.07 0.58 -0.12 0.00 -1.82 0.00 0.00 55.36 54.07 1y67 s GLN 90 Cb -0.01 -2.63 0.09 0.00 -1.09 0.00 0.00 33.01 29.37 1y67 s GLN 90 CO -0.06 0.28 0.83 0.41 -1.32 0.00 0.00 175.29 175.43 1y67 n GLY 91 N 0.03 -0.42 3.79 2.60 0.00 -1.26 -4.93 105.19 105.00 1y67 n GLY 91 Ca 0.01 0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1y67 n GLY 91 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1y67 s GLN 92 N -6.62 4.32 0.00 1.61 -1.52 -1.26 -4.97 119.66 111.21 1y67 s GLN 92 Ca 0.53 1.32 0.00 0.00 -1.95 0.00 0.00 55.36 55.25 1y67 s GLN 92 Cb -0.27 -2.50 0.00 0.00 -0.22 0.00 0.00 33.01 30.02 1y67 s GLN 92 CO 0.86 0.03 0.00 0.41 -0.25 0.00 0.00 175.29 176.34 1y67 n GLY 93 N 0.09 0.47 3.11 3.09 0.00 -1.26 -4.76 105.19 105.93 1y67 n GLY 93 Ca 0.05 -2.31 -0.12 0.00 0.00 0.00 0.00 46.02 43.63 1y67 n GLY 93 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1y67 s GLN 94 N -0.70 0.26 -0.03 1.61 0.74 0.31 -4.96 119.66 116.89 1y67 s GLN 94 Ca 0.00 0.45 -0.00 0.00 0.05 0.00 0.00 55.36 55.86 1y67 s GLN 94 Cb 0.00 0.02 0.00 0.00 1.10 0.00 0.00 33.01 34.13 1y67 s GLN 94 CO 0.00 -0.10 0.02 0.27 -0.55 0.00 0.00 175.29 174.93 1y67 n ASN 95 N 3.57 -0.17 0.00 6.67 2.04 -1.26 -1.80 115.26 124.31 1y67 n ASN 95 Ca -0.19 -0.04 0.00 0.00 -0.44 0.00 0.00 54.58 53.92 1y67 n ASN 95 Cb 0.56 -0.06 0.00 0.00 -2.53 0.00 0.00 39.78 37.75 1y67 n ASN 95 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1y67 n GLY 96 N -0.57 0.89 3.00 4.83 0.00 -1.26 -5.02 105.19 107.05 1y67 n GLY 96 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 1y67 n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y67 s ALA 97 N -2.32 -0.22 -0.29 4.61 0.00 -0.74 -5.13 121.76 117.67 1y67 s ALA 97 Ca 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 51.96 52.04 1y67 s ALA 97 Cb 0.00 -0.09 0.03 0.00 0.00 0.00 0.00 23.12 23.06 1y67 s ALA 97 CO 0.00 -0.08 0.03 1.21 0.00 0.00 0.00 175.76 176.92 1y67 s ASN 98 N -0.33 4.92 0.03 0.00 2.47 -1.26 -0.53 114.94 120.24 1y67 s ASN 98 Ca -0.04 -0.98 -0.22 0.00 0.42 0.00 0.00 52.86 52.04 1y67 s ASN 98 Cb -0.03 -1.79 0.05 0.00 -1.45 0.00 0.00 41.25 38.04 1y67 s ASN 98 CO 0.00 -0.22 0.51 0.00 -3.72 0.00 0.00 177.10 173.67 1y67 s GLN 99 N 1.38 1.00 0.86 0.43 -2.07 -1.26 -5.00 119.66 115.00 1y67 s GLN 99 Ca -0.01 -0.18 -0.12 0.00 -1.82 0.00 0.00 55.36 53.23 1y67 s GLN 99 Cb -0.18 0.46 0.11 0.00 -1.09 0.00 0.00 33.01 32.30 1y67 s GLN 99 CO 0.00 -0.35 1.10 -1.25 -1.32 0.00 0.00 175.29 173.48 1y67 s PRO 100 N -2.21 1.53 0.33 9.60 0.04 -1.26 -4.92 135.00 138.12 1y67 s PRO 100 Ca -0.07 0.60 0.08 0.00 0.04 0.00 0.00 61.00 61.65 1y67 s PRO 100 Cb -0.01 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.64 1y67 s PRO 100 CO 0.00 -1.99 0.29 -1.13 0.04 0.00 0.00 177.00 174.21 1y67 n SER 101 N -3.68 -0.74 0.00 6.66 3.41 -1.26 -4.71 113.62 113.30 1y67 n SER 101 Ca 0.07 -3.20 0.00 0.00 -0.26 0.00 0.00 58.87 55.48 1y67 n SER 101 Cb 0.57 1.71 0.00 0.00 -0.26 0.00 0.00 64.21 66.23 1y67 n SER 101 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y67 n GLY 102 N -0.64 2.93 0.30 5.00 0.00 -1.26 -3.09 105.19 108.44 1y67 n GLY 102 Ca 0.08 -0.35 -0.00 0.00 0.00 0.00 0.00 46.02 45.74 1y67 n GLY 102 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1y67 h GLU 103 N 0.00 0.74 -0.35 1.61 4.11 -1.99 -1.47 114.58 117.22 1y67 h GLU 103 Ca 0.00 -0.11 -0.10 0.00 0.07 0.00 0.00 59.36 59.22 1y67 h GLU 103 Cb 0.00 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1y67 h GLU 103 CO 0.00 0.62 -0.18 1.25 0.07 0.00 0.00 179.01 180.77 1y67 h LEU 104 N 0.73 0.77 -0.57 3.06 5.85 -1.93 -1.31 115.31 121.91 1y67 h LEU 104 Ca 0.17 -0.41 -0.00 0.00 0.84 0.00 0.00 57.88 58.48 1y67 h LEU 104 Cb 0.17 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1y67 h LEU 104 CO -0.01 1.01 0.34 0.25 -0.34 0.00 0.00 178.44 179.69 1y67 h LEU 105 N 0.53 0.68 -0.96 2.25 5.85 -1.38 0.41 115.31 122.71 1y67 h LEU 105 Ca 0.08 -0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.76 1y67 h LEU 105 Cb 0.73 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.53 1y67 h LEU 105 CO 0.05 0.54 0.63 0.44 -0.34 0.00 0.00 178.44 179.76 1y67 h ASP 106 N 0.77 1.07 -0.41 1.25 3.32 -1.16 0.30 116.42 121.56 1y67 h ASP 106 Ca 0.20 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.15 1y67 h ASP 106 Cb -0.02 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 1y67 h ASP 106 CO -0.04 0.76 -0.10 0.00 -1.72 0.00 0.00 179.24 178.14 1y67 h ALA 107 N 1.37 0.57 -0.28 3.45 0.00 -0.85 -1.12 119.26 122.41 1y67 h ALA 107 Ca 0.37 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1y67 h ALA 107 Cb -0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1y67 h ALA 107 CO -0.10 0.44 0.15 0.82 0.00 0.00 0.00 179.25 180.56 1y67 h ILE 108 N 0.61 1.13 -0.76 0.00 2.04 -0.57 0.02 117.51 119.99 1y67 h ILE 108 Ca 0.10 -0.34 0.04 0.00 1.00 0.00 0.00 64.86 65.67 1y67 h ILE 108 Cb 0.62 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 37.50 1y67 h ILE 108 CO 0.04 0.13 0.47 0.78 0.00 0.00 0.00 178.15 179.57 1y67 h ASN 109 N 0.33 0.75 -0.25 1.72 2.35 -0.88 0.16 115.58 119.77 1y67 h ASN 109 Ca 0.10 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 1y67 h ASN 109 Cb 0.07 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1y67 h ASN 109 CO -0.02 0.51 0.08 -1.28 -1.65 0.00 0.00 177.43 175.07 1y67 h SER 110 N 0.89 0.35 0.65 5.81 0.87 -0.92 -0.28 113.55 120.93 1y67 h SER 110 Ca 0.32 -0.19 -0.25 0.00 -1.23 0.00 0.00 61.79 60.43 1y67 h SER 110 Cb 0.08 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 61.94 1y67 h SER 110 CO -0.14 0.45 -1.13 0.00 -0.53 0.00 0.00 176.83 175.48 1y67 h ALA 111 N 0.91 0.21 0.00 6.23 0.00 -0.79 -3.39 119.26 122.43 1y67 h ALA 111 Ca 0.08 -0.85 0.00 0.00 0.00 0.00 0.00 54.91 54.14 1y67 h ALA 111 Cb 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1y67 h ALA 111 CO -0.00 0.99 0.00 1.19 0.00 0.00 0.00 179.25 181.42 1y67 n PHE 112 N -3.54 0.00 0.00 0.00 3.72 0.53 -5.03 117.46 113.14 1y67 n PHE 112 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 1y67 n PHE 112 Cb 0.97 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.51 1y67 n PHE 112 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1y67 n GLY 113 N 0.81 2.83 3.61 1.37 0.00 -0.12 -4.50 105.19 109.20 1y67 n GLY 113 Ca 0.00 -0.75 -0.06 0.00 0.00 0.00 0.00 46.02 45.21 1y67 n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y67 s SER 114 N 0.00 -0.28 0.20 1.61 1.04 -1.26 -4.75 113.70 110.27 1y67 s SER 114 Ca 0.00 -0.18 -0.09 0.00 0.48 0.00 0.00 55.95 56.16 1y67 s SER 114 Cb 0.00 0.42 0.14 0.00 0.10 0.00 0.00 66.02 66.68 1y67 s SER 114 CO 0.00 -0.74 1.77 0.15 0.98 0.00 0.00 173.24 175.41 1y67 h PHE 115 N 2.00 1.13 -0.75 5.02 3.57 -1.92 -1.34 116.94 124.64 1y67 h PHE 115 Ca -0.23 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.19 1y67 h PHE 115 Cb 1.24 -0.34 -0.04 0.00 2.79 0.00 0.00 35.95 39.60 1y67 h PHE 115 CO 0.31 0.85 0.47 -0.44 -2.23 0.00 0.00 178.31 177.28 1y67 h ASP 116 N 1.08 0.89 -0.26 0.41 3.32 -1.97 -1.28 116.42 118.61 1y67 h ASP 116 Ca 0.25 -0.05 -0.12 0.00 0.02 0.00 0.00 57.03 57.13 1y67 h ASP 116 Cb 0.19 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1y67 h ASP 116 CO -0.02 0.68 -0.27 0.00 -1.72 0.00 0.00 179.24 177.91 1y67 h ALA 117 N 1.25 0.85 -0.52 3.45 0.00 -1.80 -2.24 119.26 120.25 1y67 h ALA 117 Ca 0.27 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.81 1y67 h ALA 117 Cb -0.06 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1y67 h ALA 117 CO -0.05 0.64 0.32 0.35 0.00 0.00 0.00 179.25 180.51 1y67 h PHE 118 N 0.65 0.61 -0.74 0.00 3.57 -1.05 -1.49 116.94 118.48 1y67 h PHE 118 Ca 0.08 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 1y67 h PHE 118 Cb 0.78 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 39.29 1y67 h PHE 118 CO 0.04 0.36 0.44 0.87 -2.23 0.00 0.00 178.31 177.79 1y67 h LYS 119 N 0.65 1.01 -0.33 1.11 1.57 -0.87 0.79 116.57 120.49 1y67 h LYS 119 Ca 0.20 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1y67 h LYS 119 Cb -0.02 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.07 1y67 h LYS 119 CO -0.07 0.72 0.20 0.37 -0.57 0.00 0.00 179.45 180.09 1y67 h GLN 120 N 1.01 0.46 -0.61 3.15 4.15 -1.25 -0.40 115.11 121.61 1y67 h GLN 120 Ca 0.27 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.62 1y67 h GLN 120 Cb -0.03 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.54 1y67 h GLN 120 CO -0.05 0.35 0.29 -0.22 -1.93 0.00 0.00 178.83 177.28 1y67 h LYS 121 N 0.43 0.87 -0.01 1.69 3.64 -0.80 -0.40 116.57 121.99 1y67 h LYS 121 Ca 0.12 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1y67 h LYS 121 Cb 0.02 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1y67 h LYS 121 CO -0.02 0.70 0.01 0.35 -2.27 0.00 0.00 179.45 178.22 1y67 h PHE 122 N 0.83 0.02 -0.85 1.91 3.57 -0.72 -2.06 116.94 119.64 1y67 h PHE 122 Ca 0.21 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.75 1y67 h PHE 122 Cb 0.12 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.80 1y67 h PHE 122 CO -0.00 0.16 0.56 0.93 -2.23 0.00 0.00 178.31 177.73 1y67 h GLU 123 N -0.13 0.99 -0.50 1.11 5.08 -0.94 -1.57 114.58 118.61 1y67 h GLU 123 Ca 0.00 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 1y67 h GLU 123 Cb 0.15 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1y67 h GLU 123 CO -0.00 0.65 0.05 0.22 -1.00 0.00 0.00 179.01 178.93 1y67 h ASP 124 N 1.01 0.82 -0.75 1.42 3.58 -0.83 0.29 116.42 121.97 1y67 h ASP 124 Ca 0.35 -0.28 0.01 0.00 0.42 0.00 0.00 57.03 57.53 1y67 h ASP 124 Cb 0.11 -0.22 -0.04 0.00 1.72 0.00 0.00 39.33 40.90 1y67 h ASP 124 CO -0.12 0.90 0.49 0.00 -2.88 0.00 0.00 179.24 177.63 1y67 h ALA 125 N 0.95 0.95 -0.57 -0.78 0.00 -1.00 -0.74 119.26 118.08 1y67 h ALA 125 Ca 0.15 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1y67 h ALA 125 Cb 0.45 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1y67 h ALA 125 CO 0.02 0.38 -0.07 0.00 0.00 0.00 0.00 179.25 179.57 1y67 h ALA 126 N 1.27 0.80 -0.14 0.00 0.00 -0.89 -2.84 119.26 117.45 1y67 h ALA 126 Ca 0.27 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.69 1y67 h ALA 126 Cb -0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1y67 h ALA 126 CO -0.06 0.67 -0.57 0.87 0.00 0.00 0.00 179.25 180.17 1y67 h LYS 127 N 0.94 0.43 -0.01 0.00 1.57 -0.12 -3.16 116.57 116.22 1y67 h LYS 127 Ca 0.15 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1y67 h LYS 127 Cb 0.64 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1y67 h LYS 127 CO 0.04 0.88 -0.13 0.25 -0.57 0.00 0.00 179.45 179.92 1y67 n THR 128 N -3.93 0.00 -2.12 -0.16 -2.24 -0.31 -4.73 114.28 100.80 1y67 n THR 128 Ca -0.03 -0.09 -0.40 0.00 -2.27 0.00 0.00 64.05 61.26 1y67 n THR 128 Cb 0.60 0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.85 1y67 n THR 128 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1y67 s ARG 129 N -2.43 3.00 -0.02 -0.78 6.06 -1.08 -4.96 118.95 118.74 1y67 s ARG 129 Ca 0.29 0.81 -0.26 0.00 -2.50 0.00 0.00 55.73 54.07 1y67 s ARG 129 Cb 0.20 -4.27 -0.04 0.00 0.06 0.00 0.00 34.95 30.91 1y67 s ARG 129 CO 0.47 -2.28 0.83 0.12 -2.50 0.00 0.00 175.30 171.94 1y67 s PHE 130 N 7.70 3.63 0.00 5.12 5.36 -1.26 -4.79 117.98 133.74 1y67 s PHE 130 Ca 0.67 1.47 0.00 0.00 -0.96 0.00 0.00 56.93 58.11 1y67 s PHE 130 Cb -0.15 -2.94 0.00 0.00 -0.34 0.00 0.00 43.02 39.59 1y67 s PHE 130 CO 0.26 0.06 0.00 0.41 -1.46 0.00 0.00 175.22 174.49 1y67 n GLY 131 N 2.94 -0.24 3.84 13.12 0.00 -1.26 -4.90 105.19 118.69 1y67 n GLY 131 Ca 0.02 -1.09 -0.35 0.00 0.00 0.00 0.00 46.02 44.60 1y67 n GLY 131 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1y67 s SER 132 N -4.00 6.88 0.00 1.61 0.01 -1.26 -4.80 113.70 112.14 1y67 s SER 132 Ca 0.00 1.18 0.00 0.00 1.31 0.00 0.00 55.95 58.44 1y67 s SER 132 Cb 0.00 -2.33 0.00 0.00 0.21 0.00 0.00 66.02 63.90 1y67 s SER 132 CO 0.00 0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.32 1y67 n GLY 133 N 0.69 -0.52 3.02 3.44 0.00 -1.26 -0.87 105.19 109.68 1y67 n GLY 133 Ca -0.04 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 44.97 1y67 n GLY 133 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1y67 s TRP 134 N -3.22 0.42 -0.00 1.61 0.52 -0.88 -0.65 118.94 116.74 1y67 s TRP 134 Ca 0.00 -0.54 0.04 0.00 0.02 0.00 0.00 56.10 55.62 1y67 s TRP 134 Cb 0.00 -0.28 -0.03 0.00 -1.15 0.00 0.00 33.47 32.01 1y67 s TRP 134 CO 0.00 -0.16 -0.11 0.00 0.02 0.00 0.00 176.95 176.70 1y67 s ALA 135 N -1.55 2.83 0.04 0.98 0.00 -0.93 -1.51 121.76 121.63 1y67 s ALA 135 Ca -0.13 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 50.82 1y67 s ALA 135 Cb -0.09 -1.00 -0.02 0.00 0.00 0.00 0.00 23.12 22.01 1y67 s ALA 135 CO -0.01 0.59 -0.12 -1.58 0.00 0.00 0.00 175.76 174.64 1y67 s TRP 136 N -0.92 1.03 -0.24 0.00 0.52 0.16 -1.48 118.94 118.01 1y67 s TRP 136 Ca 0.15 -0.35 -0.09 0.00 0.02 0.00 0.00 56.10 55.83 1y67 s TRP 136 Cb -0.11 -0.61 -0.04 0.00 -1.15 0.00 0.00 33.47 31.56 1y67 s TRP 136 CO 0.05 0.01 0.12 -1.17 0.02 0.00 0.00 176.95 175.98 1y67 s LEU 137 N -1.12 3.81 0.24 2.99 2.96 0.18 -1.73 118.68 126.00 1y67 s LEU 137 Ca -0.01 -0.03 0.10 0.00 -0.22 0.00 0.00 54.13 53.97 1y67 s LEU 137 Cb -0.08 -2.02 -0.05 0.00 0.50 0.00 0.00 46.19 44.55 1y67 s LEU 137 CO 0.01 0.03 -0.17 0.68 -1.32 0.00 0.00 176.35 175.58 1y67 s VAL 138 N 1.27 2.08 -0.27 1.68 -7.23 -0.17 -1.10 120.40 116.64 1y67 s VAL 138 Ca 0.06 -2.30 -0.10 0.00 -1.81 0.00 0.00 61.98 57.83 1y67 s VAL 138 Cb -0.14 -2.16 -0.04 0.00 0.56 0.00 0.00 36.38 34.59 1y67 s VAL 138 CO 0.05 -0.50 0.14 -0.69 -0.31 0.00 0.00 175.10 173.79 1y67 s VAL 139 N -2.76 4.89 -0.09 1.32 1.01 -0.15 -1.66 120.40 122.95 1y67 s VAL 139 Ca 0.26 -0.01 -0.04 0.00 0.00 0.00 0.00 61.98 62.18 1y67 s VAL 139 Cb -0.03 -3.33 0.04 0.00 0.00 0.00 0.00 36.38 33.06 1y67 s VAL 139 CO 0.11 0.26 0.20 -0.75 0.00 0.00 0.00 175.10 174.92 1y67 s LYS 140 N 1.69 0.16 -1.36 2.72 2.47 0.71 -1.60 119.74 124.54 1y67 s LYS 140 Ca 0.07 0.44 -0.09 0.00 -1.56 0.00 0.00 55.97 54.83 1y67 s LYS 140 Cb -0.16 -0.12 0.06 0.00 -1.46 0.00 0.00 37.83 36.15 1y67 s LYS 140 CO 0.08 -0.15 0.55 -0.25 0.16 0.00 0.00 175.35 175.74 1y67 n ASP 141 N 4.08 -4.31 -0.70 1.43 8.00 -1.26 -1.28 116.55 122.50 1y67 n ASP 141 Ca -0.24 -0.40 -0.09 0.00 0.71 0.00 0.00 54.79 54.77 1y67 n ASP 141 Cb 0.53 -3.53 -0.04 0.00 -0.02 0.00 0.00 41.12 38.06 1y67 n ASP 141 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1y67 n GLY 142 N -1.29 1.08 3.13 0.44 0.00 -1.26 -5.01 105.19 102.28 1y67 n GLY 142 Ca -0.03 -0.62 -0.10 0.00 0.00 0.00 0.00 46.02 45.27 1y67 n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y67 s LYS 143 N -2.79 0.73 0.28 1.61 1.02 -0.41 -5.15 119.74 115.04 1y67 s LYS 143 Ca 0.00 -1.22 -0.20 0.00 0.02 0.00 0.00 55.97 54.58 1y67 s LYS 143 Cb 0.00 -0.12 -0.09 0.00 -0.52 0.00 0.00 37.83 37.10 1y67 s LYS 143 CO 0.00 -0.03 0.78 -0.51 -0.92 0.00 0.00 175.35 174.67 1y67 s LEU 144 N -2.79 4.24 0.12 3.17 1.43 -1.26 -0.21 118.68 123.38 1y67 s LEU 144 Ca 0.07 1.47 -0.15 0.00 -1.03 0.00 0.00 54.13 54.49 1y67 s LEU 144 Cb 0.03 -3.86 0.03 0.00 0.03 0.00 0.00 46.19 42.43 1y67 s LEU 144 CO -0.05 -0.08 0.38 -0.62 0.23 0.00 0.00 176.35 176.21 1y67 s ASP 145 N -1.85 -0.20 -0.14 2.29 2.15 -0.67 -4.92 116.67 113.34 1y67 s ASP 145 Ca 0.49 -0.34 -0.01 0.00 0.43 0.00 0.00 52.55 53.11 1y67 s ASP 145 Cb -0.15 0.46 -0.02 0.00 -0.30 0.00 0.00 42.92 42.91 1y67 s ASP 145 CO 0.20 -0.83 -0.10 -0.69 -0.17 0.00 0.00 175.17 173.58 1y67 s VAL 146 N -3.76 3.32 0.15 1.11 1.01 -1.26 -1.00 120.40 119.97 1y67 s VAL 146 Ca 0.03 -0.56 -0.01 0.00 0.00 0.00 0.00 61.98 61.44 1y67 s VAL 146 Cb 0.02 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 1y67 s VAL 146 CO -0.12 0.51 0.06 0.68 0.00 0.00 0.00 175.10 176.24 1y67 s VAL 147 N 0.37 0.16 0.16 2.92 -7.23 -0.71 -4.99 120.40 111.08 1y67 s VAL 147 Ca -0.09 -1.93 0.06 0.00 -1.81 0.00 0.00 61.98 58.21 1y67 s VAL 147 Cb -0.15 -2.13 -0.04 0.00 0.56 0.00 0.00 36.38 34.61 1y67 s VAL 147 CO 0.05 -0.39 -0.13 -0.94 -0.31 0.00 0.00 175.10 173.37 1y67 s SER 148 N -3.09 2.17 0.13 4.85 1.04 -1.26 0.39 113.70 117.93 1y67 s SER 148 Ca 0.27 -0.93 0.05 0.00 0.48 0.00 0.00 55.95 55.82 1y67 s SER 148 Cb 0.07 -0.08 -0.04 0.00 0.10 0.00 0.00 66.02 66.07 1y67 s SER 148 CO 0.04 -0.19 -0.12 0.42 0.98 0.00 0.00 173.24 174.36 1y67 s THR 149 N -2.68 1.22 0.26 2.02 -4.23 -0.57 -4.80 115.64 106.86 1y67 s THR 149 Ca 0.15 -1.80 -0.19 0.00 -1.18 0.00 0.00 61.69 58.67 1y67 s THR 149 Cb -0.02 -1.58 -0.09 0.00 1.34 0.00 0.00 72.50 72.15 1y67 s THR 149 CO 0.04 -0.54 0.75 0.00 -0.54 0.00 0.00 174.62 174.33 1y67 s ALA 150 N -2.52 3.37 0.00 3.99 0.00 -1.26 -2.07 121.76 123.26 1y67 s ALA 150 Ca 0.10 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.23 1y67 s ALA 150 Cb -0.03 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.25 1y67 s ALA 150 CO 0.02 0.31 0.00 0.09 0.00 0.00 0.00 175.76 176.18 1y67 n ASN 151 N 0.40 0.00 -0.96 0.00 3.02 -0.05 -1.44 115.26 116.23 1y67 n ASN 151 Ca -0.00 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.63 1y67 n ASN 151 Cb 0.52 0.00 0.26 0.00 -0.61 0.00 0.00 39.78 39.94 1y67 n ASN 151 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1y67 n GLN 152 N 12.63 3.12 -1.80 3.52 1.13 -1.26 -4.17 117.38 130.55 1y67 n GLN 152 Ca 0.00 -2.73 -0.37 0.00 -1.94 0.00 0.00 57.00 51.95 1y67 n GLN 152 Cb 0.00 -1.78 0.05 0.00 0.11 0.00 0.00 30.24 28.62 1y67 n GLN 152 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1y67 s ASP 153 N -1.63 4.91 -0.00 1.08 1.01 -0.52 -4.09 116.67 117.43 1y67 s ASP 153 Ca 0.40 2.63 0.03 0.00 0.71 0.00 0.00 52.55 56.32 1y67 s ASP 153 Cb 0.31 -2.62 -0.01 0.00 1.01 0.00 0.00 42.92 41.61 1y67 s ASP 153 CO 0.11 -1.80 -0.10 0.21 0.21 0.00 0.00 175.17 173.80 1y67 s ASN 154 N -1.29 1.23 0.62 0.27 3.84 -1.26 -4.75 114.94 113.60 1y67 s ASN 154 Ca 0.78 -0.21 0.36 0.00 0.21 0.00 0.00 52.86 54.01 1y67 s ASN 154 Cb -0.37 -0.13 1.96 0.00 -0.55 0.00 0.00 41.25 42.15 1y67 s ASN 154 CO 0.41 0.12 2.10 -0.65 -2.79 0.00 0.00 177.10 176.28 1y67 h PRO 155 N 5.81 0.00 0.00 0.43 0.11 -1.83 -0.29 132.00 136.23 1y67 h PRO 155 Ca -0.32 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.77 1y67 h PRO 155 Cb 1.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1y67 h PRO 155 CO 0.49 0.00 -0.09 -0.07 -0.21 0.00 0.00 178.00 178.12 1y67 h LEU 156 N 0.00 0.00 -1.93 2.35 3.38 -1.87 -2.51 115.31 114.73 1y67 h LEU 156 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1y67 h LEU 156 Cb 0.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1y67 h LEU 156 CO 0.00 0.09 -0.07 0.24 0.09 0.00 0.00 178.44 178.79 1y67 h MET 157 N 0.00 0.00 0.00 1.13 2.86 -1.15 -3.39 114.93 114.38 1y67 h MET 157 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1y67 h MET 157 Cb 0.24 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.90 1y67 h MET 157 CO 0.01 0.07 0.00 0.41 1.06 0.00 0.00 176.91 178.46 1y67 n GLY 158 N -0.48 0.26 0.18 8.32 0.00 -0.95 -4.52 105.19 108.00 1y67 n GLY 158 Ca -0.01 -1.78 -0.04 0.00 0.00 0.00 0.00 46.02 44.19 1y67 n GLY 158 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1y67 h GLU 159 N 0.00 0.28 -0.73 1.61 4.81 -1.84 0.11 114.58 118.82 1y67 h GLU 159 Ca 0.00 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.29 1y67 h GLU 159 Cb 0.00 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.25 1y67 h GLU 159 CO 0.00 0.18 0.39 0.00 -0.73 0.00 0.00 179.01 178.86 1y67 h ALA 160 N 1.30 1.01 0.00 2.92 0.00 -1.89 0.13 119.26 122.74 1y67 h ALA 160 Ca 0.21 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.03 1y67 h ALA 160 Cb 0.23 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1y67 h ALA 160 CO -0.23 0.03 -0.76 0.82 0.00 0.00 0.00 179.25 179.11 1y67 h ILE 161 N 0.69 0.91 0.00 0.00 2.04 -1.73 -3.41 117.51 116.01 1y67 h ILE 161 Ca 0.35 -1.94 0.00 0.00 1.00 0.00 0.00 64.86 64.26 1y67 h ILE 161 Cb 0.30 1.97 0.00 0.00 -0.74 0.00 0.00 36.82 38.35 1y67 h ILE 161 CO -0.23 0.31 -0.61 0.00 0.00 0.00 0.00 178.15 177.62 1y67 n ALA 162 N -3.22 3.53 0.00 1.87 0.00 0.00 -4.95 120.51 117.75 1y67 n ALA 162 Ca -0.21 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1y67 n ALA 162 Cb 0.52 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.88 1y67 n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y67 n GLY 163 N 1.46 2.90 3.22 0.00 0.00 0.46 -4.71 105.19 108.53 1y67 n GLY 163 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 1y67 n GLY 163 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1y67 s VAL 164 N -1.80 0.04 0.34 1.61 -7.23 -1.26 -4.88 120.40 107.22 1y67 s VAL 164 Ca 0.00 -1.88 0.03 0.00 -1.81 0.00 0.00 61.98 58.32 1y67 s VAL 164 Cb 0.00 -2.27 -0.02 0.00 0.56 0.00 0.00 36.38 34.65 1y67 s VAL 164 CO 0.00 -0.18 0.37 -0.94 -0.31 0.00 0.00 175.10 174.04 1y67 s SER 165 N -3.10 1.32 0.00 4.85 1.04 -1.26 -3.30 113.70 113.25 1y67 s SER 165 Ca 0.31 -1.64 0.00 0.00 0.48 0.00 0.00 55.95 55.10 1y67 s SER 165 Cb 0.06 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.79 1y67 s SER 165 CO 0.07 -1.17 0.00 0.61 0.98 0.00 0.00 173.24 173.73 1y67 n GLY 166 N -0.59 2.62 3.57 7.32 0.00 -1.19 -4.87 105.19 112.04 1y67 n GLY 166 Ca 0.04 -2.13 -0.40 0.00 0.00 0.00 0.00 46.02 43.54 1y67 n GLY 166 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y67 s THR 167 N -2.05 5.16 0.24 2.61 2.01 -0.63 -3.37 115.64 119.62 1y67 s THR 167 Ca 0.00 0.25 -0.30 0.00 0.31 0.00 0.00 61.69 61.96 1y67 s THR 167 Cb 0.00 -3.78 -0.09 0.00 0.01 0.00 0.00 72.50 68.64 1y67 s THR 167 CO 0.00 -0.01 1.17 -2.84 -0.69 0.00 0.00 174.62 172.25 1y67 s PRO 168 N 2.07 4.54 -0.00 4.92 0.02 -1.26 -0.98 135.00 144.30 1y67 s PRO 168 Ca 0.13 1.89 0.02 0.00 0.02 0.00 0.00 61.00 63.06 1y67 s PRO 168 Cb -0.16 -3.20 -0.02 0.00 0.02 0.00 0.00 34.50 31.14 1y67 s PRO 168 CO 0.11 0.02 0.07 0.44 -0.33 0.00 0.00 177.00 177.32 1y67 n ILE 169 N 1.76 0.00 -3.72 2.83 -5.35 -0.26 -4.96 119.36 109.66 1y67 n ILE 169 Ca 0.02 -0.33 -0.13 0.00 -0.27 0.00 0.00 62.75 62.04 1y67 n ILE 169 Cb 0.44 0.83 -0.10 0.00 -1.74 0.00 0.00 39.64 39.08 1y67 n ILE 169 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 1y67 s LEU 170 N -2.41 0.26 0.06 7.28 2.96 -1.21 -4.57 118.68 121.04 1y67 s LEU 170 Ca 0.00 0.89 -0.06 0.00 -0.22 0.00 0.00 54.13 54.74 1y67 s LEU 170 Cb 0.01 1.49 -0.01 0.00 0.50 0.00 0.00 46.19 48.19 1y67 s LEU 170 CO 0.08 -0.16 0.12 -0.83 -1.32 0.00 0.00 176.35 174.25 1y67 s GLY 171 N 0.40 0.17 -0.04 7.98 0.00 -1.26 -0.65 107.32 113.92 1y67 s GLY 171 Ca -0.01 -0.64 0.05 0.00 0.00 0.00 0.00 44.72 44.12 1y67 s GLY 171 CO -0.01 -0.80 -0.19 0.54 0.00 0.00 0.00 173.10 172.64 1y67 s VAL 172 N -3.26 1.56 -0.24 1.40 0.11 -0.55 -4.87 120.40 114.54 1y67 s VAL 172 Ca 0.00 -0.80 -0.28 0.00 -2.93 0.00 0.00 61.98 57.97 1y67 s VAL 172 Cb 0.02 -1.32 0.01 0.00 -1.53 0.00 0.00 36.38 33.56 1y67 s VAL 172 CO -0.08 0.44 0.98 -0.62 -3.33 0.00 0.00 175.10 172.50 1y67 s ASP 173 N -0.14 7.00 -0.12 3.54 -1.08 -1.26 -2.18 116.67 122.43 1y67 s ASP 173 Ca -0.00 1.24 0.15 0.00 -0.52 0.00 0.00 52.55 53.42 1y67 s ASP 173 Cb -0.11 -2.51 0.47 0.00 -1.46 0.00 0.00 42.92 39.31 1y67 s ASP 173 CO 0.01 -0.64 1.38 1.33 0.52 0.00 0.00 175.17 177.77 1y67 n VAL 174 N 5.35 1.86 -1.74 1.11 0.24 0.18 -4.83 118.33 120.49 1y67 n VAL 174 Ca 0.10 -1.55 -0.41 0.00 -2.04 0.00 0.00 64.34 60.44 1y67 n VAL 174 Cb 0.47 0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.85 1y67 n VAL 174 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 1y67 n TRP 175 N -0.09 2.61 0.16 6.34 7.02 -1.18 -4.42 117.44 127.88 1y67 n TRP 175 Ca 0.18 0.48 0.16 0.00 -1.02 0.00 0.00 57.50 57.30 1y67 n TRP 175 Cb 0.74 -2.46 0.74 0.00 -2.42 0.00 0.00 31.31 27.91 1y67 n TRP 175 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 1y67 h GLU 176 N 2.59 0.00 0.00 -0.99 5.08 -1.93 -1.15 114.58 118.18 1y67 h GLU 176 Ca -0.49 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.86 1y67 h GLU 176 Cb 1.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.51 1y67 h GLU 176 CO 0.62 0.00 -0.06 1.12 -1.00 0.00 0.00 179.01 179.70 1y67 h HIS 177 N 0.00 0.00 0.00 4.33 2.07 -1.98 0.15 115.15 119.72 1y67 h HIS 177 Ca 0.11 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.63 1y67 h HIS 177 Cb 0.51 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.49 1y67 h HIS 177 CO 0.00 0.06 0.00 0.00 -3.07 0.00 0.00 177.93 174.92 1y67 h ALA 178 N 1.94 1.00 0.00 6.11 0.00 -1.52 -3.39 119.26 123.40 1y67 h ALA 178 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1y67 h ALA 178 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1y67 h ALA 178 CO 0.01 0.00 0.00 2.48 0.00 0.00 0.00 179.25 181.74 1y67 n TYR 179 N -2.89 0.00 -0.20 0.00 0.18 -0.75 -4.95 117.16 108.55 1y67 n TYR 179 Ca 0.02 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.70 1y67 n TYR 179 Cb 0.35 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 39.33 1y67 n TYR 179 CO 0.00 0.00 0.00 -0.92 -2.08 0.00 0.00 176.86 173.86 1y67 h TYR 180 N 0.00 1.18 -0.86 -3.48 3.20 -0.93 0.20 116.97 116.27 1y67 h TYR 180 Ca 0.00 -0.23 -0.02 0.00 3.14 0.00 0.00 58.73 61.62 1y67 h TYR 180 Cb 0.15 -0.30 -0.04 0.00 1.54 0.00 0.00 36.73 38.08 1y67 h TYR 180 CO 0.00 1.06 0.46 -0.07 -1.64 0.00 0.00 178.16 177.97 1y67 h LEU 181 N 0.95 1.09 0.13 2.82 3.38 -1.87 0.45 115.31 122.26 1y67 h LEU 181 Ca 0.15 -0.10 -0.35 0.00 0.09 0.00 0.00 57.88 57.67 1y67 h LEU 181 Cb 0.64 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1y67 h LEU 181 CO 0.04 0.89 -1.83 -1.13 0.09 0.00 0.00 178.44 176.50 1y67 h ASN 182 N 1.21 0.44 0.00 -0.43 -1.24 -1.92 -3.42 115.58 110.23 1y67 h ASN 182 Ca 0.30 -0.80 0.00 0.00 0.71 0.00 0.00 56.30 56.51 1y67 h ASN 182 Cb 0.05 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 38.96 1y67 h ASN 182 CO -0.05 1.70 -0.30 -1.22 -1.29 0.00 0.00 177.43 176.27 1y67 n TYR 183 N -3.47 0.00 0.00 0.67 4.02 0.68 -5.08 117.16 113.98 1y67 n TYR 183 Ca -0.26 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.63 1y67 n TYR 183 Cb 1.06 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 40.37 1y67 n TYR 183 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1y67 n GLN 184 N -1.16 0.00 0.01 -0.72 3.00 0.15 -0.66 117.38 118.00 1y67 n GLN 184 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.06 1y67 n GLN 184 Cb 0.05 0.00 0.27 0.00 0.00 0.00 0.00 30.24 30.57 1y67 n GLN 184 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1y67 n ASN 185 N 3.22 0.07 -3.44 1.08 6.94 -1.26 -4.45 115.26 117.42 1y67 n ASN 185 Ca 0.00 0.52 -0.40 0.00 -0.02 0.00 0.00 54.58 54.68 1y67 n ASN 185 Cb 0.00 -0.53 -0.02 0.00 -2.36 0.00 0.00 39.78 36.87 1y67 n ASN 185 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1y67 n ARG 186 N -1.58 3.68 -0.30 -3.83 1.74 0.17 -4.74 116.66 111.79 1y67 n ARG 186 Ca 0.03 -2.54 0.07 0.00 -0.77 0.00 0.00 57.85 54.64 1y67 n ARG 186 Cb 0.14 -2.87 0.22 0.00 -1.02 0.00 0.00 32.46 28.93 1y67 n ARG 186 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1y67 h ARG 187 N 5.17 0.62 -0.13 5.56 2.43 -1.83 -1.61 114.38 124.59 1y67 h ARG 187 Ca 0.77 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.89 1y67 h ARG 187 Cb 0.37 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1y67 h ARG 187 CO 1.75 0.41 0.03 -1.35 -1.51 0.00 0.00 179.97 179.30 1y67 h PRO 188 N 0.64 0.18 -0.48 0.20 0.11 -1.99 -0.68 132.00 129.98 1y67 h PRO 188 Ca 0.46 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 66.43 1y67 h PRO 188 Cb 0.64 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.70 1y67 h PRO 188 CO -0.36 0.17 -0.18 -0.44 -0.21 0.00 0.00 178.00 176.98 1y67 h ASP 189 N 0.18 0.99 -0.37 -2.05 5.19 -1.70 -1.08 116.42 117.57 1y67 h ASP 189 Ca 0.05 -0.39 -0.00 0.00 -0.62 0.00 0.00 57.03 56.07 1y67 h ASP 189 Cb 0.08 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 39.30 1y67 h ASP 189 CO -0.00 1.15 0.22 0.22 -3.12 0.00 0.00 179.24 177.71 1y67 h TYR 190 N 0.82 0.50 -0.53 4.55 3.20 -1.04 -1.74 116.97 122.72 1y67 h TYR 190 Ca 0.11 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.89 1y67 h TYR 190 Cb 0.75 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.84 1y67 h TYR 190 CO 0.05 0.36 -0.03 -0.07 -1.64 0.00 0.00 178.16 176.84 1y67 h LEU 191 N 0.48 0.90 -0.38 2.82 3.38 -1.00 -0.35 115.31 121.16 1y67 h LEU 191 Ca 0.13 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1y67 h LEU 191 Cb 0.02 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1y67 h LEU 191 CO -0.02 0.98 0.24 0.00 0.09 0.00 0.00 178.44 179.73 1y67 h ALA 192 N 1.11 0.49 -0.28 1.53 0.00 -1.10 -2.96 119.26 118.05 1y67 h ALA 192 Ca 0.15 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1y67 h ALA 192 Cb 0.54 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1y67 h ALA 192 CO 0.03 -0.04 -0.11 0.00 0.00 0.00 0.00 179.25 179.13 1y67 h ALA 193 N 1.12 1.29 -0.95 0.00 0.00 -0.92 -3.14 119.26 116.67 1y67 h ALA 193 Ca 0.14 -0.26 0.17 0.00 0.00 0.00 0.00 54.91 54.96 1y67 h ALA 193 Cb -0.03 -0.13 -0.10 0.00 0.00 0.00 0.00 17.79 17.53 1y67 h ALA 193 CO -0.03 0.47 0.54 0.35 0.00 0.00 0.00 179.25 180.59 1y67 h PHE 194 N 0.44 0.96 -0.39 0.00 3.57 -0.89 -1.15 116.94 119.47 1y67 h PHE 194 Ca 0.08 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.73 1y67 h PHE 194 Cb 0.46 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1y67 h PHE 194 CO 0.01 0.22 0.30 -1.49 -2.23 0.00 0.00 178.31 175.13 1y67 h TRP 195 N 0.72 0.00 0.00 0.41 4.06 -1.62 -0.63 115.95 118.89 1y67 h TRP 195 Ca 0.53 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.48 1y67 h TRP 195 Cb 0.79 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.95 1y67 h TRP 195 CO -0.04 0.00 0.00 -0.91 -3.56 0.00 0.00 178.44 173.93 1y67 h ASN 196 N 0.00 0.00 -0.03 -3.49 2.35 -1.39 -3.21 115.58 109.80 1y67 h ASN 196 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1y67 h ASN 196 Cb 0.78 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.15 1y67 h ASN 196 CO -0.00 0.00 0.00 1.33 -1.65 0.00 0.00 177.43 177.11 1y67 n VAL 197 N -2.95 0.10 -2.06 2.81 0.24 -0.26 -4.46 118.33 111.76 1y67 n VAL 197 Ca 0.00 -0.55 -0.42 0.00 -2.04 0.00 0.00 64.34 61.33 1y67 n VAL 197 Cb 0.25 1.10 -0.03 0.00 -1.47 0.00 0.00 33.84 33.69 1y67 n VAL 197 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1y67 s VAL 198 N -0.69 2.88 -0.78 3.34 1.01 -1.14 -0.40 120.40 124.62 1y67 s VAL 198 Ca 0.10 0.68 -0.18 0.00 0.00 0.00 0.00 61.98 62.58 1y67 s VAL 198 Cb 0.07 -3.43 0.14 0.00 0.00 0.00 0.00 36.38 33.15 1y67 s VAL 198 CO 0.10 0.08 0.89 0.21 0.00 0.00 0.00 175.10 176.37 1y67 s ASN 199 N 0.76 6.49 0.50 3.32 3.84 0.98 -4.73 114.94 126.10 1y67 s ASN 199 Ca 0.63 -1.96 0.27 0.00 0.21 0.00 0.00 52.86 52.01 1y67 s ASN 199 Cb -0.40 -2.32 1.29 0.00 -0.55 0.00 0.00 41.25 39.26 1y67 s ASN 199 CO 0.36 -0.97 1.99 -0.50 -2.79 0.00 0.00 177.10 175.19 1y67 h TRP 200 N 8.72 0.00 -0.30 0.43 4.06 -1.91 -2.09 115.95 124.86 1y67 h TRP 200 Ca -0.03 0.00 0.01 0.00 2.06 0.00 0.00 58.89 60.94 1y67 h TRP 200 Cb 1.05 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.19 1y67 h TRP 200 CO 1.01 0.15 0.16 -0.44 -3.56 0.00 0.00 178.44 175.77 1y67 h ASP 201 N 0.00 0.26 -0.33 -3.49 5.19 -1.94 0.45 116.42 116.56 1y67 h ASP 201 Ca -0.00 0.01 -0.12 0.00 -0.62 0.00 0.00 57.03 56.29 1y67 h ASP 201 Cb 0.47 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 39.93 1y67 h ASP 201 CO 0.02 0.19 -0.28 -0.08 -3.12 0.00 0.00 179.24 175.97 1y67 h GLU 202 N 0.34 0.78 -0.87 3.56 4.57 -1.74 -1.70 114.58 119.52 1y67 h GLU 202 Ca 0.12 -0.39 0.03 0.00 -1.18 0.00 0.00 59.36 57.93 1y67 h GLU 202 Cb 0.01 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.56 1y67 h GLU 202 CO -0.06 1.02 0.57 0.28 -1.18 0.00 0.00 179.01 179.63 1y67 h VAL 203 N 0.55 1.17 -0.63 0.32 2.07 -1.31 -0.75 116.25 117.66 1y67 h VAL 203 Ca 0.06 -0.38 -0.06 0.00 0.82 0.00 0.00 66.70 67.14 1y67 h VAL 203 Cb 0.85 -0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 1y67 h VAL 203 CO 0.07 0.20 0.18 0.28 0.02 0.00 0.00 177.57 178.32 1y67 h SER 204 N 1.12 0.95 -0.41 0.57 0.02 -0.74 0.10 113.55 115.15 1y67 h SER 204 Ca 0.34 -0.22 0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1y67 h SER 204 Cb -0.04 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.23 1y67 h SER 204 CO -0.10 0.92 0.25 0.50 -1.14 0.00 0.00 176.83 177.26 1y67 h LYS 205 N 0.93 0.49 -0.65 3.45 3.64 -0.99 -1.03 116.57 122.40 1y67 h LYS 205 Ca 0.20 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.52 1y67 h LYS 205 Cb 0.33 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 1y67 h LYS 205 CO -0.00 0.33 0.28 0.00 -2.27 0.00 0.00 179.45 177.79 1y67 h ARG 206 N 0.51 0.95 -0.13 1.90 3.08 -0.84 -1.57 114.38 118.28 1y67 h ARG 206 Ca 0.16 -0.16 0.01 0.00 0.07 0.00 0.00 59.98 60.07 1y67 h ARG 206 Cb -0.01 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 1y67 h ARG 206 CO -0.06 0.78 0.03 -0.92 -1.07 0.00 0.00 179.97 178.73 1y67 h TYR 207 N 0.91 0.06 -0.74 3.04 3.20 -0.76 0.47 116.97 123.14 1y67 h TYR 207 Ca 0.22 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.16 1y67 h TYR 207 Cb 0.17 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.37 1y67 h TYR 207 CO 0.01 0.03 0.43 0.00 -1.64 0.00 0.00 178.16 176.98 1y67 h ALA 208 N 1.09 1.01 -0.42 1.82 0.00 -1.04 -2.19 119.26 119.54 1y67 h ALA 208 Ca 0.06 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1y67 h ALA 208 Cb 0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1y67 h ALA 208 CO -0.07 0.11 -0.04 0.00 0.00 0.00 0.00 179.25 179.26 1y67 h ALA 209 N 1.38 0.57 -0.86 0.00 0.00 -1.07 -3.22 119.26 116.06 1y67 h ALA 209 Ca 0.33 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1y67 h ALA 209 Cb 0.21 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1y67 h ALA 209 CO -0.19 0.39 0.57 0.00 0.00 0.00 0.00 179.25 180.02 1y67 h ALA 210 N 0.88 1.42 0.00 0.00 0.00 -0.35 -1.45 119.26 119.76 1y67 h ALA 210 Ca 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1y67 h ALA 210 Cb 0.54 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1y67 h ALA 210 CO 0.03 0.52 0.00 1.63 0.00 0.00 0.00 179.25 181.43 1y67 n LYS 211 N -4.42 0.10 0.00 0.00 5.02 -0.87 -2.80 118.16 115.19 1y67 n LYS 211 Ca 0.10 0.41 0.10 0.00 -2.02 0.00 0.00 58.31 56.90 1y67 n LYS 211 Cb 0.06 -1.72 0.04 0.00 -0.02 0.00 0.00 35.03 33.38 1y67 n LYS 211 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1y67 n LEU 212 N -1.92 2.29 -4.68 -0.35 4.77 -0.55 -4.95 117.00 111.61 1y67 n LEU 212 Ca 0.02 -0.88 -0.42 0.00 -0.03 0.00 0.00 56.01 54.70 1y67 n LEU 212 Cb 0.16 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 1y67 n LEU 212 CO 0.14 0.41 0.75 -0.69 -1.33 0.00 0.00 177.39 176.67 1y67 s VAL 213 N -2.00 4.81 0.49 4.08 1.01 -1.12 -5.02 120.40 122.64 1y67 s VAL 213 Ca 0.20 1.92 -0.22 0.00 0.00 0.00 0.00 61.98 63.89 1y67 s VAL 213 Cb 0.17 -4.26 -0.07 0.00 0.00 0.00 0.00 36.38 32.22 1y67 s VAL 213 CO 0.39 0.00 1.15 -2.16 0.00 0.00 0.00 175.10 174.48 1y67 s PRO 214 N 2.12 3.61 0.00 2.72 0.04 -1.26 -5.10 135.00 137.13 1y67 s PRO 214 Ca 0.45 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.21 1y67 s PRO 214 Cb -0.18 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.10 1y67 s PRO 214 CO 0.15 -0.66 0.00 0.54 0.04 0.00 0.00 177.00 177.07