#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wix h SER 2 N 0.00 0.73 -1.16 1.61 0.02 -2.04 -3.41 113.55 109.29 1wix h SER 2 Ca 0.00 -0.93 -0.61 0.00 -0.84 0.00 0.00 61.79 59.41 1wix h SER 2 Cb 0.00 -0.24 -0.10 0.00 0.14 0.00 0.00 62.40 62.20 1wix h SER 2 CO 0.00 1.67 1.53 -0.44 -1.14 0.00 0.00 176.83 178.45 1wix s SER 3 N -7.41 6.54 0.00 3.07 0.01 -1.26 -4.84 113.70 109.81 1wix s SER 3 Ca -0.12 -1.58 0.00 0.00 1.31 0.00 0.00 55.95 55.56 1wix s SER 3 Cb 0.04 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.71 1wix s SER 3 CO 0.90 -1.45 0.00 0.61 0.41 0.00 0.00 173.24 173.71 1wix n GLY 4 N 6.66 -2.74 0.01 3.44 0.00 -1.26 -4.87 105.19 106.43 1wix n GLY 4 Ca 0.34 -2.10 -0.01 0.00 0.00 0.00 0.00 46.02 44.25 1wix n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wix n SER 5 N 0.00 4.71 -3.98 1.61 2.88 -1.26 -4.94 113.62 112.65 1wix n SER 5 Ca 0.00 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.27 1wix n SER 5 Cb 0.00 0.54 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1wix n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1wix n SER 6 N -2.03 0.08 0.00 -3.46 7.64 -1.26 -4.80 113.62 109.79 1wix n SER 6 Ca -0.02 -1.04 0.00 0.00 1.01 0.00 0.00 58.87 58.82 1wix n SER 6 Cb 0.53 -1.28 0.00 0.00 -1.01 0.00 0.00 64.21 62.45 1wix n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wix n GLY 7 N -2.22 3.84 3.29 0.23 0.00 -1.26 -4.97 105.19 104.10 1wix n GLY 7 Ca -0.24 -0.38 -0.33 0.00 0.00 0.00 0.00 46.02 45.07 1wix n GLY 7 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1wix n LEU 8 N 0.00 -2.01 0.05 0.99 -0.00 -1.26 -4.50 117.00 110.26 1wix n LEU 8 Ca 0.00 -0.03 -0.12 0.00 -0.00 0.00 0.00 56.01 55.85 1wix n LEU 8 Cb 0.00 -0.98 -0.09 0.00 -0.00 0.00 0.00 43.42 42.35 1wix n LEU 8 CO 0.00 -3.20 0.56 1.55 -0.00 0.00 0.00 177.39 176.29 1wix h PRO 9 N -1.92 -0.15 -1.51 1.47 0.13 -1.97 0.47 132.00 128.52 1wix h PRO 9 Ca -0.51 0.01 0.49 0.00 -0.87 0.00 0.00 66.00 65.12 1wix h PRO 9 Cb 1.35 0.03 -0.12 0.00 0.13 0.00 0.00 31.00 32.39 1wix h PRO 9 CO 0.37 0.28 1.01 1.25 -0.23 0.00 0.00 178.00 180.67 1wix h LEU 10 N -0.64 0.16 0.00 1.56 6.46 -1.92 0.31 115.31 121.24 1wix h LEU 10 Ca -0.02 0.11 -0.39 0.00 -0.12 0.00 0.00 57.88 57.47 1wix h LEU 10 Cb 0.50 0.11 -0.07 0.00 -0.73 0.00 0.00 40.66 40.47 1wix h LEU 10 CO 0.03 -0.17 -2.47 0.00 -0.62 0.00 0.00 178.44 175.21 1wix n ASP 12 N -3.24 0.00 -0.04 0.00 2.03 0.16 -2.40 116.55 113.06 1wix n ASP 12 Ca -0.45 0.47 -0.08 0.00 0.52 0.00 0.00 54.79 55.25 1wix n ASP 12 Cb 1.00 -0.48 -0.03 0.00 -0.72 0.00 0.00 41.12 40.89 1wix n ASP 12 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1wix n SER 13 N -1.48 1.04 -0.25 1.67 2.88 0.82 -4.66 113.62 113.64 1wix n SER 13 Ca 0.00 0.08 0.05 0.00 -1.33 0.00 0.00 58.87 57.67 1wix n SER 13 Cb 0.02 -0.22 0.16 0.00 -0.75 0.00 0.00 64.21 63.41 1wix n SER 13 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1wix h LEU 14 N -0.25 -0.28 -0.78 2.46 3.38 -1.40 0.90 115.31 119.34 1wix h LEU 14 Ca -0.20 0.18 0.18 0.00 0.09 0.00 0.00 57.88 58.13 1wix h LEU 14 Cb 1.20 0.32 -0.12 0.00 0.09 0.00 0.00 40.66 42.14 1wix h LEU 14 CO -0.11 -0.15 0.15 0.40 0.09 0.00 0.00 178.44 178.82 1wix h ILE 15 N 0.13 0.42 -0.09 1.22 2.04 -1.76 0.59 117.51 120.07 1wix h ILE 15 Ca 0.41 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 66.20 1wix h ILE 15 Cb 0.71 0.19 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1wix h ILE 15 CO -0.63 0.04 0.06 0.40 0.00 0.00 0.00 178.15 178.02 1wix h ILE 16 N 0.21 1.01 -0.01 -0.67 2.04 -1.09 -0.58 117.51 118.43 1wix h ILE 16 Ca 0.45 -0.03 -0.25 0.00 1.00 0.00 0.00 64.86 66.02 1wix h ILE 16 Cb 0.82 0.90 0.02 0.00 -0.74 0.00 0.00 36.82 37.82 1wix h ILE 16 CO -0.59 0.02 -0.98 -0.25 0.00 0.00 0.00 178.15 176.35 1wix h TRP 17 N 0.10 1.01 0.00 1.37 7.01 0.30 -3.15 115.95 122.59 1wix h TRP 17 Ca 0.03 -0.54 0.00 0.00 2.11 0.00 0.00 58.89 60.49 1wix h TRP 17 Cb 0.02 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 26.96 1wix h TRP 17 CO -0.00 1.38 0.00 1.25 -2.79 0.00 0.00 178.44 178.28 1wix h LEU 18 N 0.35 0.00 -2.22 0.65 5.85 -0.49 -2.98 115.31 116.48 1wix h LEU 18 Ca -0.12 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 1wix h LEU 18 Cb 1.64 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.66 1wix h LEU 18 CO 0.19 0.00 -0.06 1.56 -0.34 0.00 0.00 178.44 179.80 1wix h GLN 19 N 0.00 0.00 0.00 1.25 4.20 -1.08 -1.75 115.11 117.73 1wix h GLN 19 Ca 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1wix h GLN 19 Cb 0.53 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.31 1wix h GLN 19 CO 0.00 0.06 -0.03 1.79 -0.67 0.00 0.00 178.83 179.98 1wix h THR 20 N 0.00 0.37 -3.06 -0.54 1.35 -1.68 -3.38 112.91 105.97 1wix h THR 20 Ca -0.00 -0.16 -0.66 0.00 -0.55 0.00 0.00 66.41 65.05 1wix h THR 20 Cb 0.20 1.11 -0.16 0.00 -1.73 0.00 0.00 68.15 67.57 1wix h THR 20 CO 0.01 0.03 0.30 -0.36 -0.25 0.00 0.00 175.52 175.25 1wix s PHE 21 N -4.35 2.89 -0.51 4.73 0.40 -0.66 -4.89 117.98 115.59 1wix s PHE 21 Ca -0.04 -0.46 0.02 0.00 -0.60 0.00 0.00 56.93 55.84 1wix s PHE 21 Cb 0.14 -3.91 0.15 0.00 0.51 0.00 0.00 43.02 39.91 1wix s PHE 21 CO 0.52 -1.28 0.94 0.36 0.70 0.00 0.00 175.22 176.45 1wix n LYS 22 N 6.86 1.53 -0.95 0.44 2.85 -1.26 -4.84 118.16 122.79 1wix n LYS 22 Ca -0.04 -0.60 -0.37 0.00 -1.05 0.00 0.00 58.31 56.25 1wix n LYS 22 Cb 0.45 -1.46 0.06 0.00 -0.65 0.00 0.00 35.03 33.43 1wix n LYS 22 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1wix n THR 23 N 0.15 0.00 -0.52 0.58 -2.24 -1.26 -4.66 114.28 106.33 1wix n THR 23 Ca 0.08 -0.22 0.44 0.00 -2.27 0.00 0.00 64.05 62.08 1wix n THR 23 Cb 0.57 -0.11 0.77 0.00 -2.10 0.00 0.00 70.33 69.46 1wix n THR 23 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wix h ALA 24 N -1.16 3.42 -3.21 6.98 0.00 -1.97 -3.35 119.26 119.97 1wix h ALA 24 Ca -0.43 -0.04 -0.62 0.00 0.00 0.00 0.00 54.91 53.82 1wix h ALA 24 Cb 1.35 0.13 -0.17 0.00 0.00 0.00 0.00 17.79 19.10 1wix h ALA 24 CO 0.25 -1.90 -0.57 -1.12 0.00 0.00 0.00 179.25 175.91 1wix s SER 25 N -4.49 5.58 1.07 0.00 0.01 -1.26 -5.10 113.70 109.51 1wix s SER 25 Ca -0.05 0.03 -0.06 0.00 1.31 0.00 0.00 55.95 57.18 1wix s SER 25 Cb 0.26 -1.97 0.09 0.00 0.21 0.00 0.00 66.02 64.60 1wix s SER 25 CO 0.85 0.13 0.31 -0.81 0.41 0.00 0.00 173.24 174.13 1wix n PRO 26 N 3.83 -1.61 -3.15 12.44 -0.04 -1.26 -4.71 135.00 140.51 1wix n PRO 26 Ca -0.16 -0.49 0.04 0.00 -0.04 0.00 0.00 63.50 62.85 1wix n PRO 26 Cb 0.52 -0.46 -0.01 0.00 -0.04 0.00 0.00 33.50 33.52 1wix n PRO 26 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wix n GLN 28 N 5.38 0.00 -3.97 0.00 1.13 -1.26 -4.72 117.38 113.94 1wix n GLN 28 Ca 0.02 0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 54.85 1wix n GLN 28 Cb 0.54 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.86 1wix n GLN 28 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1wix s ASP 29 N -4.04 6.26 0.47 1.08 2.15 -1.26 -4.93 116.67 116.40 1wix s ASP 29 Ca 0.00 0.07 0.16 0.00 0.43 0.00 0.00 52.55 53.21 1wix s ASP 29 Cb 0.00 -1.84 1.13 0.00 -0.30 0.00 0.00 42.92 41.91 1wix s ASP 29 CO 0.00 -0.04 2.03 -0.37 -0.17 0.00 0.00 175.17 176.63 1wix h VAL 30 N 1.32 0.92 0.00 1.11 -1.51 -1.96 0.27 116.25 116.39 1wix h VAL 30 Ca -0.51 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 64.87 1wix h VAL 30 Cb 1.22 0.63 0.00 0.00 -2.13 0.00 0.00 31.29 31.01 1wix h VAL 30 CO 0.63 0.05 0.00 0.29 -1.23 0.00 0.00 177.57 177.31 1wix n LYS 31 N -4.47 0.08 -0.04 5.19 4.76 -1.26 -1.94 118.16 120.49 1wix n LYS 31 Ca 0.06 0.16 -0.03 0.00 -2.87 0.00 0.00 58.31 55.63 1wix n LYS 31 Cb 0.31 -1.50 -0.14 0.00 -1.84 0.00 0.00 35.03 31.87 1wix n LYS 31 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1wix n GLN 32 N -1.43 0.66 0.03 1.97 6.02 0.94 -4.28 117.38 121.29 1wix n GLN 32 Ca 0.06 0.05 -0.03 0.00 -0.01 0.00 0.00 57.00 57.06 1wix n GLN 32 Cb 0.20 -1.63 -0.09 0.00 1.02 0.00 0.00 30.24 29.74 1wix n GLN 32 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1wix h LEU 33 N 0.00 0.00 -1.66 1.08 -0.00 -1.24 -3.35 115.31 110.15 1wix h LEU 33 Ca -0.31 0.00 0.52 0.00 -0.00 0.00 0.00 57.88 58.09 1wix h LEU 33 Cb 1.80 0.00 -0.11 0.00 -0.00 0.00 0.00 40.66 42.35 1wix h LEU 33 CO 0.03 0.77 1.13 0.71 -0.00 0.00 0.00 178.44 181.08 1wix h THR 34 N 0.00 0.01 -0.72 0.22 1.35 -1.57 0.62 112.91 112.82 1wix h THR 34 Ca -0.15 -0.00 0.15 0.00 -0.55 0.00 0.00 66.41 65.85 1wix h THR 34 Cb 1.72 0.00 -0.10 0.00 -1.73 0.00 0.00 68.15 68.04 1wix h THR 34 CO 0.07 0.00 0.21 -0.55 -0.25 0.00 0.00 175.52 175.00 1wix h ASN 35 N 0.00 0.09 0.00 5.36 -1.07 -1.84 -3.45 115.58 114.68 1wix h ASN 35 Ca 0.91 0.13 0.00 0.00 0.07 0.00 0.00 56.30 57.41 1wix h ASN 35 Cb 3.26 0.15 0.00 0.00 -2.07 0.00 0.00 38.32 39.67 1wix h ASN 35 CO -0.27 0.01 0.00 0.61 0.07 0.00 0.00 177.43 177.85 1wix n GLY 36 N -1.34 3.07 0.27 9.14 0.00 0.22 -4.47 105.19 112.09 1wix n GLY 36 Ca 0.13 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.11 1wix n GLY 36 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1wix h VAL 37 N 0.00 0.33 0.25 1.61 2.07 -1.81 0.53 116.25 119.24 1wix h VAL 37 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1wix h VAL 37 Cb 0.00 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.07 1wix h VAL 37 CO 0.00 0.00 -0.36 0.74 0.02 0.00 0.00 177.57 177.97 1wix h THR 38 N -0.10 0.25 -0.86 2.57 2.02 -1.86 0.60 112.91 115.53 1wix h THR 38 Ca 0.24 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.57 1wix h THR 38 Cb 0.48 0.25 -0.10 0.00 -1.74 0.00 0.00 68.15 67.04 1wix h THR 38 CO -0.58 0.00 0.44 0.24 0.37 0.00 0.00 175.52 175.99 1wix h MET 39 N -0.68 0.59 0.50 6.66 2.86 -1.70 0.14 114.93 123.31 1wix h MET 39 Ca -0.00 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 1wix h MET 39 Cb 0.65 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.18 1wix h MET 39 CO -0.13 0.39 -0.24 0.00 1.06 0.00 0.00 176.91 177.99 1wix h ALA 40 N 1.57 -0.67 -0.65 6.32 0.00 -0.31 -1.87 119.26 123.65 1wix h ALA 40 Ca 0.47 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.28 1wix h ALA 40 Cb 0.69 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.67 1wix h ALA 40 CO -0.37 -0.80 0.32 1.96 0.00 0.00 0.00 179.25 180.36 1wix h GLN 41 N -0.82 0.56 -0.66 0.00 4.20 -0.32 -0.99 115.11 117.08 1wix h GLN 41 Ca -0.07 -0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.64 1wix h GLN 41 Cb 0.58 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.20 1wix h GLN 41 CO 0.11 0.37 0.44 0.28 -0.67 0.00 0.00 178.83 179.36 1wix h VAL 42 N 0.57 1.09 -0.80 -0.54 2.07 -0.67 -1.92 116.25 116.05 1wix h VAL 42 Ca 0.31 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 67.51 1wix h VAL 42 Cb 0.29 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 1wix h VAL 42 CO -0.24 0.14 0.32 -0.07 0.02 0.00 0.00 177.57 177.75 1wix h LEU 43 N 0.79 1.11 -2.02 2.57 3.38 -0.32 -2.15 115.31 118.66 1wix h LEU 43 Ca 0.26 -0.17 0.06 0.00 0.09 0.00 0.00 57.88 58.12 1wix h LEU 43 Cb 0.07 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1wix h LEU 43 CO -0.07 0.98 0.15 -0.74 0.09 0.00 0.00 178.44 178.85 1wix h HIS 44 N 1.17 0.00 0.00 1.13 2.76 -0.99 0.20 115.15 119.42 1wix h HIS 44 Ca 0.27 0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 58.29 1wix h HIS 44 Cb 0.22 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.16 1wix h HIS 44 CO 0.02 0.00 -0.69 1.96 -1.30 0.00 0.00 177.93 177.92 1wix h GLN 45 N 0.00 0.00 -0.05 5.26 4.20 -1.34 -3.19 115.11 120.00 1wix h GLN 45 Ca 0.10 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 1wix h GLN 45 Cb 0.40 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.18 1wix h GLN 45 CO -0.00 0.69 -0.06 0.82 -0.67 0.00 0.00 178.83 179.60 1wix h ILE 46 N 0.00 1.40 -1.72 2.54 2.04 -0.79 -3.44 117.51 117.55 1wix h ILE 46 Ca -0.01 -1.29 -0.13 0.00 1.00 0.00 0.00 64.86 64.43 1wix h ILE 46 Cb 1.36 2.16 -0.28 0.00 -0.74 0.00 0.00 36.82 39.32 1wix h ILE 46 CO 0.09 0.35 -0.47 -0.62 0.00 0.00 0.00 178.15 177.50 1wix s ASP 47 N -5.89 0.07 0.04 1.72 -1.08 -0.94 -4.54 116.67 106.06 1wix s ASP 47 Ca -0.15 0.09 -0.27 0.00 -0.52 0.00 0.00 52.55 51.70 1wix s ASP 47 Cb 0.03 1.25 -0.17 0.00 -1.46 0.00 0.00 42.92 42.56 1wix s ASP 47 CO 0.70 -0.31 1.45 0.58 0.52 0.00 0.00 175.17 178.11 1wix h VAL 48 N 6.15 0.66 -0.96 1.11 2.07 -1.71 0.83 116.25 124.40 1wix h VAL 48 Ca -0.16 -0.32 0.29 0.00 0.82 0.00 0.00 66.70 67.33 1wix h VAL 48 Cb 1.15 0.83 -0.17 0.00 -1.52 0.00 0.00 31.29 31.57 1wix h VAL 48 CO 0.27 0.06 0.15 0.00 0.02 0.00 0.00 177.57 178.07 1wix h ALA 49 N -0.07 1.35 0.01 1.67 0.00 -1.96 0.51 119.26 120.75 1wix h ALA 49 Ca -0.05 0.31 -0.27 0.00 0.00 0.00 0.00 54.91 54.90 1wix h ALA 49 Cb 0.47 0.50 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 1wix h ALA 49 CO 0.08 -0.61 -1.51 2.35 0.00 0.00 0.00 179.25 179.56 1wix h TRP 50 N 0.05 0.02 -2.57 0.00 2.91 -1.94 -3.40 115.95 111.01 1wix h TRP 50 Ca 0.63 -0.02 -0.60 0.00 1.13 0.00 0.00 58.89 60.03 1wix h TRP 50 Cb 1.37 -0.00 -0.40 0.00 -0.51 0.00 0.00 29.16 29.61 1wix h TRP 50 CO -0.37 1.03 -0.76 1.19 -1.03 0.00 0.00 178.44 178.49 1wix n PHE 51 N -3.15 1.69 -3.30 2.65 3.72 0.29 -4.97 117.46 114.38 1wix n PHE 51 Ca -0.12 -3.91 -0.24 0.00 -0.05 0.00 0.00 57.45 53.13 1wix n PHE 51 Cb 1.02 -0.33 -0.01 0.00 -0.94 0.00 0.00 39.48 39.22 1wix n PHE 51 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1wix s SER 52 N -1.20 6.27 0.63 4.37 0.15 0.93 -4.15 113.70 120.71 1wix s SER 52 Ca 0.31 0.48 0.18 0.00 0.70 0.00 0.00 55.95 57.62 1wix s SER 52 Cb 0.04 -2.02 0.76 0.00 -1.71 0.00 0.00 66.02 63.10 1wix s SER 52 CO -0.14 -0.34 1.36 -0.33 1.20 0.00 0.00 173.24 174.99 1wix h GLU 53 N 0.69 0.00 -0.32 5.44 5.08 -1.96 0.66 114.58 124.18 1wix h GLU 53 Ca -0.49 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.83 1wix h GLU 53 Cb 1.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 1wix h GLU 53 CO 0.61 0.00 0.04 1.03 -1.00 0.00 0.00 179.01 179.69 1wix h SER 54 N 0.00 0.52 0.22 1.42 0.87 -1.96 -0.99 113.55 113.62 1wix h SER 54 Ca 0.21 -0.27 -0.01 0.00 -1.23 0.00 0.00 61.79 60.48 1wix h SER 54 Cb 2.04 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 63.86 1wix h SER 54 CO -0.00 0.66 -0.10 -0.25 -0.53 0.00 0.00 176.83 176.60 1wix h TRP 55 N 0.36 -0.27 0.00 2.24 7.01 -0.02 -3.10 115.95 122.17 1wix h TRP 55 Ca 0.09 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.09 1wix h TRP 55 Cb 0.37 0.09 0.00 0.00 -2.10 0.00 0.00 29.16 27.52 1wix h TRP 55 CO 0.03 0.12 0.12 1.25 -2.79 0.00 0.00 178.44 177.17 1wix h LEU 56 N -0.86 0.00 -0.28 0.65 5.85 -1.57 0.15 115.31 119.25 1wix h LEU 56 Ca -0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1wix h LEU 56 Cb 0.51 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.54 1wix h LEU 56 CO 0.05 0.00 0.00 -1.20 -0.34 0.00 0.00 178.44 176.95 1wix n SER 57 N -2.84 0.26 -0.06 1.25 7.64 -0.38 -1.71 113.62 117.78 1wix n SER 57 Ca -0.02 0.57 0.12 0.00 1.01 0.00 0.00 58.87 60.54 1wix n SER 57 Cb 0.18 -0.62 0.21 0.00 -1.01 0.00 0.00 64.21 62.97 1wix n SER 57 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1wix n ARG 58 N -1.79 0.19 -3.39 1.43 5.12 0.52 -4.89 116.66 113.85 1wix n ARG 58 Ca 0.03 -0.12 -0.38 0.00 -1.93 0.00 0.00 57.85 55.45 1wix n ARG 58 Cb 0.19 -1.50 -0.06 0.00 -1.16 0.00 0.00 32.46 29.93 1wix n ARG 58 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1wix s ILE 59 N -2.89 4.88 0.39 0.55 -1.09 -0.70 -4.97 121.20 117.37 1wix s ILE 59 Ca 0.13 0.98 0.08 0.00 -2.23 0.00 0.00 60.65 59.61 1wix s ILE 59 Cb 0.18 -3.79 -0.06 0.00 -1.58 0.00 0.00 42.46 37.21 1wix s ILE 59 CO 0.69 0.50 0.12 -0.54 -1.23 0.00 0.00 174.94 174.48 1wix s LYS 60 N -1.27 2.17 0.00 2.79 1.02 -1.26 -5.05 119.74 118.14 1wix s LYS 60 Ca 0.29 -1.83 0.00 0.00 0.02 0.00 0.00 55.97 54.44 1wix s LYS 60 Cb -0.17 -1.94 0.00 0.00 -0.52 0.00 0.00 37.83 35.19 1wix s LYS 60 CO 0.17 -0.03 0.08 -3.47 -0.92 0.00 0.00 175.35 171.17 1wix n ASP 61 N -1.13 0.15 0.08 2.83 2.03 -1.26 -4.58 116.55 114.66 1wix n ASP 61 Ca -0.02 -0.51 0.05 0.00 0.52 0.00 0.00 54.79 54.83 1wix n ASP 61 Cb 0.64 0.61 0.24 0.00 -0.72 0.00 0.00 41.12 41.89 1wix n ASP 61 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1wix n ASP 62 N -0.61 0.23 -0.20 1.67 8.00 -1.26 -2.55 116.55 121.83 1wix n ASP 62 Ca 0.00 0.57 0.30 0.00 0.71 0.00 0.00 54.79 56.37 1wix n ASP 62 Cb 0.01 -0.59 0.60 0.00 -0.02 0.00 0.00 41.12 41.13 1wix n ASP 62 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 1wix h VAL 63 N 0.00 0.14 -0.67 2.53 -1.51 -1.84 -2.29 116.25 112.62 1wix h VAL 63 Ca 0.00 0.00 0.12 0.00 -1.23 0.00 0.00 66.70 65.59 1wix h VAL 63 Cb 0.13 0.22 -0.12 0.00 -2.13 0.00 0.00 31.29 29.39 1wix h VAL 63 CO 0.00 0.00 -0.21 0.61 -1.23 0.00 0.00 177.57 176.74 1wix n GLY 64 N -1.69 -1.24 0.23 5.19 0.00 -1.06 0.76 105.19 107.39 1wix n GLY 64 Ca 0.22 0.73 0.08 0.00 0.00 0.00 0.00 46.02 47.05 1wix n GLY 64 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wix n ASP 65 N -5.04 1.31 -4.38 1.61 8.00 -0.87 -4.93 116.55 112.25 1wix n ASP 65 Ca 0.09 -1.15 -0.33 0.00 0.71 0.00 0.00 54.79 54.11 1wix n ASP 65 Cb 0.30 0.67 -0.14 0.00 -0.02 0.00 0.00 41.12 41.93 1wix n ASP 65 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1wix s ASN 66 N -2.13 4.09 0.01 -2.24 0.01 0.23 -4.99 114.94 109.92 1wix s ASN 66 Ca 0.11 -0.31 0.18 0.00 -0.71 0.00 0.00 52.86 52.13 1wix s ASN 66 Cb 0.13 -1.63 -0.18 0.00 0.41 0.00 0.00 41.25 39.98 1wix s ASN 66 CO 0.50 0.16 0.65 -2.67 -1.51 0.00 0.00 177.10 174.23 1wix n TRP 67 N 3.55 0.66 -0.09 2.20 4.27 -1.26 -4.20 117.44 122.57 1wix n TRP 67 Ca -0.18 0.22 -0.15 0.00 -3.89 0.00 0.00 57.50 53.50 1wix n TRP 67 Cb 0.53 -0.98 -0.04 0.00 -1.36 0.00 0.00 31.31 29.46 1wix n TRP 67 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1wix h ARG 68 N 0.00 0.90 -0.01 -2.67 3.08 -1.94 -3.00 114.38 110.73 1wix h ARG 68 Ca -0.20 -0.54 0.00 0.00 0.07 0.00 0.00 59.98 59.31 1wix h ARG 68 Cb 1.59 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.69 1wix h ARG 68 CO 0.03 1.18 0.01 0.82 -1.07 0.00 0.00 179.97 180.95 1wix h ILE 69 N 0.69 0.84 0.45 2.04 2.04 -1.94 -3.03 117.51 118.60 1wix h ILE 69 Ca 0.03 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 1wix h ILE 69 Cb 1.11 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 1wix h ILE 69 CO 0.12 0.00 -0.22 0.11 0.00 0.00 0.00 178.15 178.16 1wix h LYS 70 N 0.00 -0.58 -0.80 2.37 1.57 -1.69 -3.08 116.57 114.36 1wix h LYS 70 Ca 0.01 0.04 0.12 0.00 -1.87 0.00 0.00 60.65 58.94 1wix h LYS 70 Cb 0.03 0.13 -0.13 0.00 0.08 0.00 0.00 32.23 32.34 1wix h LYS 70 CO -0.00 -0.39 -0.43 0.00 -0.57 0.00 0.00 179.45 178.07 1wix h ALA 71 N -1.72 -0.13 -0.98 3.86 0.00 -1.62 0.31 119.26 118.98 1wix h ALA 71 Ca -0.06 0.18 0.32 0.00 0.00 0.00 0.00 54.91 55.35 1wix h ALA 71 Cb 0.46 1.02 -0.18 0.00 0.00 0.00 0.00 17.79 19.09 1wix h ALA 71 CO 0.10 -0.75 0.22 0.43 0.00 0.00 0.00 179.25 179.25 1wix n SER 72 N -5.41 0.06 0.10 0.00 7.64 -1.18 -0.76 113.62 114.06 1wix n SER 72 Ca 0.05 1.64 -0.09 0.00 1.01 0.00 0.00 58.87 61.48 1wix n SER 72 Cb 0.36 -0.68 -0.06 0.00 -1.01 0.00 0.00 64.21 62.82 1wix n SER 72 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1wix h ASN 73 N 0.00 -0.28 -1.03 6.43 2.35 -0.35 -3.20 115.58 119.50 1wix h ASN 73 Ca 0.69 -0.20 0.42 0.00 -0.55 0.00 0.00 56.30 56.65 1wix h ASN 73 Cb 1.60 0.07 -0.17 0.00 0.05 0.00 0.00 38.32 39.87 1wix h ASN 73 CO -0.85 0.23 0.57 -0.07 -1.65 0.00 0.00 177.43 175.65 1wix h LEU 74 N -0.97 0.33 0.86 1.61 3.38 0.14 0.21 115.31 120.86 1wix h LEU 74 Ca -0.03 0.25 -0.04 0.00 0.09 0.00 0.00 57.88 58.14 1wix h LEU 74 Cb 0.47 0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.47 1wix h LEU 74 CO 0.06 -0.40 -0.41 0.11 0.09 0.00 0.00 178.44 177.88 1wix h LYS 75 N 0.03 -1.11 -0.27 1.13 6.56 -1.18 -1.96 116.57 119.77 1wix h LYS 75 Ca 0.84 0.08 0.06 0.00 -1.06 0.00 0.00 60.65 60.57 1wix h LYS 75 Cb 2.25 0.25 -0.06 0.00 -0.57 0.00 0.00 32.23 34.10 1wix h LYS 75 CO -0.73 -0.74 -0.16 0.87 -2.06 0.00 0.00 179.45 176.64 1wix h LYS 76 N -1.22 -0.13 -0.99 3.15 1.57 -0.66 0.12 116.57 118.41 1wix h LYS 76 Ca -0.12 0.01 0.20 0.00 -1.87 0.00 0.00 60.65 58.87 1wix h LYS 76 Cb 0.89 0.03 -0.10 0.00 0.08 0.00 0.00 32.23 33.13 1wix h LYS 76 CO 0.19 -0.08 0.62 0.28 -0.57 0.00 0.00 179.45 179.89 1wix h VAL 77 N -0.13 0.67 0.30 0.50 2.07 -1.12 0.22 116.25 118.76 1wix h VAL 77 Ca 0.14 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1wix h VAL 77 Cb 0.35 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 1wix h VAL 77 CO -0.35 0.12 -0.14 0.25 0.02 0.00 0.00 177.57 177.47 1wix h LEU 78 N 0.64 -0.34 -1.29 2.57 5.85 -0.33 -3.18 115.31 119.23 1wix h LEU 78 Ca 0.56 0.01 0.27 0.00 0.84 0.00 0.00 57.88 59.56 1wix h LEU 78 Cb 1.04 0.09 -0.10 0.00 0.37 0.00 0.00 40.66 42.05 1wix h LEU 78 CO -0.33 -0.03 0.66 -0.74 -0.34 0.00 0.00 178.44 177.66 1wix h HIS 79 N -0.81 0.72 -0.24 1.25 2.76 -0.74 0.45 115.15 118.53 1wix h HIS 79 Ca -0.04 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.17 1wix h HIS 79 Cb 0.31 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.05 1wix h HIS 79 CO 0.03 0.04 0.16 0.78 -1.30 0.00 0.00 177.93 177.65 1wix h GLY 80 N 0.41 0.29 0.00 5.26 0.00 -0.63 -1.39 103.07 107.02 1wix h GLY 80 Ca 0.62 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.83 1wix h GLY 80 CO -0.34 0.10 -0.28 -2.22 0.00 0.00 0.00 176.54 173.80 1wix h ILE 81 N 0.27 0.10 -0.67 2.60 2.04 -0.13 -3.24 117.51 118.49 1wix h ILE 81 Ca 0.10 -1.09 0.13 0.00 1.00 0.00 0.00 64.86 64.99 1wix h ILE 81 Cb 0.05 0.20 -0.13 0.00 -0.74 0.00 0.00 36.82 36.21 1wix h ILE 81 CO -0.02 0.03 -0.26 0.71 0.00 0.00 0.00 178.15 178.62 1wix h THR 82 N -1.00 0.22 -0.99 -0.27 1.35 -1.30 0.26 112.91 111.18 1wix h THR 82 Ca -0.01 0.00 0.09 0.00 -0.55 0.00 0.00 66.41 65.94 1wix h THR 82 Cb 0.31 0.22 -0.08 0.00 -1.73 0.00 0.00 68.15 66.88 1wix h THR 82 CO -0.01 0.00 0.63 0.28 -0.25 0.00 0.00 175.52 176.17 1wix h SER 83 N -0.08 0.96 0.29 5.36 0.02 -1.44 0.25 113.55 118.91 1wix h SER 83 Ca 0.29 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 1wix h SER 83 Cb 0.54 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.91 1wix h SER 83 CO -0.72 0.56 0.00 0.00 -1.14 0.00 0.00 176.83 175.54 1wix n TYR 84 N -4.57 0.31 -0.06 3.45 9.36 0.86 0.24 117.16 126.73 1wix n TYR 84 Ca 0.17 0.14 -0.10 0.00 3.32 0.00 0.00 57.90 61.42 1wix n TYR 84 Cb 0.26 -0.73 -0.15 0.00 -0.63 0.00 0.00 39.34 38.10 1wix n TYR 84 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1wix n TYR 85 N -1.80 0.48 -0.00 2.98 4.01 0.82 -2.55 117.16 121.11 1wix n TYR 85 Ca 0.01 0.17 -0.04 0.00 -0.16 0.00 0.00 57.90 57.88 1wix n TYR 85 Cb 0.10 -1.09 -0.11 0.00 -0.31 0.00 0.00 39.34 37.93 1wix n TYR 85 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1wix n HIS 86 N -2.94 0.91 0.00 -0.72 8.25 -0.69 0.13 115.22 120.17 1wix n HIS 86 Ca -0.27 0.32 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1wix n HIS 86 Cb 1.10 -1.11 0.00 0.00 1.12 0.00 0.00 29.99 31.10 1wix n HIS 86 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1wix n GLU 87 N -2.93 0.00 0.00 -0.41 1.02 0.14 -3.63 120.64 114.83 1wix n GLU 87 Ca -0.14 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 1wix n GLU 87 Cb 0.95 -0.60 0.00 0.00 -0.02 0.00 0.00 31.44 31.77 1wix n GLU 87 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1wix n PHE 88 N -2.36 0.00 0.08 -0.32 7.35 -1.16 -3.86 117.46 117.20 1wix n PHE 88 Ca 0.00 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.60 1wix n PHE 88 Cb 0.00 -0.42 -0.06 0.00 0.35 0.00 0.00 39.48 39.35 1wix n PHE 88 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1wix h LEU 89 N 0.00 -0.25 0.00 -2.13 3.38 -1.62 -3.49 115.31 111.20 1wix h LEU 89 Ca 0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1wix h LEU 89 Cb 0.00 0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1wix h LEU 89 CO 0.00 0.27 0.00 0.61 0.09 0.00 0.00 178.44 179.41 1wix n GLY 90 N 0.68 1.94 3.75 0.83 0.00 0.28 -4.97 105.19 107.70 1wix n GLY 90 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 1wix n GLY 90 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1wix s GLN 91 N 0.00 0.15 0.29 1.61 -2.07 0.34 -4.53 119.66 115.45 1wix s GLN 91 Ca 0.00 -0.02 0.01 0.00 -1.82 0.00 0.00 55.36 53.53 1wix s GLN 91 Cb 0.00 -1.75 0.01 0.00 -1.09 0.00 0.00 33.01 30.18 1wix s GLN 91 CO 0.00 -2.81 0.07 0.00 -1.32 0.00 0.00 175.29 171.23 1wix n GLN 92 N -4.13 1.24 -4.74 9.60 10.64 -1.26 -1.70 117.38 127.03 1wix n GLN 92 Ca 0.11 -2.01 -0.25 0.00 -1.83 0.00 0.00 57.00 53.02 1wix n GLN 92 Cb 0.59 0.44 -0.16 0.00 -0.86 0.00 0.00 30.24 30.26 1wix n GLN 92 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 1wix s ILE 93 N -1.86 1.30 0.38 -0.39 1.01 -1.26 -4.33 121.20 116.05 1wix s ILE 93 Ca 0.05 -0.63 -0.16 0.00 0.00 0.00 0.00 60.65 59.90 1wix s ILE 93 Cb -0.00 -1.13 -0.09 0.00 0.01 0.00 0.00 42.46 41.25 1wix s ILE 93 CO 0.03 0.38 0.82 -0.44 0.00 0.00 0.00 174.94 175.73 1wix s SER 94 N 0.15 6.79 0.39 3.58 0.01 -1.26 -4.92 113.70 118.44 1wix s SER 94 Ca -0.05 1.41 0.18 0.00 1.31 0.00 0.00 55.95 58.79 1wix s SER 94 Cb -0.12 -2.43 0.97 0.00 0.21 0.00 0.00 66.02 64.66 1wix s SER 94 CO 0.02 -0.30 1.48 -0.33 0.41 0.00 0.00 173.24 174.52 1wix h GLU 95 N 1.95 0.00 0.00 12.44 5.08 -2.00 0.34 114.58 132.39 1wix h GLU 95 Ca -0.48 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 57.78 1wix h GLU 95 Cb 1.18 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 1wix h GLU 95 CO 0.64 0.00 -0.46 0.93 -1.00 0.00 0.00 179.01 179.12 1wix h GLU 96 N 0.00 0.00 0.00 2.33 4.39 -2.03 -3.15 114.58 116.12 1wix h GLU 96 Ca 0.00 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.42 1wix h GLU 96 Cb 0.52 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.11 1wix h GLU 96 CO 0.00 0.46 -1.97 1.28 -1.16 0.00 0.00 179.01 177.61 1wix n LEU 97 N -3.74 0.43 -4.48 1.33 4.77 0.12 -4.89 117.00 110.55 1wix n LEU 97 Ca -0.01 0.20 -0.47 0.00 -0.03 0.00 0.00 56.01 55.71 1wix n LEU 97 Cb 0.52 0.28 -0.07 0.00 -2.33 0.00 0.00 43.42 41.82 1wix n LEU 97 CO 0.39 0.37 1.89 -0.38 -1.33 0.00 0.00 177.39 178.33 1wix n ILE 98 N -2.84 0.13 -2.22 -0.08 2.08 -1.00 -4.77 119.36 110.66 1wix n ILE 98 Ca -0.22 -0.33 -0.42 0.00 0.56 0.00 0.00 62.75 62.35 1wix n ILE 98 Cb 1.03 -1.75 -0.03 0.00 -0.75 0.00 0.00 39.64 38.14 1wix n ILE 98 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1wix s PRO 99 N 6.91 4.38 -0.81 0.38 0.04 -1.26 -4.96 135.00 139.67 1wix s PRO 99 Ca 1.10 2.04 -0.24 0.00 0.04 0.00 0.00 61.00 63.94 1wix s PRO 99 Cb -0.76 -3.22 0.06 0.00 0.04 0.00 0.00 34.50 30.62 1wix s PRO 99 CO 0.44 -0.30 1.22 -0.51 0.04 0.00 0.00 177.00 177.90 1wix s ASP 100 N 0.57 6.30 0.06 6.66 1.01 -1.26 -4.86 116.67 125.14 1wix s ASP 100 Ca 0.59 -1.02 -0.19 0.00 0.71 0.00 0.00 52.55 52.63 1wix s ASP 100 Cb -0.36 -2.51 -0.12 0.00 1.01 0.00 0.00 42.92 40.95 1wix s ASP 100 CO 0.36 -1.56 1.41 -0.07 0.21 0.00 0.00 175.17 175.52 1wix h LEU 101 N 12.21 0.41 -1.30 1.23 3.38 -1.93 -2.20 115.31 127.11 1wix h LEU 101 Ca -0.12 -0.41 0.17 0.00 0.09 0.00 0.00 57.88 57.61 1wix h LEU 101 Cb 1.04 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 41.60 1wix h LEU 101 CO 1.27 0.74 0.59 0.78 0.09 0.00 0.00 178.44 181.91 1wix h ASN 102 N 0.09 0.61 0.90 -0.43 2.35 -1.99 0.66 115.58 117.77 1wix h ASN 102 Ca 0.04 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1wix h ASN 102 Cb 0.58 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.89 1wix h ASN 102 CO 0.03 0.27 -0.21 1.67 -1.65 0.00 0.00 177.43 177.53 1wix n GLN 103 N -4.59 0.06 -0.04 0.81 7.27 -1.15 -2.03 117.38 117.73 1wix n GLN 103 Ca 0.19 0.04 -0.02 0.00 0.07 0.00 0.00 57.00 57.28 1wix n GLN 103 Cb 0.56 -1.56 -0.14 0.00 2.41 0.00 0.00 30.24 31.51 1wix n GLN 103 CO 0.00 0.00 0.00 -0.89 0.07 0.00 0.00 177.06 176.24 1wix n ILE 104 N -1.66 0.97 -0.03 1.69 5.41 0.18 0.31 119.36 126.23 1wix n ILE 104 Ca 0.06 -0.71 -0.06 0.00 1.00 0.00 0.00 62.75 63.03 1wix n ILE 104 Cb 0.36 -0.44 -0.13 0.00 -0.71 0.00 0.00 39.64 38.72 1wix n ILE 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1wix n THR 105 N -2.67 1.40 -0.08 1.39 -1.04 0.16 -2.22 114.28 111.23 1wix n THR 105 Ca -0.18 -0.77 -0.17 0.00 -2.04 0.00 0.00 64.05 60.89 1wix n THR 105 Cb 0.91 -0.80 -0.13 0.00 -1.82 0.00 0.00 70.33 68.49 1wix n THR 105 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1wix n GLU 106 N -2.91 0.69 -0.07 -2.82 1.02 -0.86 -4.71 120.64 110.98 1wix n GLU 106 Ca -0.18 0.17 -0.12 0.00 -0.02 0.00 0.00 57.16 57.01 1wix n GLU 106 Cb 1.01 -1.60 -0.06 0.00 -0.02 0.00 0.00 31.44 30.77 1wix n GLU 106 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wix n ALA 108 N -3.13 -0.18 -1.62 0.00 0.00 0.15 -4.93 120.51 110.80 1wix n ALA 108 Ca -0.27 0.08 -0.42 0.00 0.00 0.00 0.00 53.44 52.83 1wix n ALA 108 Cb 0.76 -1.10 0.01 0.00 0.00 0.00 0.00 19.45 19.12 1wix n ALA 108 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1wix n ASP 109 N 0.64 1.50 0.02 0.00 2.03 -1.15 -4.79 116.55 114.79 1wix n ASP 109 Ca -0.08 1.08 -0.06 0.00 0.52 0.00 0.00 54.79 56.24 1wix n ASP 109 Cb 0.45 -1.37 0.12 0.00 -0.72 0.00 0.00 41.12 39.61 1wix n ASP 109 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1wix h PRO 110 N 1.75 0.48 -0.79 -0.67 0.13 -1.93 0.02 132.00 130.99 1wix h PRO 110 Ca -0.44 -0.25 -0.03 0.00 -0.87 0.00 0.00 66.00 64.41 1wix h PRO 110 Cb 1.33 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.43 1wix h PRO 110 CO 0.58 0.83 0.38 0.28 -0.23 0.00 0.00 178.00 179.84 1wix h VAL 111 N 0.39 1.24 0.13 1.56 2.07 -1.95 -2.51 116.25 117.18 1wix h VAL 111 Ca 0.03 -0.68 -0.24 0.00 0.82 0.00 0.00 66.70 66.62 1wix h VAL 111 Cb 0.93 0.23 0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1wix h VAL 111 CO 0.08 0.29 -1.18 -0.33 0.02 0.00 0.00 177.57 176.46 1wix h GLU 112 N 1.12 0.28 -0.80 1.57 4.39 -1.91 -3.32 114.58 115.91 1wix h GLU 112 Ca 0.27 -0.48 0.19 0.00 0.34 0.00 0.00 59.36 59.68 1wix h GLU 112 Cb 0.10 0.18 -0.13 0.00 -0.10 0.00 0.00 28.75 28.81 1wix h GLU 112 CO -0.04 1.23 0.17 1.25 -1.16 0.00 0.00 179.01 180.47 1wix h LEU 113 N -0.31 -0.05 -1.17 1.33 7.12 -0.93 0.22 115.31 121.52 1wix h LEU 113 Ca -0.24 0.17 -0.01 0.00 0.13 0.00 0.00 57.88 57.93 1wix h LEU 113 Cb 1.73 0.25 -0.03 0.00 -0.53 0.00 0.00 40.66 42.08 1wix h LEU 113 CO 0.11 -0.10 0.37 1.23 -0.13 0.00 0.00 178.44 179.91 1wix h GLY 114 N 0.22 1.00 -0.56 3.75 0.00 -1.58 -2.79 103.07 103.11 1wix h GLY 114 Ca 0.47 -0.44 0.22 0.00 0.00 0.00 0.00 47.33 47.58 1wix h GLY 114 CO -0.59 0.43 0.11 3.21 0.00 0.00 0.00 176.54 179.69 1wix h ARG 115 N 0.95 0.12 -0.01 4.80 2.47 -0.65 0.13 114.38 122.18 1wix h ARG 115 Ca 0.24 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.95 1wix h ARG 115 Cb 0.03 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.33 1wix h ARG 115 CO -0.04 0.08 0.00 1.25 0.56 0.00 0.00 179.97 181.82 1wix h LEU 116 N 0.12 0.01 -1.43 3.04 5.85 -1.52 -2.77 115.31 118.62 1wix h LEU 116 Ca 0.52 -0.24 0.14 0.00 0.84 0.00 0.00 57.88 59.14 1wix h LEU 116 Cb 1.03 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.99 1wix h LEU 116 CO -0.73 0.25 0.53 -0.07 -0.34 0.00 0.00 178.44 178.08 1wix h LEU 117 N -0.22 0.54 0.04 2.25 3.38 -0.90 -1.77 115.31 118.63 1wix h LEU 117 Ca 0.00 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1wix h LEU 117 Cb 0.24 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1wix h LEU 117 CO 0.00 0.29 -0.02 -0.61 0.09 0.00 0.00 178.44 178.19 1wix h GLN 118 N 0.58 -0.05 -0.97 1.13 4.15 -0.64 -1.22 115.11 118.09 1wix h GLN 118 Ca 0.40 0.00 0.13 0.00 0.77 0.00 0.00 58.65 59.95 1wix h GLN 118 Cb 0.72 0.01 -0.08 0.00 0.21 0.00 0.00 27.48 28.34 1wix h GLN 118 CO -0.16 0.10 0.61 -0.07 -1.93 0.00 0.00 178.83 177.38 1wix h LEU 119 N -0.18 0.83 -0.10 -2.39 3.38 -1.07 -0.18 115.31 115.60 1wix h LEU 119 Ca -0.01 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1wix h LEU 119 Cb 0.17 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1wix h LEU 119 CO 0.01 0.42 -0.05 0.40 0.09 0.00 0.00 178.44 179.32 1wix h ILE 120 N 0.88 1.32 0.00 1.22 2.04 -1.20 -2.81 117.51 118.96 1wix h ILE 120 Ca 0.49 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 65.30 1wix h ILE 120 Cb 0.59 1.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.47 1wix h ILE 120 CO -0.26 0.30 0.00 0.25 0.00 0.00 0.00 178.15 178.44 1wix h LEU 121 N -0.14 0.00 0.54 1.44 5.85 -0.43 -3.06 115.31 119.50 1wix h LEU 121 Ca 0.02 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1wix h LEU 121 Cb 0.49 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.53 1wix h LEU 121 CO 0.01 0.00 -0.26 1.23 -0.34 0.00 0.00 178.44 179.09 1wix h GLY 122 N 0.86 -0.75 2.00 3.75 0.00 -0.78 -2.97 103.07 105.18 1wix h GLY 122 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1wix h GLY 122 CO 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 176.54 176.27 1wix n ALA 124 N -1.63 2.45 0.14 0.00 0.00 -1.12 -3.13 120.51 117.23 1wix n ALA 124 Ca 0.00 -0.14 0.02 0.00 0.00 0.00 0.00 53.44 53.32 1wix n ALA 124 Cb 0.05 -1.48 -0.01 0.00 0.00 0.00 0.00 19.45 18.01 1wix n ALA 124 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1wix n VAL 125 N -1.30 0.00 -2.39 0.00 0.24 -0.07 -4.14 118.33 110.68 1wix n VAL 125 Ca 0.14 -0.44 -0.19 0.00 -2.04 0.00 0.00 64.34 61.80 1wix n VAL 125 Cb 0.24 1.02 0.02 0.00 -1.47 0.00 0.00 33.84 33.65 1wix n VAL 125 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1wix n ASN 126 N -0.78 3.85 -2.33 -1.34 0.23 -1.18 -4.95 115.26 108.75 1wix n ASN 126 Ca 0.01 -3.33 -0.11 0.00 -0.53 0.00 0.00 54.58 50.62 1wix n ASN 126 Cb 0.06 -0.43 -0.04 0.00 -2.08 0.00 0.00 39.78 37.29 1wix n ASN 126 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1wix h GLU 128 N 0.00 0.45 -0.00 0.00 4.11 -1.90 -3.21 114.58 114.03 1wix h GLU 128 Ca -0.14 -0.52 0.00 0.00 0.07 0.00 0.00 59.36 58.77 1wix h GLU 128 Cb 0.63 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1wix h GLU 128 CO 0.20 1.17 -0.09 1.63 0.07 0.00 0.00 179.01 181.99 1wix n LYS 129 N -4.13 0.56 -0.25 1.06 5.02 -1.26 -4.26 118.16 114.90 1wix n LYS 129 Ca -0.11 -0.15 0.02 0.00 -2.02 0.00 0.00 58.31 56.06 1wix n LYS 129 Cb 0.74 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 34.32 1wix n LYS 129 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1wix n LYS 130 N -1.09 -0.09 -0.16 1.97 2.85 -1.21 0.17 118.16 120.59 1wix n LYS 130 Ca 0.14 1.04 -0.03 0.00 -1.05 0.00 0.00 58.31 58.41 1wix n LYS 130 Cb 0.27 -1.55 0.04 0.00 -0.65 0.00 0.00 35.03 33.14 1wix n LYS 130 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 1wix h GLN 131 N 0.00 0.02 -0.48 -1.58 1.08 -1.80 0.43 115.11 112.78 1wix h GLN 131 Ca 0.29 -0.00 0.14 0.00 -1.45 0.00 0.00 58.65 57.63 1wix h GLN 131 Cb 0.46 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.87 1wix h GLN 131 CO -0.68 0.01 0.59 1.49 -0.95 0.00 0.00 178.83 179.30 1wix h GLU 132 N 0.02 0.00 0.02 1.46 4.57 0.15 -1.35 114.58 119.45 1wix h GLU 132 Ca 0.24 0.00 -0.35 0.00 -1.18 0.00 0.00 59.36 58.07 1wix h GLU 132 Cb 0.37 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.91 1wix h GLU 132 CO -0.49 0.00 -1.97 0.72 -1.18 0.00 0.00 179.01 176.09 1wix n HIS 133 N -3.50 0.56 -0.34 0.92 8.25 0.12 -4.28 115.22 116.95 1wix n HIS 133 Ca 0.09 0.21 0.32 0.00 -0.26 0.00 0.00 57.72 58.08 1wix n HIS 133 Cb 0.78 -1.06 0.59 0.00 1.12 0.00 0.00 29.99 31.42 1wix n HIS 133 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1wix h ILE 134 N -0.76 0.03 -0.61 1.59 5.03 0.56 1.65 117.51 125.00 1wix h ILE 134 Ca -0.52 -0.01 -0.06 0.00 -0.12 0.00 0.00 64.86 64.15 1wix h ILE 134 Cb 1.58 -0.00 -0.03 0.00 -3.03 0.00 0.00 36.82 35.34 1wix h ILE 134 CO -0.24 0.00 0.14 0.07 -0.68 0.00 0.00 178.15 177.45 1wix h LYS 135 N 0.03 0.95 -0.90 2.37 2.10 -1.67 -2.65 116.57 116.80 1wix h LYS 135 Ca 0.84 -0.21 0.01 0.00 -2.00 0.00 0.00 60.65 59.30 1wix h LYS 135 Cb 2.28 -0.13 -0.04 0.00 -0.90 0.00 0.00 32.23 33.44 1wix h LYS 135 CO -0.71 0.85 0.59 -0.97 -2.00 0.00 0.00 179.45 177.21 1wix h ASN 136 N 0.91 1.03 -0.62 7.07 -1.24 0.23 -2.26 115.58 120.69 1wix h ASN 136 Ca 0.19 -0.03 -0.00 0.00 0.71 0.00 0.00 56.30 57.18 1wix h ASN 136 Cb 0.33 -0.26 -0.03 0.00 0.73 0.00 0.00 38.32 39.10 1wix h ASN 136 CO 0.00 0.74 0.37 0.40 -1.29 0.00 0.00 177.43 177.65 1wix h ILE 137 N 1.21 1.18 -0.14 2.57 5.03 -1.14 -2.18 117.51 124.04 1wix h ILE 137 Ca 0.33 -0.41 -0.05 0.00 -0.12 0.00 0.00 64.86 64.61 1wix h ILE 137 Cb -0.13 0.34 -0.01 0.00 -3.03 0.00 0.00 36.82 33.98 1wix h ILE 137 CO -0.07 0.19 -0.14 0.24 -0.68 0.00 0.00 178.15 177.68 1wix h MET 138 N 0.84 0.22 0.00 2.37 2.86 -1.33 -1.46 114.93 118.42 1wix h MET 138 Ca 0.22 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1wix h MET 138 Cb -0.02 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.61 1wix h MET 138 CO -0.04 0.37 0.00 0.25 1.06 0.00 0.00 176.91 178.55 1wix n THR 139 N -4.27 0.00 -2.66 2.22 -2.24 -0.83 -4.80 114.28 101.71 1wix n THR 139 Ca -0.01 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.55 1wix n THR 139 Cb 0.27 -0.25 0.06 0.00 -2.10 0.00 0.00 70.33 68.32 1wix n THR 139 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1wix s LEU 140 N -1.29 3.16 0.22 3.22 1.43 -0.55 -5.05 118.68 119.81 1wix s LEU 140 Ca 0.11 -0.21 -0.30 0.00 -1.03 0.00 0.00 54.13 52.70 1wix s LEU 140 Cb 0.05 -2.45 -0.09 0.00 0.03 0.00 0.00 46.19 43.74 1wix s LEU 140 CO 0.09 -1.41 1.23 -0.70 0.23 0.00 0.00 176.35 175.78 1wix s GLU 141 N -4.88 4.46 0.03 1.70 2.12 -1.26 -4.67 118.70 116.20 1wix s GLU 141 Ca 0.61 1.96 -0.07 0.00 0.36 0.00 0.00 54.97 57.83 1wix s GLU 141 Cb -0.08 -3.20 -0.01 0.00 0.26 0.00 0.00 34.13 31.09 1wix s GLU 141 CO 0.40 -0.11 0.77 -1.91 -0.54 0.00 0.00 175.26 173.88 1wix n GLU 142 N 2.20 -0.09 -0.34 4.30 2.13 -1.26 0.23 120.64 127.81 1wix n GLU 142 Ca 0.04 0.77 0.22 0.00 0.66 0.00 0.00 57.16 58.85 1wix n GLU 142 Cb 0.44 -1.14 0.48 0.00 0.27 0.00 0.00 31.44 31.49 1wix n GLU 142 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 1wix h SER 143 N 0.00 0.50 0.48 4.31 0.02 -2.01 -1.70 113.55 115.15 1wix h SER 143 Ca 0.03 0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 1wix h SER 143 Cb 0.09 0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.67 1wix h SER 143 CO -0.20 0.06 -0.23 0.58 -1.14 0.00 0.00 176.83 175.90 1wix h VAL 144 N 0.42 0.19 -1.04 2.27 2.07 0.26 -3.16 116.25 117.25 1wix h VAL 144 Ca 0.64 -0.54 0.40 0.00 0.82 0.00 0.00 66.70 68.02 1wix h VAL 144 Cb 1.52 0.29 -0.14 0.00 -1.52 0.00 0.00 31.29 31.44 1wix h VAL 144 CO -0.38 0.04 0.62 0.00 0.02 0.00 0.00 177.57 177.87 1wix n GLN 145 N -5.22 -0.04 0.35 1.57 6.02 0.12 -0.18 117.38 120.00 1wix n GLN 145 Ca -0.09 1.18 -0.14 0.00 -0.01 0.00 0.00 57.00 57.94 1wix n GLN 145 Cb 0.29 -2.20 -0.07 0.00 1.02 0.00 0.00 30.24 29.28 1wix n GLN 145 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1wix h HIS 146 N 0.00 -0.84 -0.56 1.08 -0.00 -1.46 -0.11 115.15 113.26 1wix h HIS 146 Ca 0.77 -0.02 0.09 0.00 -0.00 0.00 0.00 60.37 61.21 1wix h HIS 146 Cb 2.24 0.28 -0.07 0.00 -0.00 0.00 0.00 27.41 29.86 1wix h HIS 146 CO -0.01 -0.52 0.18 0.28 -0.00 0.00 0.00 177.93 177.86 1wix h VAL 147 N -1.04 0.76 -0.96 5.26 2.07 -0.54 0.40 116.25 122.19 1wix h VAL 147 Ca -0.09 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.34 1wix h VAL 147 Cb 0.70 0.39 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 1wix h VAL 147 CO 0.15 0.06 0.63 0.58 0.02 0.00 0.00 177.57 179.01 1wix h VAL 148 N 0.34 1.20 -0.08 2.57 2.07 -0.94 -1.44 116.25 119.98 1wix h VAL 148 Ca 0.28 -0.43 -0.19 0.00 0.82 0.00 0.00 66.70 67.19 1wix h VAL 148 Cb 0.35 -0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 29.96 1wix h VAL 148 CO -0.31 0.23 -0.74 0.24 0.02 0.00 0.00 177.57 177.01 1wix h MET 149 N 1.25 0.41 0.76 1.57 2.86 0.18 -3.27 114.93 118.68 1wix h MET 149 Ca 0.37 -0.34 -0.04 0.00 -2.06 0.00 0.00 59.70 57.63 1wix h MET 149 Cb -0.06 0.07 0.01 0.00 0.06 0.00 0.00 31.60 31.68 1wix h MET 149 CO -0.10 0.99 -0.36 1.15 1.06 0.00 0.00 176.91 179.64 1wix h THR 150 N 0.28 0.20 -0.96 2.22 2.02 0.35 -2.70 112.91 114.32 1wix h THR 150 Ca -0.03 -0.11 0.31 0.00 0.77 0.00 0.00 66.41 67.34 1wix h THR 150 Cb 1.32 0.23 -0.16 0.00 -1.74 0.00 0.00 68.15 67.80 1wix h THR 150 CO 0.13 0.01 0.38 0.00 0.37 0.00 0.00 175.52 176.40 1wix h ALA 151 N -0.92 1.68 0.18 6.16 0.00 -1.38 0.20 119.26 125.18 1wix h ALA 151 Ca -0.10 0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1wix h ALA 151 Cb 0.79 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1wix h ALA 151 CO 0.17 -0.64 -0.09 0.82 0.00 0.00 0.00 179.25 179.52 1wix h ILE 152 N 0.16 0.84 -0.65 0.00 2.04 -1.56 -1.43 117.51 116.91 1wix h ILE 152 Ca 0.69 -0.08 0.11 0.00 1.00 0.00 0.00 64.86 66.59 1wix h ILE 152 Cb 1.58 0.89 -0.08 0.00 -0.74 0.00 0.00 36.82 38.47 1wix h ILE 152 CO -0.71 0.02 0.22 1.56 0.00 0.00 0.00 178.15 179.23 1wix h GLN 153 N -0.28 0.37 -0.84 2.37 1.08 -0.32 -0.62 115.11 116.87 1wix h GLN 153 Ca -0.02 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.12 1wix h GLN 153 Cb 0.22 -0.08 -0.04 0.00 -0.05 0.00 0.00 27.48 27.52 1wix h GLN 153 CO 0.04 0.24 0.40 1.49 -0.95 0.00 0.00 178.83 180.05 1wix h GLU 154 N 0.38 1.21 -0.65 1.46 4.81 -1.12 0.12 114.58 120.78 1wix h GLU 154 Ca 0.34 -0.18 0.07 0.00 -0.13 0.00 0.00 59.36 59.46 1wix h GLU 154 Cb 0.48 -0.22 -0.06 0.00 0.63 0.00 0.00 28.75 29.58 1wix h GLU 154 CO -0.36 0.93 0.34 -0.07 -0.73 0.00 0.00 179.01 179.11 1wix h LEU 155 N 1.20 0.47 0.05 1.64 3.38 -0.01 -0.69 115.31 121.35 1wix h LEU 155 Ca 0.29 0.04 -0.28 0.00 0.09 0.00 0.00 57.88 58.02 1wix h LEU 155 Cb 0.12 -0.04 0.02 0.00 0.09 0.00 0.00 40.66 40.85 1wix h LEU 155 CO -0.04 0.30 -1.16 0.24 0.09 0.00 0.00 178.44 177.87 1wix h MET 156 N 0.61 0.62 -0.45 1.13 2.86 -1.10 -2.98 114.93 115.62 1wix h MET 156 Ca 0.30 -0.77 0.07 0.00 -2.06 0.00 0.00 59.70 57.25 1wix h MET 156 Cb 0.25 0.24 -0.06 0.00 0.06 0.00 0.00 31.60 32.09 1wix h MET 156 CO -0.21 1.34 0.11 0.77 1.06 0.00 0.00 176.91 179.97 1wix h SER 157 N 0.30 0.05 -0.53 1.22 0.02 -0.31 -2.07 113.55 112.24 1wix h SER 157 Ca -0.16 0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 60.80 1wix h SER 157 Cb 1.82 0.09 -0.02 0.00 0.14 0.00 0.00 62.40 64.43 1wix h SER 157 CO 0.22 0.06 0.07 0.11 -1.14 0.00 0.00 176.83 176.15 1wix h LYS 158 N 0.25 0.88 -0.99 3.45 1.79 -1.22 -2.93 116.57 117.80 1wix h LYS 158 Ca 0.22 -0.25 0.35 0.00 -2.18 0.00 0.00 60.65 58.80 1wix h LYS 158 Cb 0.27 -0.10 -0.16 0.00 -1.58 0.00 0.00 32.23 30.66 1wix h LYS 158 CO -0.27 0.87 0.52 0.77 -1.08 0.00 0.00 179.45 180.26 1wix h SER 159 N 0.76 0.39 -5.00 0.86 0.02 -1.21 -3.44 113.55 105.94 1wix h SER 159 Ca 0.16 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 61.33 1wix h SER 159 Cb 0.43 0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.17 1wix h SER 159 CO 0.01 -0.25 0.00 0.61 -1.14 0.00 0.00 176.83 176.06 1wix n GLY 160 N -1.29 0.69 3.69 -3.77 0.00 -1.11 -4.34 105.19 99.06 1wix n GLY 160 Ca 0.33 -2.20 -0.29 0.00 0.00 0.00 0.00 46.02 43.86 1wix n GLY 160 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wix s PRO 161 N -1.06 0.69 0.17 1.61 0.04 -1.26 -4.90 135.00 130.28 1wix s PRO 161 Ca 0.00 0.62 -0.31 0.00 0.04 0.00 0.00 61.00 61.35 1wix s PRO 161 Cb 0.00 -1.76 -0.09 0.00 0.04 0.00 0.00 34.50 32.69 1wix s PRO 161 CO 0.00 -2.58 1.47 -1.12 0.04 0.00 0.00 177.00 174.81 1wix s SER 162 N -3.44 6.69 -0.30 6.66 0.01 -1.26 -4.99 113.70 117.08 1wix s SER 162 Ca 0.65 2.53 -0.04 0.00 1.31 0.00 0.00 55.95 60.40 1wix s SER 162 Cb -0.18 -2.60 0.19 0.00 0.21 0.00 0.00 66.02 63.63 1wix s SER 162 CO 0.57 -0.72 0.77 -0.44 0.41 0.00 0.00 173.24 173.83 1wix s SER 163 N 0.87 -1.08 0.00 2.44 0.01 -1.26 -5.26 113.70 109.42 1wix s SER 163 Ca 0.65 0.47 0.00 0.00 1.31 0.00 0.00 55.95 58.37 1wix s SER 163 Cb -0.41 1.82 0.00 0.00 0.21 0.00 0.00 66.02 67.64 1wix s SER 163 CO 0.34 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.40