#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 -0.06 -3.03 1.61 0.02 -2.06 -3.46 113.55 106.57 1wix h SER 2 Ca 0.00 -0.57 -0.48 0.00 -0.84 0.00 0.00 61.79 59.90 1wix h SER 2 Cb 0.00 0.01 0.02 0.00 0.14 0.00 0.00 62.40 62.57 1wix h SER 2 CO 0.00 0.58 -0.09 -0.94 -1.14 0.00 0.00 176.83 175.24 1wix s SER 3 N -5.76 6.25 -0.67 3.07 1.04 -1.26 -5.00 113.70 111.37 1wix s SER 3 Ca -0.15 0.58 -0.26 0.00 0.48 0.00 0.00 55.95 56.60 1wix s SER 3 Cb 0.00 -2.06 -0.02 0.00 0.10 0.00 0.00 66.02 64.04 1wix s SER 3 CO 0.61 -0.41 1.83 -0.83 0.98 0.00 0.00 173.24 175.42 1wix s GLY 4 N -4.07 0.26 -0.90 7.32 0.00 -1.26 -4.86 107.32 103.81 1wix s GLY 4 Ca 0.43 -0.87 -0.15 0.00 0.00 0.00 0.00 44.72 44.13 1wix s GLY 4 CO 0.39 3.37 2.21 -1.26 0.00 0.00 0.00 173.10 177.80 1wix n SER 5 N 12.66 -0.35 -3.86 1.64 2.88 -1.26 -1.78 113.62 123.54 1wix n SER 5 Ca 0.23 -0.92 -0.29 0.00 -1.33 0.00 0.00 58.87 56.56 1wix n SER 5 Cb 0.51 -0.93 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 1wix n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1wix n SER 6 N 10.13 -2.28 -4.05 -3.46 2.88 -1.26 -4.97 113.62 110.61 1wix n SER 6 Ca 0.59 -1.03 -0.24 0.00 -1.33 0.00 0.00 58.87 56.86 1wix n SER 6 Cb 0.25 -3.10 -0.16 0.00 -0.75 0.00 0.00 64.21 60.45 1wix n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wix s GLY 7 N -4.01 0.79 1.09 0.46 0.00 -0.73 -4.93 107.32 99.99 1wix s GLY 7 Ca 0.20 -0.47 -0.16 0.00 0.00 0.00 0.00 44.72 44.29 1wix s GLY 7 CO 0.88 -0.02 0.40 1.47 0.00 0.00 0.00 173.10 175.83 1wix n LEU 8 N 3.58 -1.36 -0.01 0.66 -0.00 -1.26 -4.53 117.00 114.08 1wix n LEU 8 Ca -0.21 -0.02 -0.13 0.00 -0.00 0.00 0.00 56.01 55.65 1wix n LEU 8 Cb 0.52 -1.11 -0.10 0.00 -0.00 0.00 0.00 43.42 42.73 1wix n LEU 8 CO 0.25 -3.18 0.63 1.55 -0.00 0.00 0.00 177.39 176.64 1wix h PRO 9 N -2.12 0.00 -0.77 1.47 0.13 -1.98 0.66 132.00 129.40 1wix h PRO 9 Ca -0.53 -0.00 0.22 0.00 -0.87 0.00 0.00 66.00 64.82 1wix h PRO 9 Cb 1.33 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.43 1wix h PRO 9 CO 0.40 0.49 0.97 1.25 -0.23 0.00 0.00 178.00 180.88 1wix h LEU 10 N -0.48 0.00 0.00 1.56 5.85 -1.95 0.26 115.31 120.55 1wix h LEU 10 Ca 0.00 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.56 1wix h LEU 10 Cb 0.49 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 1wix h LEU 10 CO 0.00 0.00 -1.62 0.00 -0.34 0.00 0.00 178.44 176.48 1wix n ASP 12 N -2.61 0.00 -0.07 0.00 2.03 0.23 -2.67 116.55 113.46 1wix n ASP 12 Ca -0.17 0.32 -0.15 0.00 0.52 0.00 0.00 54.79 55.31 1wix n ASP 12 Cb 0.74 -0.40 -0.05 0.00 -0.72 0.00 0.00 41.12 40.69 1wix n ASP 12 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1wix n SER 13 N -1.40 1.30 -0.11 1.67 7.64 0.69 -4.64 113.62 118.77 1wix n SER 13 Ca 0.04 0.14 -0.06 0.00 1.01 0.00 0.00 58.87 60.00 1wix n SER 13 Cb 0.11 -0.40 0.01 0.00 -1.01 0.00 0.00 64.21 62.92 1wix n SER 13 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1wix h LEU 14 N -0.44 -0.74 -0.98 -3.43 3.38 -1.66 -1.58 115.31 109.85 1wix h LEU 14 Ca -0.36 0.16 0.18 0.00 0.09 0.00 0.00 57.88 57.95 1wix h LEU 14 Cb 1.34 0.39 -0.18 0.00 0.09 0.00 0.00 40.66 42.30 1wix h LEU 14 CO -0.20 -0.25 -0.29 -0.38 0.09 0.00 0.00 178.44 177.41 1wix n ILE 15 N -5.39 -0.45 -0.30 1.22 5.41 -1.09 0.16 119.36 118.93 1wix n ILE 15 Ca 0.02 2.27 0.12 0.00 1.00 0.00 0.00 62.75 66.16 1wix n ILE 15 Cb 0.30 -3.09 0.36 0.00 -0.71 0.00 0.00 39.64 36.50 1wix n ILE 15 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1wix h ILE 16 N 0.00 0.81 -0.08 1.39 2.04 -1.55 0.56 117.51 120.69 1wix h ILE 16 Ca 0.43 -0.25 -0.04 0.00 1.00 0.00 0.00 64.86 66.00 1wix h ILE 16 Cb 0.67 0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.78 1wix h ILE 16 CO -1.00 0.13 -0.10 -0.25 0.00 0.00 0.00 178.15 176.93 1wix h TRP 17 N 0.72 0.26 -0.06 1.37 7.01 0.16 -3.11 115.95 122.30 1wix h TRP 17 Ca 0.48 -0.08 -0.01 0.00 2.11 0.00 0.00 58.89 61.39 1wix h TRP 17 Cb 0.76 -0.05 -0.00 0.00 -2.10 0.00 0.00 29.16 27.77 1wix h TRP 17 CO -0.00 0.68 -0.00 1.25 -2.79 0.00 0.00 178.44 177.57 1wix h LEU 18 N -0.24 0.07 -1.55 0.65 7.12 -0.24 -2.07 115.31 119.06 1wix h LEU 18 Ca 0.01 -0.00 0.24 0.00 0.13 0.00 0.00 57.88 58.25 1wix h LEU 18 Cb 0.64 -0.02 -0.07 0.00 -0.53 0.00 0.00 40.66 40.69 1wix h LEU 18 CO 0.02 0.09 0.64 1.56 -0.13 0.00 0.00 178.44 180.63 1wix h GLN 19 N 0.08 0.32 -1.36 1.25 4.20 -0.85 0.74 115.11 119.50 1wix h GLN 19 Ca 0.02 -0.02 0.39 0.00 0.06 0.00 0.00 58.65 59.11 1wix h GLN 19 Cb 0.06 -0.07 -0.06 0.00 0.30 0.00 0.00 27.48 27.72 1wix h GLN 19 CO 0.00 0.21 0.97 1.79 -0.67 0.00 0.00 178.83 181.13 1wix h THR 20 N 0.33 0.32 -3.13 -0.54 1.35 -1.49 -3.32 112.91 106.42 1wix h THR 20 Ca 0.51 -0.00 -0.67 0.00 -0.55 0.00 0.00 66.41 65.70 1wix h THR 20 Cb 1.42 0.30 -0.17 0.00 -1.73 0.00 0.00 68.15 67.97 1wix h THR 20 CO -0.18 0.00 0.18 -0.36 -0.25 0.00 0.00 175.52 174.91 1wix s PHE 21 N -4.95 2.97 -0.28 4.73 0.40 0.25 -4.90 117.98 116.19 1wix s PHE 21 Ca -0.05 -0.53 0.01 0.00 -0.60 0.00 0.00 56.93 55.76 1wix s PHE 21 Cb 0.24 -3.77 0.13 0.00 0.51 0.00 0.00 43.02 40.13 1wix s PHE 21 CO 0.83 -1.18 1.06 0.36 0.70 0.00 0.00 175.22 176.98 1wix n LYS 22 N 6.53 1.36 -0.94 0.44 2.85 -1.25 -4.73 118.16 122.42 1wix n LYS 22 Ca -0.06 -0.56 -0.37 0.00 -1.05 0.00 0.00 58.31 56.27 1wix n LYS 22 Cb 0.45 -1.33 0.06 0.00 -0.65 0.00 0.00 35.03 33.56 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 0.17 0.00 -0.40 0.58 -2.24 -1.26 -4.60 114.28 106.54 1wix n THR 23 Ca 0.10 -0.19 0.38 0.00 -2.27 0.00 0.00 64.05 62.06 1wix n THR 23 Cb 0.64 -0.12 0.61 0.00 -2.10 0.00 0.00 70.33 69.36 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 -1.18 3.31 -3.11 6.98 0.00 -1.96 -3.31 119.26 119.99 1wix h ALA 24 Ca -0.43 -0.05 -0.67 0.00 0.00 0.00 0.00 54.91 53.77 1wix h ALA 24 Cb 1.36 0.10 -0.32 0.00 0.00 0.00 0.00 17.79 18.94 1wix h ALA 24 CO 0.25 -1.98 -0.78 0.45 0.00 0.00 0.00 179.25 177.19 1wix s SER 25 N -3.74 3.87 1.08 0.00 0.15 -1.26 -5.08 113.70 108.71 1wix s SER 25 Ca -0.04 -0.63 -0.15 0.00 0.70 0.00 0.00 55.95 55.84 1wix s SER 25 Cb 0.19 -1.62 0.23 0.00 -1.71 0.00 0.00 66.02 63.11 1wix s SER 25 CO 0.65 -0.04 1.10 -2.16 1.20 0.00 0.00 173.24 173.98 1wix s PRO 26 N 1.36 -0.19 -0.39 5.44 0.04 -1.25 -4.55 135.00 135.47 1wix s PRO 26 Ca 0.04 0.29 0.01 0.00 0.04 0.00 0.00 61.00 61.38 1wix s PRO 26 Cb -0.14 -1.68 0.14 0.00 0.04 0.00 0.00 34.50 32.85 1wix s PRO 26 CO -0.07 -3.10 0.22 0.00 0.04 0.00 0.00 177.00 174.08 1wix n GLN 28 N 3.86 0.00 -3.08 0.00 6.02 -1.26 -4.58 117.38 118.34 1wix n GLN 28 Ca 0.10 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.89 1wix n GLN 28 Cb 0.36 -0.26 0.05 0.00 1.02 0.00 0.00 30.24 31.40 1wix n GLN 28 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1wix s ASP 29 N -3.57 5.18 0.05 1.08 1.01 -1.26 -4.97 116.67 114.19 1wix s ASP 29 Ca 0.00 -0.79 -0.17 0.00 0.71 0.00 0.00 52.55 52.30 1wix s ASP 29 Cb 0.00 0.11 -0.19 0.00 1.01 0.00 0.00 42.92 43.84 1wix s ASP 29 CO 0.00 -1.21 1.21 -0.37 0.21 0.00 0.00 175.17 175.01 1wix h VAL 30 N 0.31 1.36 0.00 -1.27 -1.51 -1.97 -3.07 116.25 110.09 1wix h VAL 30 Ca -0.32 -1.95 0.00 0.00 -1.23 0.00 0.00 66.70 63.20 1wix h VAL 30 Cb 1.29 2.27 0.00 0.00 -2.13 0.00 0.00 31.29 32.72 1wix h VAL 30 CO 0.43 0.59 0.00 0.11 -1.23 0.00 0.00 177.57 177.46 1wix h LYS 31 N 0.16 0.00 0.00 5.19 1.57 -1.97 0.23 116.57 121.76 1wix h LYS 31 Ca -0.06 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.61 1wix h LYS 31 Cb 1.28 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.57 1wix h LYS 31 CO 0.13 0.00 -0.88 1.96 -0.57 0.00 0.00 179.45 180.08 1wix h GLN 32 N 0.00 0.00 0.00 3.15 4.20 -1.94 -3.34 115.11 117.18 1wix h GLN 32 Ca 0.00 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.49 1wix h GLN 32 Cb 0.05 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.79 1wix h GLN 32 CO 0.00 0.37 -1.95 1.28 -0.67 0.00 0.00 178.83 177.86 1wix n LEU 33 N -3.05 0.33 -0.17 1.46 4.77 -0.05 -4.25 117.00 116.03 1wix n LEU 33 Ca -0.03 0.15 0.27 0.00 -0.03 0.00 0.00 56.01 56.37 1wix n LEU 33 Cb 0.76 0.23 0.50 0.00 -2.33 0.00 0.00 43.42 42.58 1wix n LEU 33 CO 0.41 0.27 1.25 0.71 -1.33 0.00 0.00 177.39 178.70 1wix h THR 34 N 0.00 0.06 0.71 -5.08 1.35 -0.76 0.90 112.91 110.08 1wix h THR 34 Ca -0.29 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.54 1wix h THR 34 Cb 1.74 0.11 0.01 0.00 -1.73 0.00 0.00 68.15 68.28 1wix h THR 34 CO 0.03 0.00 -0.34 0.78 -0.25 0.00 0.00 175.52 175.74 1wix h ASN 35 N 0.00 -0.80 0.00 5.36 4.21 -1.79 -3.44 115.58 119.12 1wix h ASN 35 Ca 0.45 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.99 1wix h ASN 35 Cb 2.64 0.21 0.00 0.00 -1.12 0.00 0.00 38.32 40.05 1wix h ASN 35 CO -0.00 -0.47 0.00 0.61 -1.29 0.00 0.00 177.43 176.27 1wix n GLY 36 N -0.83 2.60 0.35 2.83 0.00 0.31 -3.53 105.19 106.92 1wix n GLY 36 Ca -0.12 -0.70 -0.06 0.00 0.00 0.00 0.00 46.02 45.14 1wix n GLY 36 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1wix n VAL 37 N 0.00 -0.54 -0.22 1.61 0.31 -1.26 0.79 118.33 119.02 1wix n VAL 37 Ca 0.00 2.07 0.02 0.00 -0.01 0.00 0.00 64.34 66.42 1wix n VAL 37 Cb 0.00 -2.63 0.13 0.00 -0.91 0.00 0.00 33.84 30.43 1wix n VAL 37 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 1wix h THR 38 N 0.00 0.68 0.59 2.52 2.02 -1.88 0.79 112.91 117.62 1wix h THR 38 Ca 0.20 -0.12 -0.03 0.00 0.77 0.00 0.00 66.41 67.23 1wix h THR 38 Cb 0.42 0.29 0.01 0.00 -1.74 0.00 0.00 68.15 67.12 1wix h THR 38 CO -0.83 0.07 -0.28 0.24 0.37 0.00 0.00 175.52 175.08 1wix h MET 39 N 0.36 -0.76 -0.26 6.66 2.86 0.05 -2.50 114.93 121.34 1wix h MET 39 Ca 0.35 0.05 0.06 0.00 -2.06 0.00 0.00 59.70 58.10 1wix h MET 39 Cb 0.50 0.17 -0.07 0.00 0.06 0.00 0.00 31.60 32.26 1wix h MET 39 CO -0.38 -0.47 -0.23 0.00 1.06 0.00 0.00 176.91 176.89 1wix h ALA 40 N -0.54 -0.09 -0.97 6.32 0.00 -0.18 0.33 119.26 124.13 1wix h ALA 40 Ca -0.08 0.08 0.23 0.00 0.00 0.00 0.00 54.91 55.14 1wix h ALA 40 Cb 0.64 0.49 -0.08 0.00 0.00 0.00 0.00 17.79 18.84 1wix h ALA 40 CO 0.13 -0.65 0.63 1.96 0.00 0.00 0.00 179.25 181.33 1wix h GLN 41 N -0.23 0.40 -0.08 0.00 4.20 -0.83 0.15 115.11 118.72 1wix h GLN 41 Ca 0.14 -0.02 -0.21 0.00 0.06 0.00 0.00 58.65 58.61 1wix h GLN 41 Cb 0.45 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1wix h GLN 41 CO -0.39 0.27 -0.82 0.28 -0.67 0.00 0.00 178.83 177.50 1wix h VAL 42 N 0.42 1.34 -0.48 -0.54 2.07 -0.54 -3.16 116.25 115.37 1wix h VAL 42 Ca 0.53 -2.16 0.07 0.00 0.82 0.00 0.00 66.70 65.95 1wix h VAL 42 Cb 1.31 2.16 -0.03 0.00 -1.52 0.00 0.00 31.29 33.21 1wix h VAL 42 CO -0.23 0.66 0.32 -0.07 0.02 0.00 0.00 177.57 178.28 1wix h LEU 43 N 0.36 0.33 -1.07 2.57 3.38 0.88 -0.29 115.31 121.47 1wix h LEU 43 Ca -0.06 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 1wix h LEU 43 Cb 1.43 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 1wix h LEU 43 CO 0.15 0.21 -0.30 -0.74 0.09 0.00 0.00 178.44 177.85 1wix h HIS 44 N 0.37 0.31 -0.04 1.13 2.76 -1.42 -2.78 115.15 115.50 1wix h HIS 44 Ca 0.21 -0.07 -0.18 0.00 -2.20 0.00 0.00 60.37 58.13 1wix h HIS 44 Cb 0.36 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.23 1wix h HIS 44 CO -0.00 0.56 -0.77 1.96 -1.30 0.00 0.00 177.93 178.38 1wix h GLN 45 N 0.25 0.26 -0.14 5.26 4.20 -1.13 -3.20 115.11 120.61 1wix h GLN 45 Ca 0.03 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.50 1wix h GLN 45 Cb 0.66 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.49 1wix h GLN 45 CO 0.05 0.91 0.06 0.82 -0.67 0.00 0.00 178.83 180.00 1wix h ILE 46 N 0.17 1.15 -1.43 2.54 2.04 -1.15 -3.43 117.51 117.40 1wix h ILE 46 Ca -0.03 -0.44 0.03 0.00 1.00 0.00 0.00 64.86 65.42 1wix h ILE 46 Cb 1.35 1.18 -0.23 0.00 -0.74 0.00 0.00 36.82 38.38 1wix h ILE 46 CO 0.12 0.14 -0.29 -0.62 0.00 0.00 0.00 178.15 177.50 1wix s ASP 47 N -5.52 -0.98 0.01 1.72 -1.08 -1.09 -4.80 116.67 104.92 1wix s ASP 47 Ca -0.14 0.89 -0.25 0.00 -0.52 0.00 0.00 52.55 52.54 1wix s ASP 47 Cb 0.07 1.95 -0.18 0.00 -1.46 0.00 0.00 42.92 43.30 1wix s ASP 47 CO 0.69 -0.26 1.29 0.58 0.52 0.00 0.00 175.17 178.00 1wix h VAL 48 N 6.04 0.98 -1.00 1.11 2.07 -1.72 0.48 116.25 124.21 1wix h VAL 48 Ca -0.21 -0.74 0.35 0.00 0.82 0.00 0.00 66.70 66.93 1wix h VAL 48 Cb 1.15 1.42 -0.16 0.00 -1.52 0.00 0.00 31.29 32.17 1wix h VAL 48 CO 0.23 0.17 0.56 0.00 0.02 0.00 0.00 177.57 178.54 1wix h ALA 49 N 0.18 2.01 0.04 1.67 0.00 -1.97 0.31 119.26 121.51 1wix h ALA 49 Ca -0.02 0.22 -0.31 0.00 0.00 0.00 0.00 54.91 54.79 1wix h ALA 49 Cb 0.44 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 1wix h ALA 49 CO 0.04 -0.69 -1.79 1.87 0.00 0.00 0.00 179.25 178.67 1wix n TRP 50 N -5.12 1.11 -3.72 0.00 -0.00 -1.17 -4.61 117.44 103.93 1wix n TRP 50 Ca 0.34 0.34 -0.28 0.00 -0.00 0.00 0.00 57.50 57.90 1wix n TRP 50 Cb 1.08 -1.18 -0.11 0.00 -0.00 0.00 0.00 31.31 31.09 1wix n TRP 50 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 1wix n PHE 51 N -3.19 2.07 -3.22 5.87 3.72 0.17 -4.99 117.46 117.89 1wix n PHE 51 Ca -0.21 -4.02 -0.30 0.00 -0.05 0.00 0.00 57.45 52.87 1wix n PHE 51 Cb 1.05 -0.38 -0.04 0.00 -0.94 0.00 0.00 39.48 39.18 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 -1.11 6.49 0.45 4.37 0.15 0.09 -4.22 113.70 119.93 1wix s SER 52 Ca 0.28 0.86 0.39 0.00 0.70 0.00 0.00 55.95 58.17 1wix s SER 52 Cb -0.00 -2.20 1.45 0.00 -1.71 0.00 0.00 66.02 63.55 1wix s SER 52 CO -0.17 -0.23 1.37 -0.62 1.20 0.00 0.00 173.24 174.79 1wix n GLU 53 N -0.91 -0.01 -0.00 5.44 -0.58 -1.26 0.12 120.64 123.43 1wix n GLU 53 Ca -0.00 1.01 -0.10 0.00 -0.42 0.00 0.00 57.16 57.65 1wix n GLU 53 Cb 0.54 -2.19 -0.04 0.00 -0.57 0.00 0.00 31.44 29.18 1wix n GLU 53 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 1wix h SER 54 N 0.00 -0.16 -0.28 1.62 0.02 -1.97 0.43 113.55 113.21 1wix h SER 54 Ca 0.81 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.78 1wix h SER 54 Cb 3.02 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 65.64 1wix h SER 54 CO -0.16 -0.06 0.09 -0.25 -1.14 0.00 0.00 176.83 175.30 1wix h TRP 55 N -0.03 0.45 0.00 3.45 7.01 0.54 -2.33 115.95 125.04 1wix h TRP 55 Ca 0.06 -0.05 0.00 0.00 2.11 0.00 0.00 58.89 61.01 1wix h TRP 55 Cb 0.12 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 27.05 1wix h TRP 55 CO -0.17 0.48 0.00 1.25 -2.79 0.00 0.00 178.44 177.21 1wix h LEU 56 N 0.29 0.00 -1.95 0.65 5.85 -1.25 -2.46 115.31 116.44 1wix h LEU 56 Ca 0.09 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1wix h LEU 56 Cb 0.24 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.27 1wix h LEU 56 CO -0.00 0.00 -0.11 -1.28 -0.34 0.00 0.00 178.44 176.71 1wix h SER 57 N 0.00 0.00 0.89 1.25 0.87 0.45 -0.84 113.55 116.17 1wix h SER 57 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1wix h SER 57 Cb 0.36 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 1wix h SER 57 CO 0.00 0.11 -0.11 0.54 -0.53 0.00 0.00 176.83 176.84 1wix n ARG 58 N -3.66 0.00 -3.13 2.24 1.74 -0.93 -4.81 116.66 108.12 1wix n ARG 58 Ca -0.02 -0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.67 1wix n ARG 58 Cb 0.23 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.11 1wix n ARG 58 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1wix s ILE 59 N -3.00 4.88 0.19 0.55 -1.09 -0.32 -4.93 121.20 117.49 1wix s ILE 59 Ca 0.13 1.36 0.11 0.00 -2.23 0.00 0.00 60.65 60.02 1wix s ILE 59 Cb 0.19 -3.99 -0.04 0.00 -1.58 0.00 0.00 42.46 37.04 1wix s ILE 59 CO 0.57 0.38 -0.19 -0.54 -1.23 0.00 0.00 174.94 173.93 1wix s LYS 60 N -0.03 1.70 -0.00 2.79 1.02 -1.26 -5.03 119.74 118.93 1wix s LYS 60 Ca 0.34 -1.45 0.09 0.00 0.02 0.00 0.00 55.97 54.97 1wix s LYS 60 Cb -0.19 -1.95 -0.11 0.00 -0.52 0.00 0.00 37.83 35.07 1wix s LYS 60 CO 0.19 0.41 0.37 -3.47 -0.92 0.00 0.00 175.35 171.93 1wix n ASP 61 N 0.16 0.75 0.26 2.83 2.03 -1.26 -4.53 116.55 116.79 1wix n ASP 61 Ca -0.12 -0.63 0.09 0.00 0.52 0.00 0.00 54.79 54.66 1wix n ASP 61 Cb 0.56 1.06 0.49 0.00 -0.72 0.00 0.00 41.12 42.51 1wix n ASP 61 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1wix h ASP 62 N 0.00 0.00 -1.32 1.67 3.32 -1.96 -2.51 116.42 115.62 1wix h ASP 62 Ca 0.00 0.00 0.38 0.00 0.02 0.00 0.00 57.03 57.43 1wix h ASP 62 Cb 0.25 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.75 1wix h ASP 62 CO 0.00 0.00 1.18 1.33 -1.72 0.00 0.00 179.24 180.03 1wix n VAL 63 N -2.44 0.00 -0.20 -1.35 0.24 -1.26 -1.96 118.33 111.37 1wix n VAL 63 Ca -0.01 1.22 -0.01 0.00 -2.04 0.00 0.00 64.34 63.50 1wix n VAL 63 Cb 0.45 -2.12 0.01 0.00 -1.47 0.00 0.00 33.84 30.71 1wix n VAL 63 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wix n GLY 64 N -1.72 -1.08 0.57 7.63 0.00 -0.95 0.15 105.19 109.79 1wix n GLY 64 Ca 0.30 0.57 0.08 0.00 0.00 0.00 0.00 46.02 46.97 1wix n GLY 64 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1wix n ASP 65 N -4.72 2.15 -4.36 1.61 -0.08 -0.83 -4.93 116.55 105.39 1wix n ASP 65 Ca 0.04 -1.57 -0.33 0.00 -1.51 0.00 0.00 54.79 51.42 1wix n ASP 65 Cb 0.19 0.18 -0.15 0.00 2.34 0.00 0.00 41.12 43.68 1wix n ASP 65 CO 0.00 0.00 0.00 0.20 0.12 0.00 0.00 177.20 177.52 1wix s ASN 66 N -1.63 3.82 -0.05 1.67 0.01 0.39 -5.00 114.94 114.15 1wix s ASN 66 Ca 0.18 -0.35 0.19 0.00 -0.71 0.00 0.00 52.86 52.16 1wix s ASN 66 Cb 0.14 -1.42 -0.22 0.00 0.41 0.00 0.00 41.25 40.15 1wix s ASN 66 CO 0.29 0.20 0.48 -2.67 -1.51 0.00 0.00 177.10 173.89 1wix n TRP 67 N 3.31 0.41 -0.05 2.20 4.27 -1.26 -4.29 117.44 122.03 1wix n TRP 67 Ca -0.18 0.14 -0.14 0.00 -3.89 0.00 0.00 57.50 53.43 1wix n TRP 67 Cb 0.53 -0.91 -0.07 0.00 -1.36 0.00 0.00 31.31 29.49 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 0.43 -0.52 -2.67 3.08 -1.94 -3.06 114.38 109.69 1wix h ARG 68 Ca -0.25 -0.27 0.15 0.00 0.07 0.00 0.00 59.98 59.68 1wix h ARG 68 Cb 1.66 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.72 1wix h ARG 68 CO 0.03 0.87 0.41 0.82 -1.07 0.00 0.00 179.97 181.02 1wix h ILE 69 N 0.04 0.63 0.38 2.04 2.04 -1.94 -2.69 117.51 118.01 1wix h ILE 69 Ca 0.01 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.85 1wix h ILE 69 Cb 0.84 0.71 -0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1wix h ILE 69 CO 0.06 0.00 -0.22 0.11 0.00 0.00 0.00 178.15 178.10 1wix h LYS 70 N 0.00 -0.54 -0.97 2.37 1.57 -1.72 -3.02 116.57 114.26 1wix h LYS 70 Ca 0.25 0.04 0.11 0.00 -1.87 0.00 0.00 60.65 59.17 1wix h LYS 70 Cb 1.06 0.12 -0.13 0.00 0.08 0.00 0.00 32.23 33.37 1wix h LYS 70 CO -0.00 -0.36 -0.53 0.00 -0.57 0.00 0.00 179.45 177.99 1wix h ALA 71 N -1.62 -0.37 -0.97 3.86 0.00 -1.58 0.39 119.26 118.98 1wix h ALA 71 Ca -0.05 0.16 0.28 0.00 0.00 0.00 0.00 54.91 55.29 1wix h ALA 71 Cb 0.44 1.27 -0.18 0.00 0.00 0.00 0.00 17.79 19.32 1wix h ALA 71 CO 0.06 -0.88 0.06 0.43 0.00 0.00 0.00 179.25 178.92 1wix n SER 72 N -5.32 -0.08 0.06 0.00 7.64 -1.20 -0.07 113.62 114.66 1wix n SER 72 Ca 0.04 1.64 -0.13 0.00 1.01 0.00 0.00 58.87 61.43 1wix n SER 72 Cb 0.30 -0.61 -0.09 0.00 -1.01 0.00 0.00 64.21 62.80 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 -0.15 -0.88 6.43 2.35 -0.14 -2.89 115.58 120.30 1wix h ASN 73 Ca 0.61 -0.31 0.21 0.00 -0.55 0.00 0.00 56.30 56.26 1wix h ASN 73 Cb 1.29 0.04 -0.12 0.00 0.05 0.00 0.00 38.32 39.58 1wix h ASN 73 CO -0.90 0.25 0.37 -0.07 -1.65 0.00 0.00 177.43 175.44 1wix h LEU 74 N -0.58 0.31 0.63 1.61 3.38 0.60 0.15 115.31 121.41 1wix h LEU 74 Ca -0.02 0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1wix h LEU 74 Cb 0.45 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1wix h LEU 74 CO 0.03 0.01 -0.33 0.11 0.09 0.00 0.00 178.44 178.35 1wix h LYS 75 N 0.40 -0.85 -0.33 1.13 6.56 -0.90 0.32 116.57 122.90 1wix h LYS 75 Ca 0.54 0.06 0.05 0.00 -1.06 0.00 0.00 60.65 60.23 1wix h LYS 75 Cb 1.00 0.19 -0.04 0.00 -0.57 0.00 0.00 32.23 32.81 1wix h LYS 75 CO -0.52 -0.57 0.07 0.87 -2.06 0.00 0.00 179.45 177.25 1wix h LYS 76 N -0.88 0.19 -0.25 3.15 1.57 -1.05 0.29 116.57 119.59 1wix h LYS 76 Ca -0.08 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.73 1wix h LYS 76 Cb 0.69 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.92 1wix h LYS 76 CO 0.12 0.12 -0.00 0.28 -0.57 0.00 0.00 179.45 179.40 1wix h VAL 77 N 0.19 0.82 0.84 0.50 2.07 -0.64 -1.40 116.25 118.63 1wix h VAL 77 Ca 0.15 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.61 1wix h VAL 77 Cb 0.16 0.74 0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1wix h VAL 77 CO -0.20 0.01 -0.40 0.25 0.02 0.00 0.00 177.57 177.26 1wix h LEU 78 N 0.07 -0.95 -1.95 2.57 6.46 -0.51 -2.45 115.31 118.55 1wix h LEU 78 Ca 0.12 0.03 0.34 0.00 -0.12 0.00 0.00 57.88 58.25 1wix h LEU 78 Cb 0.15 0.25 -0.05 0.00 -0.73 0.00 0.00 40.66 40.28 1wix h LEU 78 CO -0.20 -0.66 0.85 -0.74 -0.62 0.00 0.00 178.44 177.06 1wix h HIS 79 N -1.15 0.05 -1.00 1.25 2.76 -0.83 0.23 115.15 116.46 1wix h HIS 79 Ca -0.12 0.00 0.06 0.00 -2.20 0.00 0.00 60.37 58.11 1wix h HIS 79 Cb 0.87 -0.01 -0.06 0.00 1.55 0.00 0.00 27.41 29.75 1wix h HIS 79 CO -0.01 0.00 0.65 0.78 -1.30 0.00 0.00 177.93 178.05 1wix h GLY 80 N 0.03 1.49 0.00 5.26 0.00 -0.75 -1.50 103.07 107.60 1wix h GLY 80 Ca 0.57 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 47.42 1wix h GLY 80 CO -0.03 0.36 -0.06 -2.22 0.00 0.00 0.00 176.54 174.59 1wix h ILE 81 N 1.19 0.00 -0.97 2.60 5.03 -0.58 -2.97 117.51 121.81 1wix h ILE 81 Ca 0.42 -0.64 0.32 0.00 -0.12 0.00 0.00 64.86 64.84 1wix h ILE 81 Cb 0.12 0.00 -0.18 0.00 -3.03 0.00 0.00 36.82 33.73 1wix h ILE 81 CO -0.16 0.00 0.19 0.35 -0.68 0.00 0.00 178.15 177.86 1wix n THR 82 N -3.77 -0.41 0.04 -0.27 -2.24 -1.00 0.21 114.28 106.84 1wix n THR 82 Ca -0.01 2.08 -0.07 0.00 -2.27 0.00 0.00 64.05 63.79 1wix n THR 82 Cb 0.03 -3.15 0.11 0.00 -2.10 0.00 0.00 70.33 65.22 1wix n THR 82 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1wix h SER 83 N 0.00 0.47 0.60 3.42 0.87 -1.42 -2.57 113.55 114.91 1wix h SER 83 Ca 0.67 -0.23 0.00 0.00 -1.23 0.00 0.00 61.79 61.00 1wix h SER 83 Cb 1.55 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.37 1wix h SER 83 CO -0.86 0.89 0.00 0.00 -0.53 0.00 0.00 176.83 176.33 1wix n TYR 84 N -3.97 0.38 -0.07 2.24 4.19 0.56 0.39 117.16 120.89 1wix n TYR 84 Ca -0.02 0.15 -0.09 0.00 3.31 0.00 0.00 57.90 61.24 1wix n TYR 84 Cb 0.56 -0.74 -0.15 0.00 0.49 0.00 0.00 39.34 39.50 1wix n TYR 84 CO 0.00 0.00 0.00 0.66 0.91 0.00 0.00 176.86 178.43 1wix n TYR 85 N -1.85 0.45 -0.03 2.98 4.01 -0.39 -1.98 117.16 120.35 1wix n TYR 85 Ca 0.03 0.16 -0.06 0.00 -0.16 0.00 0.00 57.90 57.87 1wix n TYR 85 Cb 0.19 -1.08 -0.13 0.00 -0.31 0.00 0.00 39.34 38.01 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 -2.88 0.60 0.00 -0.72 8.25 -0.75 0.20 115.22 119.92 1wix n HIS 86 Ca -0.26 0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 1wix n HIS 86 Cb 1.11 -1.06 0.00 0.00 1.12 0.00 0.00 29.99 31.17 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 -2.86 0.00 0.02 -0.41 1.02 0.16 -3.65 120.64 114.92 1wix n GLU 87 Ca -0.20 0.11 -0.02 0.00 -0.02 0.00 0.00 57.16 57.04 1wix n GLU 87 Cb 1.01 -0.59 -0.01 0.00 -0.02 0.00 0.00 31.44 31.83 1wix n GLU 87 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1wix h PHE 88 N 0.00 -0.15 0.30 -0.32 3.04 -1.63 -3.33 116.94 114.85 1wix h PHE 88 Ca 0.00 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 1wix h PHE 88 Cb 0.00 0.06 0.00 0.00 2.56 0.00 0.00 35.95 38.58 1wix h PHE 88 CO 0.00 -0.06 -0.14 -0.07 -2.02 0.00 0.00 178.31 176.01 1wix h LEU 89 N -0.08 -0.34 0.00 0.59 3.38 -1.54 -3.49 115.31 113.83 1wix h LEU 89 Ca -0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1wix h LEU 89 Cb 0.08 0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1wix h LEU 89 CO -0.02 0.12 0.00 0.61 0.09 0.00 0.00 178.44 179.24 1wix n GLY 90 N 0.69 1.95 3.07 0.83 0.00 0.29 -4.95 105.19 107.06 1wix n GLY 90 Ca -0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.72 1wix n GLY 90 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wix n GLN 91 N 0.00 -1.63 -3.22 1.61 10.64 0.55 -4.54 117.38 120.78 1wix n GLN 91 Ca 0.00 -1.60 -0.14 0.00 -1.83 0.00 0.00 57.00 53.42 1wix n GLN 91 Cb 0.00 -1.20 -0.03 0.00 -0.86 0.00 0.00 30.24 28.15 1wix n GLN 91 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1wix n GLN 92 N -3.62 1.28 -4.69 2.61 10.64 -1.26 -1.81 117.38 120.53 1wix n GLN 92 Ca 0.13 -1.70 -0.24 0.00 -1.83 0.00 0.00 57.00 53.36 1wix n GLN 92 Cb 0.48 0.55 -0.16 0.00 -0.86 0.00 0.00 30.24 30.25 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 -1.94 1.22 0.39 -0.39 1.01 -1.26 -4.42 121.20 115.81 1wix s ILE 93 Ca 0.02 -0.60 -0.23 0.00 0.00 0.00 0.00 60.65 59.84 1wix s ILE 93 Cb 0.00 -1.05 -0.10 0.00 0.01 0.00 0.00 42.46 41.31 1wix s ILE 93 CO 0.02 0.36 0.97 -0.44 0.00 0.00 0.00 174.94 175.84 1wix s SER 94 N 0.07 7.02 0.38 3.58 0.01 -1.26 -4.90 113.70 118.60 1wix s SER 94 Ca -0.03 1.80 0.18 0.00 1.31 0.00 0.00 55.95 59.20 1wix s SER 94 Cb -0.10 -2.56 0.96 0.00 0.21 0.00 0.00 66.02 64.53 1wix s SER 94 CO 0.01 -0.30 1.48 -0.33 0.41 0.00 0.00 173.24 174.51 1wix h GLU 95 N 2.39 0.00 0.00 12.44 5.08 -1.95 0.32 114.58 132.85 1wix h GLU 95 Ca -0.48 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.79 1wix h GLU 95 Cb 1.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 1wix h GLU 95 CO 0.62 0.00 -0.40 0.93 -1.00 0.00 0.00 179.01 179.16 1wix h GLU 96 N 0.00 0.00 0.00 2.33 4.39 -1.99 -3.16 114.58 116.16 1wix h GLU 96 Ca 0.00 0.00 -0.34 0.00 0.34 0.00 0.00 59.36 59.36 1wix h GLU 96 Cb 0.50 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.09 1wix h GLU 96 CO 0.00 0.40 -2.08 1.28 -1.16 0.00 0.00 179.01 177.45 1wix n LEU 97 N -3.70 0.55 -4.45 1.33 4.77 0.11 -4.90 117.00 110.72 1wix n LEU 97 Ca -0.01 0.18 -0.46 0.00 -0.03 0.00 0.00 56.01 55.69 1wix n LEU 97 Cb 0.49 0.26 -0.09 0.00 -2.33 0.00 0.00 43.42 41.75 1wix n LEU 97 CO 0.38 0.48 1.95 -0.38 -1.33 0.00 0.00 177.39 178.48 1wix n ILE 98 N -2.92 0.06 -2.24 -0.08 2.08 -1.03 -4.75 119.36 110.49 1wix n ILE 98 Ca -0.26 -0.27 -0.41 0.00 0.56 0.00 0.00 62.75 62.37 1wix n ILE 98 Cb 1.10 -1.43 -0.03 0.00 -0.75 0.00 0.00 39.64 38.53 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 7.31 4.45 -0.81 0.38 0.04 -1.26 -4.97 135.00 140.14 1wix s PRO 99 Ca 1.16 2.06 -0.21 0.00 0.04 0.00 0.00 61.00 64.04 1wix s PRO 99 Cb -0.91 -3.13 0.09 0.00 0.04 0.00 0.00 34.50 30.59 1wix s PRO 99 CO 0.47 -0.08 1.10 -0.51 0.04 0.00 0.00 177.00 178.02 1wix s ASP 100 N -0.45 6.40 0.15 6.66 1.11 -1.26 -4.87 116.67 124.41 1wix s ASP 100 Ca 0.49 -1.46 -0.12 0.00 0.18 0.00 0.00 52.55 51.64 1wix s ASP 100 Cb -0.37 -2.43 0.02 0.00 1.07 0.00 0.00 42.92 41.21 1wix s ASP 100 CO 0.47 -1.31 1.60 -0.07 1.18 0.00 0.00 175.17 177.04 1wix h LEU 101 N 11.18 0.88 -1.33 1.23 3.38 -1.93 -2.13 115.31 126.59 1wix h LEU 101 Ca -0.05 -0.31 0.08 0.00 0.09 0.00 0.00 57.88 57.69 1wix h LEU 101 Cb 1.04 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.51 1wix h LEU 101 CO 1.18 0.97 0.51 0.78 0.09 0.00 0.00 178.44 181.97 1wix h ASN 102 N 0.76 0.69 0.92 -0.43 2.35 -1.99 0.33 115.58 118.21 1wix h ASN 102 Ca 0.14 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1wix h ASN 102 Cb 0.52 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.75 1wix h ASN 102 CO 0.03 0.43 -0.17 1.67 -1.65 0.00 0.00 177.43 177.74 1wix n GLN 103 N -4.49 0.05 -0.02 0.81 7.27 -1.08 -1.74 117.38 118.17 1wix n GLN 103 Ca 0.12 0.03 0.01 0.00 0.07 0.00 0.00 57.00 57.23 1wix n GLN 103 Cb 0.26 -1.55 -0.13 0.00 2.41 0.00 0.00 30.24 31.23 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 -1.63 0.80 -0.06 1.69 5.41 0.44 0.12 119.36 126.14 1wix n ILE 104 Ca 0.06 -0.67 -0.11 0.00 1.00 0.00 0.00 62.75 63.03 1wix n ILE 104 Cb 0.36 -0.37 -0.15 0.00 -0.71 0.00 0.00 39.64 38.77 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 -2.61 1.52 -0.07 1.39 -1.04 0.87 -2.58 114.28 111.76 1wix n THR 105 Ca -0.15 -0.80 -0.16 0.00 -2.04 0.00 0.00 64.05 60.90 1wix n THR 105 Cb 0.83 -0.86 -0.14 0.00 -1.82 0.00 0.00 70.33 68.34 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 -2.96 0.69 -0.08 -2.82 1.02 -0.71 -4.69 120.64 111.08 1wix n GLU 106 Ca -0.27 0.18 -0.14 0.00 -0.02 0.00 0.00 57.16 56.91 1wix n GLU 106 Cb 1.09 -1.62 -0.07 0.00 -0.02 0.00 0.00 31.44 30.82 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 -3.26 -0.16 -1.67 0.00 0.00 0.33 -4.92 120.51 110.83 1wix n ALA 108 Ca -0.31 0.09 -0.42 0.00 0.00 0.00 0.00 53.44 52.80 1wix n ALA 108 Cb 0.78 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 19.18 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 0.74 2.25 0.07 0.00 2.03 -1.07 -4.74 116.55 115.83 1wix n ASP 109 Ca -0.08 1.13 -0.04 0.00 0.52 0.00 0.00 54.79 56.33 1wix n ASP 109 Cb 0.40 -1.45 0.17 0.00 -0.72 0.00 0.00 41.12 39.53 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 2.12 0.31 -0.36 -0.67 0.13 -1.93 -0.89 132.00 130.70 1wix h PRO 110 Ca -0.46 -0.16 -0.06 0.00 -0.87 0.00 0.00 66.00 64.45 1wix h PRO 110 Cb 1.30 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.42 1wix h PRO 110 CO 0.60 0.71 -0.02 0.28 -0.23 0.00 0.00 178.00 179.34 1wix h VAL 111 N 0.25 1.21 0.10 1.56 2.07 -1.95 -2.77 116.25 116.72 1wix h VAL 111 Ca 0.02 -0.86 -0.23 0.00 0.82 0.00 0.00 66.70 66.45 1wix h VAL 111 Cb 0.91 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 31.63 1wix h VAL 111 CO 0.07 0.29 -1.16 -0.33 0.02 0.00 0.00 177.57 176.47 1wix h GLU 112 N 0.54 0.21 -0.67 1.57 4.39 -1.90 -3.34 114.58 115.39 1wix h GLU 112 Ca 0.11 -0.36 0.13 0.00 0.34 0.00 0.00 59.36 59.58 1wix h GLU 112 Cb 0.38 0.13 -0.13 0.00 -0.10 0.00 0.00 28.75 29.03 1wix h GLU 112 CO 0.01 1.17 -0.20 1.25 -1.16 0.00 0.00 179.01 180.09 1wix h LEU 113 N -0.44 -0.72 -1.27 1.33 7.12 -1.13 0.25 115.31 120.45 1wix h LEU 113 Ca -0.25 0.21 0.11 0.00 0.13 0.00 0.00 57.88 58.08 1wix h LEU 113 Cb 1.63 0.45 -0.06 0.00 -0.53 0.00 0.00 40.66 42.15 1wix h LEU 113 CO 0.05 -0.24 0.56 1.23 -0.13 0.00 0.00 178.44 179.90 1wix h GLY 114 N -0.03 1.19 -0.13 3.75 0.00 -1.65 -1.55 103.07 104.65 1wix h GLY 114 Ca 0.31 -0.33 0.24 0.00 0.00 0.00 0.00 47.33 47.55 1wix h GLY 114 CO -0.70 0.17 0.58 3.21 0.00 0.00 0.00 176.54 179.80 1wix h ARG 115 N 0.79 0.56 0.03 4.80 2.47 -0.61 -0.23 114.38 122.18 1wix h ARG 115 Ca 0.41 -0.03 -0.00 0.00 -1.26 0.00 0.00 59.98 59.09 1wix h ARG 115 Cb 0.50 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 28.69 1wix h ARG 115 CO -0.17 0.37 -0.01 1.25 0.56 0.00 0.00 179.97 181.96 1wix h LEU 116 N 0.58 -0.03 -1.82 3.04 5.85 -1.27 -3.06 115.31 118.59 1wix h LEU 116 Ca 0.64 -0.44 0.17 0.00 0.84 0.00 0.00 57.88 59.09 1wix h LEU 116 Cb 1.20 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.20 1wix h LEU 116 CO -0.48 0.43 0.47 -0.07 -0.34 0.00 0.00 178.44 178.45 1wix h LEU 117 N -0.50 0.16 -0.49 2.25 3.38 -1.11 -0.56 115.31 118.43 1wix h LEU 117 Ca -0.00 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1wix h LEU 117 Cb 0.47 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1wix h LEU 117 CO 0.01 0.08 0.25 -0.61 0.09 0.00 0.00 178.44 178.26 1wix h GLN 118 N 0.17 0.70 0.13 1.13 4.15 -1.00 -2.46 115.11 117.93 1wix h GLN 118 Ca 0.33 -0.09 0.01 0.00 0.77 0.00 0.00 58.65 59.67 1wix h GLN 118 Cb 1.04 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 28.58 1wix h GLN 118 CO -0.05 0.56 -0.19 -0.07 -1.93 0.00 0.00 178.83 177.15 1wix h LEU 119 N 0.65 -0.54 -0.06 -2.39 3.38 -1.08 -0.85 115.31 114.43 1wix h LEU 119 Ca 0.17 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.24 1wix h LEU 119 Cb 0.08 0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.97 1wix h LEU 119 CO -0.02 -0.28 -0.39 0.40 0.09 0.00 0.00 178.44 178.24 1wix h ILE 120 N -0.39 0.20 -0.64 1.22 2.04 -1.42 -0.21 117.51 118.30 1wix h ILE 120 Ca 0.02 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.01 1wix h ILE 120 Cb 0.39 0.20 -0.04 0.00 -0.74 0.00 0.00 36.82 36.63 1wix h ILE 120 CO -0.09 0.00 0.44 0.25 0.00 0.00 0.00 178.15 178.75 1wix h LEU 121 N -0.51 0.26 -0.75 1.44 5.85 -1.29 -1.39 115.31 118.93 1wix h LEU 121 Ca 0.07 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.88 1wix h LEU 121 Cb 0.61 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.54 1wix h LEU 121 CO -0.34 0.14 0.41 1.23 -0.34 0.00 0.00 178.44 179.55 1wix h GLY 122 N 0.29 1.13 2.00 3.75 0.00 0.46 -0.13 103.07 110.56 1wix h GLY 122 Ca 0.31 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1wix h GLY 122 CO -0.07 0.13 0.00 0.00 0.00 0.00 0.00 176.54 176.60 1wix n ALA 124 N -1.84 2.44 -0.05 0.00 0.00 -0.11 -3.29 120.51 117.65 1wix n ALA 124 Ca 0.05 -0.08 0.04 0.00 0.00 0.00 0.00 53.44 53.44 1wix n ALA 124 Cb 0.42 -1.41 0.09 0.00 0.00 0.00 0.00 19.45 18.55 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 -2.07 0.84 -2.04 0.00 0.24 -0.88 -4.09 118.33 110.34 1wix n VAL 125 Ca 0.05 -0.92 0.04 0.00 -2.04 0.00 0.00 64.34 61.48 1wix n VAL 125 Cb 0.41 0.60 0.07 0.00 -1.47 0.00 0.00 33.84 33.45 1wix n VAL 125 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1wix n ASN 126 N 0.20 1.05 -4.77 -1.34 3.02 -1.18 -4.99 115.26 107.25 1wix n ASN 126 Ca 0.07 -2.51 -0.32 0.00 -0.03 0.00 0.00 54.58 51.79 1wix n ASN 126 Cb 0.34 -0.34 -0.07 0.00 -0.61 0.00 0.00 39.78 39.10 1wix n ASN 126 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wix h GLU 128 N 1.31 0.89 -0.00 0.00 4.11 -1.92 -2.93 114.58 116.04 1wix h GLU 128 Ca -0.43 -0.52 0.00 0.00 0.07 0.00 0.00 59.36 58.47 1wix h GLU 128 Cb 1.31 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1wix h GLU 128 CO 0.73 1.17 -0.16 1.63 0.07 0.00 0.00 179.01 182.45 1wix n LYS 129 N -4.03 0.59 -0.25 1.06 5.02 -1.26 -4.31 118.16 114.99 1wix n LYS 129 Ca -0.03 -0.23 0.02 0.00 -2.02 0.00 0.00 58.31 56.05 1wix n LYS 129 Cb 0.59 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 34.18 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 -1.00 -0.09 -0.21 1.97 2.85 -1.11 0.18 118.16 120.75 1wix n LYS 130 Ca 0.13 1.04 0.01 0.00 -1.05 0.00 0.00 58.31 58.44 1wix n LYS 130 Cb 0.30 -1.56 0.09 0.00 -0.65 0.00 0.00 35.03 33.21 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 0.05 -0.53 -1.58 1.08 -1.81 0.65 115.11 112.96 1wix h GLN 131 Ca 0.29 -0.00 0.15 0.00 -1.45 0.00 0.00 58.65 57.64 1wix h GLN 131 Cb 0.46 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.86 1wix h GLN 131 CO -0.68 0.03 0.53 1.49 -0.95 0.00 0.00 178.83 179.25 1wix h GLU 132 N 0.05 0.00 0.02 1.46 4.57 0.16 -1.78 114.58 119.06 1wix h GLU 132 Ca 0.32 0.00 -0.28 0.00 -1.18 0.00 0.00 59.36 58.22 1wix h GLU 132 Cb 0.51 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.07 1wix h GLU 132 CO -0.60 0.00 -1.53 0.72 -1.18 0.00 0.00 179.01 176.42 1wix n HIS 133 N -3.79 0.92 -0.32 0.92 8.25 0.20 -4.20 115.22 117.20 1wix n HIS 133 Ca 0.10 0.36 0.28 0.00 -0.26 0.00 0.00 57.72 58.21 1wix n HIS 133 Cb 0.73 -1.10 0.53 0.00 1.12 0.00 0.00 29.99 31.27 1wix n HIS 133 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1wix n ILE 134 N -4.26 -0.41 -0.20 1.59 -0.00 0.54 0.22 119.36 116.84 1wix n ILE 134 Ca -0.35 2.02 -0.04 0.00 -0.00 0.00 0.00 62.75 64.38 1wix n ILE 134 Cb 0.76 -3.22 0.15 0.00 -0.00 0.00 0.00 39.64 37.34 1wix n ILE 134 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.55 176.62 1wix h LYS 135 N 0.00 0.98 0.00 0.38 5.09 -1.67 -2.07 116.57 119.28 1wix h LYS 135 Ca 0.79 -0.18 -0.00 0.00 0.09 0.00 0.00 60.65 61.35 1wix h LYS 135 Cb 2.03 -0.16 -0.00 0.00 0.10 0.00 0.00 32.23 34.20 1wix h LYS 135 CO -0.78 0.82 -0.01 -0.91 -2.09 0.00 0.00 179.45 176.48 1wix h ASN 136 N 0.96 0.00 -0.04 7.07 4.21 0.25 -2.20 115.58 125.84 1wix h ASN 136 Ca 0.22 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.71 1wix h ASN 136 Cb 0.22 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.42 1wix h ASN 136 CO -0.02 0.01 -0.05 0.40 -1.29 0.00 0.00 177.43 176.48 1wix h ILE 137 N 0.00 1.41 -0.95 2.81 5.03 -1.09 -3.19 117.51 121.53 1wix h ILE 137 Ca -0.00 -1.28 0.04 0.00 -0.12 0.00 0.00 64.86 63.50 1wix h ILE 137 Cb 0.01 2.18 -0.06 0.00 -3.03 0.00 0.00 36.82 35.93 1wix h ILE 137 CO 0.00 0.35 0.62 0.24 -0.68 0.00 0.00 178.15 178.68 1wix h MET 138 N -0.39 1.14 -0.02 2.37 2.86 -1.33 -0.48 114.93 119.08 1wix h MET 138 Ca 0.00 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1wix h MET 138 Cb 0.59 -0.26 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 1wix h MET 138 CO 0.01 0.76 0.03 1.79 1.06 0.00 0.00 176.91 180.56 1wix h THR 139 N 1.18 0.30 -2.24 2.22 1.35 -1.41 -3.43 112.91 110.88 1wix h THR 139 Ca 0.39 0.00 -0.17 0.00 -0.55 0.00 0.00 66.41 66.08 1wix h THR 139 Cb 0.05 0.97 0.09 0.00 -1.73 0.00 0.00 68.15 67.53 1wix h THR 139 CO -0.13 0.00 0.03 0.18 -0.25 0.00 0.00 175.52 175.36 1wix n LEU 140 N -3.51 0.00 -4.79 3.87 4.77 -0.19 -5.02 117.00 112.12 1wix n LEU 140 Ca -0.03 -0.48 -0.30 0.00 -0.03 0.00 0.00 56.01 55.17 1wix n LEU 140 Cb 0.11 -0.43 0.11 0.00 -2.33 0.00 0.00 43.42 40.88 1wix n LEU 140 CO 0.24 -1.58 0.71 -0.70 -1.33 0.00 0.00 177.39 174.73 1wix s GLU 141 N -4.05 1.75 0.05 3.23 2.56 -1.26 -4.84 118.70 116.14 1wix s GLU 141 Ca 0.30 0.56 -0.21 0.00 0.00 0.00 0.00 54.97 55.62 1wix s GLU 141 Cb -0.03 -1.89 -0.13 0.00 2.00 0.00 0.00 34.13 34.08 1wix s GLU 141 CO 0.24 -1.84 1.45 1.49 -0.56 0.00 0.00 175.26 176.04 1wix h GLU 142 N -1.24 0.24 0.51 4.30 4.81 -1.95 0.49 114.58 121.74 1wix h GLU 142 Ca -0.48 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 58.64 1wix h GLU 142 Cb 1.29 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.66 1wix h GLU 142 CO 0.60 0.51 -0.25 0.66 -0.73 0.00 0.00 179.01 179.80 1wix h SER 143 N -0.05 -0.58 -0.31 1.04 4.64 -2.01 -2.67 113.55 113.61 1wix h SER 143 Ca 0.03 0.02 0.01 0.00 -0.47 0.00 0.00 61.79 61.38 1wix h SER 143 Cb 0.41 0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.63 1wix h SER 143 CO 0.01 -0.41 0.18 1.62 -0.87 0.00 0.00 176.83 177.36 1wix h VAL 144 N -0.70 1.04 -0.98 0.95 3.04 -1.93 -2.38 116.25 115.29 1wix h VAL 144 Ca -0.07 -0.13 0.27 0.00 -1.01 0.00 0.00 66.70 65.76 1wix h VAL 144 Cb 0.53 0.63 -0.13 0.00 -2.01 0.00 0.00 31.29 30.30 1wix h VAL 144 CO 0.12 0.07 0.55 1.56 -1.01 0.00 0.00 177.57 178.85 1wix h GLN 145 N 0.38 0.44 0.37 4.17 4.20 -0.80 0.34 115.11 124.21 1wix h GLN 145 Ca 0.12 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.79 1wix h GLN 145 Cb -0.00 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.67 1wix h GLN 145 CO -0.05 0.29 -0.22 1.25 -0.67 0.00 0.00 178.83 179.43 1wix h HIS 146 N 0.46 -0.59 -0.49 2.96 -0.00 -1.07 0.66 115.15 117.07 1wix h HIS 146 Ca 0.66 -0.01 0.10 0.00 -0.00 0.00 0.00 60.37 61.12 1wix h HIS 146 Cb 1.35 0.21 -0.08 0.00 -0.00 0.00 0.00 27.41 28.89 1wix h HIS 146 CO -0.03 -0.34 -0.02 0.28 -0.00 0.00 0.00 177.93 177.82 1wix h VAL 147 N -0.56 0.59 -0.67 5.26 2.07 -1.36 0.24 116.25 121.84 1wix h VAL 147 Ca -0.05 -0.03 0.09 0.00 0.82 0.00 0.00 66.70 67.53 1wix h VAL 147 Cb 0.44 0.49 -0.07 0.00 -1.52 0.00 0.00 31.29 30.64 1wix h VAL 147 CO 0.05 0.02 0.31 0.58 0.02 0.00 0.00 177.57 178.56 1wix h VAL 148 N 0.09 0.84 -0.13 2.57 2.07 -0.90 -0.65 116.25 120.15 1wix h VAL 148 Ca 0.25 -0.19 -0.13 0.00 0.82 0.00 0.00 66.70 67.45 1wix h VAL 148 Cb 0.37 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1wix h VAL 148 CO -0.43 0.10 -0.47 0.24 0.02 0.00 0.00 177.57 177.03 1wix h MET 149 N 0.55 0.33 -0.18 1.57 2.86 0.42 -3.18 114.93 117.29 1wix h MET 149 Ca 0.33 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.78 1wix h MET 149 Cb 0.35 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1wix h MET 149 CO -0.27 0.73 0.06 1.15 1.06 0.00 0.00 176.91 179.65 1wix h THR 150 N 0.26 1.17 -0.91 2.22 2.02 0.71 -3.02 112.91 115.37 1wix h THR 150 Ca 0.02 -0.54 0.22 0.00 0.77 0.00 0.00 66.41 66.87 1wix h THR 150 Cb 0.93 1.19 -0.17 0.00 -1.74 0.00 0.00 68.15 68.37 1wix h THR 150 CO 0.08 0.17 -0.06 0.00 0.37 0.00 0.00 175.52 176.08 1wix h ALA 151 N 0.89 0.90 0.08 6.16 0.00 -1.15 0.15 119.26 126.29 1wix h ALA 151 Ca 0.06 0.32 0.02 0.00 0.00 0.00 0.00 54.91 55.31 1wix h ALA 151 Cb 0.21 0.58 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1wix h ALA 151 CO -0.00 -0.47 -0.18 0.82 0.00 0.00 0.00 179.25 179.42 1wix h ILE 152 N 0.03 0.59 -0.97 0.00 5.03 -1.63 0.15 117.51 120.70 1wix h ILE 152 Ca 0.50 0.00 0.11 0.00 -0.12 0.00 0.00 64.86 65.35 1wix h ILE 152 Cb 0.92 0.59 -0.08 0.00 -3.03 0.00 0.00 36.82 35.22 1wix h ILE 152 CO -0.87 0.00 0.61 1.56 -0.68 0.00 0.00 178.15 178.77 1wix h GLN 153 N -0.33 0.96 -0.28 2.37 1.08 -0.76 -0.75 115.11 117.39 1wix h GLN 153 Ca 0.03 -0.06 -0.13 0.00 -1.45 0.00 0.00 58.65 57.04 1wix h GLN 153 Cb 0.36 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 1wix h GLN 153 CO -0.12 0.63 -0.38 1.49 -0.95 0.00 0.00 178.83 179.51 1wix h GLU 154 N 0.98 0.64 -0.76 1.46 4.81 -0.51 -1.84 114.58 119.36 1wix h GLU 154 Ca 0.47 -0.32 -0.05 0.00 -0.13 0.00 0.00 59.36 59.33 1wix h GLU 154 Cb 0.43 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 1wix h GLU 154 CO -0.25 0.92 0.28 -0.07 -0.73 0.00 0.00 179.01 179.15 1wix h LEU 155 N 0.53 1.07 -0.19 1.64 3.38 0.66 0.12 115.31 122.53 1wix h LEU 155 Ca 0.05 -0.19 -0.13 0.00 0.09 0.00 0.00 57.88 57.71 1wix h LEU 155 Cb 0.89 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1wix h LEU 155 CO 0.08 0.97 -0.37 0.24 0.09 0.00 0.00 178.44 179.45 1wix h MET 156 N 1.11 0.59 -0.24 1.13 2.86 -1.17 -0.74 114.93 118.47 1wix h MET 156 Ca 0.25 -0.38 -0.02 0.00 -2.06 0.00 0.00 59.70 57.49 1wix h MET 156 Cb 0.25 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 1wix h MET 156 CO -0.02 0.99 0.06 1.03 1.06 0.00 0.00 176.91 180.03 1wix h SER 157 N 0.26 0.36 -0.41 1.22 0.87 -1.18 -3.11 113.55 111.56 1wix h SER 157 Ca 0.01 -0.23 -0.06 0.00 -1.23 0.00 0.00 61.79 60.28 1wix h SER 157 Cb 0.97 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.82 1wix h SER 157 CO 0.08 0.50 0.03 0.11 -0.53 0.00 0.00 176.83 177.02 1wix h LYS 158 N 0.21 0.70 -0.73 2.24 1.79 -0.82 -3.17 116.57 116.79 1wix h LYS 158 Ca 0.07 -0.21 0.12 0.00 -2.18 0.00 0.00 60.65 58.46 1wix h LYS 158 Cb 0.28 -0.07 -0.12 0.00 -1.58 0.00 0.00 32.23 30.73 1wix h LYS 158 CO 0.00 0.77 -0.25 0.45 -1.08 0.00 0.00 179.45 179.34 1wix n SER 159 N -4.47 -0.40 0.00 0.86 2.88 -0.28 -4.23 113.62 107.99 1wix n SER 159 Ca -0.01 1.26 0.00 0.00 -1.33 0.00 0.00 58.87 58.80 1wix n SER 159 Cb 0.27 -0.32 0.00 0.00 -0.75 0.00 0.00 64.21 63.40 1wix n SER 159 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wix n GLY 160 N -1.39 2.27 3.77 0.46 0.00 -1.20 -4.20 105.19 104.90 1wix n GLY 160 Ca 0.09 -0.72 -0.37 0.00 0.00 0.00 0.00 46.02 45.02 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 0.00 3.71 -0.04 1.61 0.04 -1.26 -5.01 135.00 134.05 1wix s PRO 161 Ca 0.00 1.76 -0.01 0.00 0.04 0.00 0.00 61.00 62.78 1wix s PRO 161 Cb 0.00 -2.36 0.03 0.00 0.04 0.00 0.00 34.50 32.21 1wix s PRO 161 CO 0.00 -0.59 0.07 0.45 0.04 0.00 0.00 177.00 176.97 1wix s SER 162 N -1.40 0.48 0.09 6.66 0.15 -1.26 -5.03 113.70 113.40 1wix s SER 162 Ca 0.65 0.12 -0.25 0.00 0.70 0.00 0.00 55.95 57.17 1wix s SER 162 Cb -0.28 -0.02 -0.14 0.00 -1.71 0.00 0.00 66.02 63.87 1wix s SER 162 CO 0.34 -0.19 0.56 -1.54 1.20 0.00 0.00 173.24 173.61 1wix n SER 163 N 4.70 -0.60 0.00 5.45 3.41 -1.26 -5.28 113.62 120.05 1wix n SER 163 Ca -0.17 0.87 0.00 0.00 -0.26 0.00 0.00 58.87 59.32 1wix n SER 163 Cb 0.50 -0.72 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 1wix n SER 163 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49