#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 0.09 0.37 1.61 0.02 -2.06 -3.30 113.55 110.28 1wix h SER 2 Ca 0.00 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.84 1wix h SER 2 Cb 0.00 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.52 1wix h SER 2 CO 0.00 0.15 -0.18 0.28 -1.14 0.00 0.00 176.83 175.95 1wix h SER 3 N 0.02 -0.42 0.00 3.07 0.02 -2.03 -3.50 113.55 110.70 1wix h SER 3 Ca 0.03 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1wix h SER 3 Cb 0.08 0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.73 1wix h SER 3 CO -0.00 -0.07 0.00 0.61 -1.14 0.00 0.00 176.83 176.22 1wix n GLY 4 N 0.32 2.85 3.91 -3.77 0.00 -1.25 -4.94 105.19 102.31 1wix n GLY 4 Ca -0.06 -1.10 -0.28 0.00 0.00 0.00 0.00 46.02 44.58 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 -2.61 -4.66 1.61 2.88 -1.26 -4.84 113.62 104.74 1wix n SER 5 Ca 0.00 -0.87 -0.42 0.00 -1.33 0.00 0.00 58.87 56.25 1wix n SER 5 Cb 0.00 -3.60 -0.03 0.00 -0.75 0.00 0.00 64.21 59.84 1wix n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wix s SER 6 N -3.83 6.48 0.09 -3.46 0.01 -1.26 -4.98 113.70 106.74 1wix s SER 6 Ca 0.35 2.44 0.00 0.00 1.31 0.00 0.00 55.95 60.05 1wix s SER 6 Cb -0.18 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.52 1wix s SER 6 CO 0.85 -1.06 0.00 0.61 0.41 0.00 0.00 173.24 174.06 1wix n GLY 7 N 4.45 -2.01 3.18 3.44 0.00 -1.26 -4.98 105.19 108.01 1wix n GLY 7 Ca 0.19 -1.43 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 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 -2.65 0.02 0.99 -0.00 -1.26 -4.36 117.00 109.73 1wix n LEU 8 Ca 0.00 -0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 55.88 1wix n LEU 8 Cb 0.00 -0.82 -0.09 0.00 -0.00 0.00 0.00 43.42 42.51 1wix n LEU 8 CO 0.00 -3.24 0.58 1.55 -0.00 0.00 0.00 177.39 176.29 1wix h PRO 9 N -1.57 -0.10 -1.39 1.47 0.13 -1.93 0.67 132.00 129.27 1wix h PRO 9 Ca -0.47 0.01 0.40 0.00 -0.87 0.00 0.00 66.00 65.07 1wix h PRO 9 Cb 1.36 0.02 -0.06 0.00 0.13 0.00 0.00 31.00 32.46 1wix h PRO 9 CO 0.31 0.35 1.19 1.25 -0.23 0.00 0.00 178.00 180.87 1wix h LEU 10 N -0.59 0.00 0.00 1.56 5.85 -1.94 0.37 115.31 120.56 1wix h LEU 10 Ca -0.01 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.48 1wix h LEU 10 Cb 0.50 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 1wix h LEU 10 CO 0.02 0.00 -1.85 0.00 -0.34 0.00 0.00 178.44 176.26 1wix n ASP 12 N -2.77 0.00 -0.06 0.00 2.03 0.23 -2.57 116.55 113.41 1wix n ASP 12 Ca -0.24 0.27 -0.12 0.00 0.52 0.00 0.00 54.79 55.21 1wix n ASP 12 Cb 0.82 -0.36 -0.04 0.00 -0.72 0.00 0.00 41.12 40.82 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 -1.36 1.00 -0.33 1.67 7.64 0.10 -4.61 113.62 117.73 1wix n SER 13 Ca 0.04 0.17 0.15 0.00 1.01 0.00 0.00 58.87 60.24 1wix n SER 13 Cb 0.10 -0.40 0.35 0.00 -1.01 0.00 0.00 64.21 63.24 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 -0.46 0.55 -0.51 -3.43 3.38 -1.63 -0.02 115.31 113.20 1wix h LEU 14 Ca -0.28 0.14 0.10 0.00 0.09 0.00 0.00 57.88 57.93 1wix h LEU 14 Cb 1.16 0.06 -0.09 0.00 0.09 0.00 0.00 40.66 41.88 1wix h LEU 14 CO -0.17 0.08 -0.05 0.40 0.09 0.00 0.00 178.44 178.79 1wix h ILE 15 N 0.53 0.55 -0.72 1.22 2.04 -1.76 0.14 117.51 119.50 1wix h ILE 15 Ca 0.60 -0.02 0.14 0.00 1.00 0.00 0.00 64.86 66.58 1wix h ILE 15 Cb 1.13 0.48 -0.05 0.00 -0.74 0.00 0.00 36.82 37.65 1wix h ILE 15 CO -0.49 0.01 0.48 0.40 0.00 0.00 0.00 178.15 178.56 1wix h ILE 16 N 0.06 0.81 -0.00 -0.67 2.04 -1.25 -0.99 117.51 117.52 1wix h ILE 16 Ca 0.25 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.97 1wix h ILE 16 Cb 0.39 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1wix h ILE 16 CO -0.47 0.07 -0.00 -0.25 0.00 0.00 0.00 178.15 177.50 1wix h TRP 17 N 0.41 0.01 -0.05 1.37 7.01 -0.71 -3.12 115.95 120.87 1wix h TRP 17 Ca 0.35 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.36 1wix h TRP 17 Cb 0.79 -0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 27.85 1wix h TRP 17 CO -0.00 0.57 0.05 1.25 -2.79 0.00 0.00 178.44 177.52 1wix h LEU 18 N -0.56 0.00 -1.29 0.65 7.12 -0.51 -1.66 115.31 119.07 1wix h LEU 18 Ca 0.00 0.00 0.11 0.00 0.13 0.00 0.00 57.88 58.12 1wix h LEU 18 Cb 0.57 0.00 -0.06 0.00 -0.53 0.00 0.00 40.66 40.64 1wix h LEU 18 CO 0.00 0.00 0.55 1.56 -0.13 0.00 0.00 178.44 180.42 1wix h GLN 19 N 0.00 0.74 -1.13 1.25 4.20 -1.14 -1.11 115.11 117.92 1wix h GLN 19 Ca 0.03 -0.04 0.33 0.00 0.06 0.00 0.00 58.65 59.02 1wix h GLN 19 Cb 0.13 -0.17 -0.05 0.00 0.30 0.00 0.00 27.48 27.70 1wix h GLN 19 CO -0.00 0.49 1.05 1.79 -0.67 0.00 0.00 178.83 181.49 1wix h THR 20 N 0.76 0.14 -3.14 -0.54 1.35 -1.41 -3.30 112.91 106.76 1wix h THR 20 Ca 0.41 0.00 -0.69 0.00 -0.55 0.00 0.00 66.41 65.58 1wix h THR 20 Cb 0.52 0.20 -0.18 0.00 -1.73 0.00 0.00 68.15 66.96 1wix h THR 20 CO -0.17 0.00 0.09 -0.36 -0.25 0.00 0.00 175.52 174.83 1wix s PHE 21 N -4.64 3.02 -0.08 4.73 0.40 -0.42 -4.92 117.98 116.07 1wix s PHE 21 Ca -0.04 -0.64 0.00 0.00 -0.60 0.00 0.00 56.93 55.66 1wix s PHE 21 Cb 0.18 -3.69 0.08 0.00 0.51 0.00 0.00 43.02 40.10 1wix s PHE 21 CO 0.63 -1.12 1.53 0.36 0.70 0.00 0.00 175.22 177.31 1wix n LYS 22 N 6.28 1.20 -0.90 0.44 2.85 -1.25 -4.88 118.16 121.92 1wix n LYS 22 Ca -0.07 -0.44 -0.35 0.00 -1.05 0.00 0.00 58.31 56.40 1wix n LYS 22 Cb 0.45 -1.17 0.08 0.00 -0.65 0.00 0.00 35.03 33.73 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 0.67 0.00 -0.28 0.58 -2.24 -1.26 -4.66 114.28 107.10 1wix n THR 23 Ca 0.09 -0.30 0.33 0.00 -2.27 0.00 0.00 64.05 61.89 1wix n THR 23 Cb 0.60 -0.26 0.58 0.00 -2.10 0.00 0.00 70.33 69.15 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 -1.31 3.06 -3.29 6.98 0.00 -1.97 -3.35 119.26 119.38 1wix h ALA 24 Ca -0.44 -0.04 -0.62 0.00 0.00 0.00 0.00 54.91 53.80 1wix h ALA 24 Cb 1.32 0.09 -0.18 0.00 0.00 0.00 0.00 17.79 19.01 1wix h ALA 24 CO 0.28 -1.73 -0.61 0.45 0.00 0.00 0.00 179.25 177.64 1wix s SER 25 N -3.90 5.26 1.13 0.00 0.15 -1.26 -5.10 113.70 109.97 1wix s SER 25 Ca -0.03 -0.01 -0.17 0.00 0.70 0.00 0.00 55.95 56.43 1wix s SER 25 Cb 0.17 -1.88 0.25 0.00 -1.71 0.00 0.00 66.02 62.85 1wix s SER 25 CO 0.59 0.17 1.10 -2.16 1.20 0.00 0.00 173.24 174.14 1wix s PRO 26 N 0.37 -0.66 -0.25 5.44 0.04 -1.26 -4.73 135.00 133.96 1wix s PRO 26 Ca -0.00 0.14 -0.03 0.00 0.04 0.00 0.00 61.00 61.15 1wix s PRO 26 Cb -0.13 -1.64 0.14 0.00 0.04 0.00 0.00 34.50 32.90 1wix s PRO 26 CO 0.01 -3.38 0.40 0.00 0.04 0.00 0.00 177.00 174.08 1wix n GLN 28 N 5.37 0.00 -2.57 0.00 6.02 -1.26 -4.80 117.38 120.14 1wix n GLN 28 Ca -0.04 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 56.82 1wix n GLN 28 Cb 0.50 -0.02 0.02 0.00 1.02 0.00 0.00 30.24 31.75 1wix n GLN 28 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1wix n ASP 29 N -2.58 1.71 0.08 1.08 2.03 -1.26 -4.94 116.55 112.66 1wix n ASP 29 Ca 0.00 -2.02 -0.07 0.00 0.52 0.00 0.00 54.79 53.22 1wix n ASP 29 Cb 0.00 -0.11 -0.07 0.00 -0.72 0.00 0.00 41.12 40.22 1wix n ASP 29 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 1wix h VAL 30 N 0.39 1.65 0.00 5.18 -1.51 -1.96 -3.10 116.25 116.89 1wix h VAL 30 Ca -0.18 -3.16 0.00 0.00 -1.23 0.00 0.00 66.70 62.13 1wix h VAL 30 Cb 0.73 2.73 0.00 0.00 -2.13 0.00 0.00 31.29 32.62 1wix h VAL 30 CO 0.28 0.90 0.00 0.11 -1.23 0.00 0.00 177.57 177.63 1wix h LYS 31 N 0.02 0.00 0.00 5.19 1.57 -1.96 0.32 116.57 121.71 1wix h LYS 31 Ca -0.02 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.51 1wix h LYS 31 Cb 1.67 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.94 1wix h LYS 31 CO 0.13 0.00 -1.52 1.96 -0.57 0.00 0.00 179.45 179.45 1wix h GLN 32 N 0.00 0.00 0.00 3.15 4.20 -1.95 -3.36 115.11 117.15 1wix h GLN 32 Ca 0.00 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 1wix h GLN 32 Cb 0.47 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 1wix h GLN 32 CO 0.00 0.51 -1.47 1.28 -0.67 0.00 0.00 178.83 178.48 1wix n LEU 33 N -3.05 0.63 0.09 1.46 4.77 -1.03 -4.14 117.00 115.72 1wix n LEU 33 Ca -0.13 0.26 0.16 0.00 -0.03 0.00 0.00 56.01 56.28 1wix n LEU 33 Cb 0.98 0.05 0.44 0.00 -2.33 0.00 0.00 43.42 42.56 1wix n LEU 33 CO 0.45 0.04 1.15 0.71 -1.33 0.00 0.00 177.39 178.40 1wix h THR 34 N 0.00 0.07 0.02 -5.08 1.35 -0.51 0.29 112.91 109.06 1wix h THR 34 Ca -0.11 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.75 1wix h THR 34 Cb 1.34 0.24 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 1wix h THR 34 CO 0.02 0.00 -0.01 -1.13 -0.25 0.00 0.00 175.52 174.15 1wix h ASN 35 N 0.00 -0.02 0.00 5.36 -0.73 -1.81 -3.44 115.58 114.94 1wix h ASN 35 Ca 0.21 -0.18 0.00 0.00 1.87 0.00 0.00 56.30 58.20 1wix h ASN 35 Cb 1.92 0.01 0.00 0.00 0.27 0.00 0.00 38.32 40.51 1wix h ASN 35 CO -0.00 0.17 0.00 0.61 -0.37 0.00 0.00 177.43 177.84 1wix n GLY 36 N -0.59 3.17 0.00 1.57 0.00 0.10 -3.78 105.19 105.66 1wix n GLY 36 Ca -0.08 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.91 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 0.00 -0.33 1.61 0.31 -1.26 0.90 118.33 119.56 1wix n VAL 37 Ca 0.00 1.27 0.31 0.00 -0.01 0.00 0.00 64.34 65.92 1wix n VAL 37 Cb 0.00 -1.70 0.57 0.00 -0.91 0.00 0.00 33.84 31.80 1wix n VAL 37 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1wix n THR 38 N -2.80 -0.35 0.09 2.52 -1.04 -1.26 -0.40 114.28 111.04 1wix n THR 38 Ca 0.00 1.83 -0.08 0.00 -2.04 0.00 0.00 64.05 63.77 1wix n THR 38 Cb 0.00 -2.98 -0.05 0.00 -1.82 0.00 0.00 70.33 65.48 1wix n THR 38 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 1wix h MET 39 N 0.00 -0.31 -0.92 -2.82 2.86 0.20 -3.18 114.93 110.76 1wix h MET 39 Ca 0.79 0.02 0.24 0.00 -2.06 0.00 0.00 59.70 58.69 1wix h MET 39 Cb 2.22 0.07 -0.13 0.00 0.06 0.00 0.00 31.60 33.82 1wix h MET 39 CO -0.65 -0.07 0.42 0.00 1.06 0.00 0.00 176.91 177.67 1wix h ALA 40 N -0.84 1.52 0.00 6.32 0.00 0.26 0.86 119.26 127.37 1wix h ALA 40 Ca -0.03 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1wix h ALA 40 Cb 0.38 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1wix h ALA 40 CO 0.05 -0.37 -0.04 1.96 0.00 0.00 0.00 179.25 180.86 1wix h GLN 41 N 0.39 0.00 0.04 0.00 4.20 -0.81 -1.89 115.11 117.04 1wix h GLN 41 Ca 0.59 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 59.05 1wix h GLN 41 Cb 1.15 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.94 1wix h GLN 41 CO -0.54 0.04 -1.04 0.28 -0.67 0.00 0.00 178.83 176.90 1wix h VAL 42 N 0.00 1.39 -0.90 -0.54 2.07 0.76 -3.25 116.25 115.77 1wix h VAL 42 Ca -0.00 -2.52 0.06 0.00 0.82 0.00 0.00 66.70 65.07 1wix h VAL 42 Cb 0.08 2.53 -0.06 0.00 -1.52 0.00 0.00 31.29 32.32 1wix h VAL 42 CO 0.00 0.75 0.59 -0.07 0.02 0.00 0.00 177.57 178.86 1wix h LEU 43 N 0.23 0.90 -2.52 2.57 -0.00 -0.80 0.74 115.31 116.44 1wix h LEU 43 Ca -0.11 0.01 -0.00 0.00 -0.00 0.00 0.00 57.88 57.77 1wix h LEU 43 Cb 1.69 -0.19 -0.00 0.00 -0.00 0.00 0.00 40.66 42.17 1wix h LEU 43 CO 0.18 0.58 -0.02 -0.74 -0.00 0.00 0.00 178.44 178.44 1wix h HIS 44 N 1.02 0.00 0.04 1.13 2.76 -1.57 -2.55 115.15 115.97 1wix h HIS 44 Ca 0.39 0.00 -0.17 0.00 -2.20 0.00 0.00 60.37 58.39 1wix h HIS 44 Cb 0.20 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 1wix h HIS 44 CO -0.00 0.02 -0.88 1.96 -1.30 0.00 0.00 177.93 177.73 1wix h GLN 45 N 0.00 0.08 0.27 5.26 4.20 -0.99 -2.95 115.11 120.98 1wix h GLN 45 Ca -0.00 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.57 1wix h GLN 45 Cb 0.12 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 1wix h GLN 45 CO 0.00 1.07 -0.42 0.82 -0.67 0.00 0.00 178.83 179.63 1wix h ILE 46 N -0.78 0.00 -2.56 2.54 2.04 -1.10 -3.37 117.51 114.28 1wix h ILE 46 Ca -0.22 0.00 -0.60 0.00 1.00 0.00 0.00 64.86 65.05 1wix h ILE 46 Cb 1.35 0.00 -0.39 0.00 -0.74 0.00 0.00 36.82 37.04 1wix h ILE 46 CO -0.05 0.00 -0.86 -0.90 0.00 0.00 0.00 178.15 176.34 1wix n ASP 47 N -4.87 0.63 -0.29 1.72 5.75 -0.99 -4.81 116.55 113.69 1wix n ASP 47 Ca -0.08 -2.65 0.25 0.00 -0.01 0.00 0.00 54.79 52.30 1wix n ASP 47 Cb 0.35 -0.62 0.59 0.00 -1.03 0.00 0.00 41.12 40.41 1wix n ASP 47 CO 0.00 0.00 0.00 1.62 -0.11 0.00 0.00 177.20 178.71 1wix h VAL 48 N 4.46 0.53 0.09 2.12 3.04 -1.68 0.22 116.25 125.05 1wix h VAL 48 Ca 0.23 -0.09 0.02 0.00 -1.01 0.00 0.00 66.70 65.85 1wix h VAL 48 Cb 0.86 0.24 -0.05 0.00 -2.01 0.00 0.00 31.29 30.33 1wix h VAL 48 CO 0.48 0.05 -0.42 0.00 -1.01 0.00 0.00 177.57 176.68 1wix h ALA 49 N 1.57 -0.72 0.01 3.17 0.00 -1.93 -2.34 119.26 119.02 1wix h ALA 49 Ca 0.54 -0.07 -0.20 0.00 0.00 0.00 0.00 54.91 55.19 1wix h ALA 49 Cb 1.62 0.71 -0.02 0.00 0.00 0.00 0.00 17.79 20.10 1wix h ALA 49 CO -0.18 -0.98 -0.93 2.35 0.00 0.00 0.00 179.25 179.52 1wix h TRP 50 N -0.63 0.10 -3.38 0.00 2.91 -1.67 -3.38 115.95 109.90 1wix h TRP 50 Ca 0.03 -0.06 -0.68 0.00 1.13 0.00 0.00 58.89 59.31 1wix h TRP 50 Cb 0.67 -0.01 -0.37 0.00 -0.51 0.00 0.00 29.16 28.94 1wix h TRP 50 CO -0.38 0.95 -0.37 -0.06 -1.03 0.00 0.00 178.44 177.55 1wix s PHE 51 N -2.97 3.52 0.55 2.65 0.08 0.68 -4.98 117.98 117.51 1wix s PHE 51 Ca -0.01 -2.99 0.07 0.00 0.12 0.00 0.00 56.93 54.12 1wix s PHE 51 Cb 0.10 -3.06 0.06 0.00 -0.57 0.00 0.00 43.02 39.56 1wix s PHE 51 CO 0.82 -0.74 0.75 0.45 -0.10 0.00 0.00 175.22 176.40 1wix s SER 52 N -0.10 5.18 0.58 1.36 0.15 -0.91 -4.16 113.70 115.80 1wix s SER 52 Ca 0.21 -0.55 0.28 0.00 0.70 0.00 0.00 55.95 56.59 1wix s SER 52 Cb -0.15 -0.18 1.69 0.00 -1.71 0.00 0.00 66.02 65.67 1wix s SER 52 CO -0.08 -1.22 2.17 -0.33 1.20 0.00 0.00 173.24 174.99 1wix h GLU 53 N 0.21 0.00 0.00 5.44 5.08 -1.97 -0.23 114.58 123.11 1wix h GLU 53 Ca -0.35 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.97 1wix h GLU 53 Cb 1.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1wix h GLU 53 CO 0.43 0.00 -0.20 0.77 -1.00 0.00 0.00 179.01 179.02 1wix h SER 54 N 0.00 0.00 0.06 1.42 0.02 -1.98 0.49 113.55 113.56 1wix h SER 54 Ca 0.04 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.74 1wix h SER 54 Cb 0.23 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 1wix h SER 54 CO -0.00 0.20 -1.32 -0.25 -1.14 0.00 0.00 176.83 174.32 1wix h TRP 55 N 0.00 0.23 0.00 3.45 7.01 -1.43 -3.34 115.95 121.87 1wix h TRP 55 Ca -0.00 -0.17 0.00 0.00 2.11 0.00 0.00 58.89 60.83 1wix h TRP 55 Cb 0.36 -0.01 0.00 0.00 -2.10 0.00 0.00 29.16 27.41 1wix h TRP 55 CO 0.00 1.52 0.00 -0.11 -2.79 0.00 0.00 178.44 177.06 1wix n LEU 56 N -4.12 0.63 0.26 0.65 7.94 -0.92 -1.95 117.00 119.49 1wix n LEU 56 Ca -0.28 0.68 0.15 0.00 -1.11 0.00 0.00 56.01 55.46 1wix n LEU 56 Cb 0.80 -0.63 0.61 0.00 0.53 0.00 0.00 43.42 44.72 1wix n LEU 56 CO 0.32 -0.64 0.94 0.28 -1.11 0.00 0.00 177.39 177.18 1wix h SER 57 N 0.00 0.00 0.93 1.96 0.02 -1.01 -2.38 113.55 113.06 1wix h SER 57 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1wix h SER 57 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1wix h SER 57 CO 0.00 0.05 -0.30 0.54 -1.14 0.00 0.00 176.83 175.99 1wix n ARG 58 N -3.17 0.13 -3.00 3.45 1.74 -0.82 -4.83 116.66 110.16 1wix n ARG 58 Ca 0.01 0.07 -0.40 0.00 -0.77 0.00 0.00 57.85 56.76 1wix n ARG 58 Cb 0.35 -1.61 -0.05 0.00 -1.02 0.00 0.00 32.46 30.12 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 -3.06 4.72 0.29 0.55 -1.09 -0.90 -4.95 121.20 116.76 1wix s ILE 59 Ca 0.10 1.61 0.10 0.00 -2.23 0.00 0.00 60.65 60.24 1wix s ILE 59 Cb 0.16 -4.10 -0.05 0.00 -1.58 0.00 0.00 42.46 36.88 1wix s ILE 59 CO 0.64 0.38 -0.06 -0.54 -1.23 0.00 0.00 174.94 174.13 1wix s LYS 60 N -0.14 2.05 0.00 2.79 1.02 -1.26 -5.04 119.74 119.17 1wix s LYS 60 Ca 0.38 -1.62 0.00 0.00 0.02 0.00 0.00 55.97 54.75 1wix s LYS 60 Cb -0.21 -1.98 0.00 0.00 -0.52 0.00 0.00 37.83 35.13 1wix s LYS 60 CO 0.23 0.29 0.44 -3.47 -0.92 0.00 0.00 175.35 171.91 1wix n ASP 61 N -0.83 0.86 0.04 2.83 2.03 -1.26 -4.65 116.55 115.57 1wix n ASP 61 Ca -0.05 -1.06 0.03 0.00 0.52 0.00 0.00 54.79 54.22 1wix n ASP 61 Cb 0.60 0.00 0.15 0.00 -0.72 0.00 0.00 41.12 41.15 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 -0.03 0.14 -0.43 1.67 8.00 -1.26 -2.97 116.55 121.67 1wix n ASP 62 Ca 0.00 0.55 0.39 0.00 0.71 0.00 0.00 54.79 56.44 1wix n ASP 62 Cb 0.07 -0.57 0.59 0.00 -0.02 0.00 0.00 41.12 41.19 1wix n ASP 62 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1wix n VAL 63 N -1.68 0.00 -0.11 2.53 0.24 -1.26 -2.44 118.33 115.61 1wix n VAL 63 Ca -0.00 1.33 -0.02 0.00 -2.04 0.00 0.00 64.34 63.61 1wix n VAL 63 Cb 0.02 -2.31 -0.02 0.00 -1.47 0.00 0.00 33.84 30.07 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 -1.79 -0.65 0.52 7.63 0.00 -1.16 0.21 105.19 109.95 1wix n GLY 64 Ca 0.32 0.31 0.08 0.00 0.00 0.00 0.00 46.02 46.73 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 -4.35 2.02 -4.30 1.61 9.92 -1.02 -4.94 116.55 115.49 1wix n ASP 65 Ca 0.01 -1.51 -0.32 0.00 -0.53 0.00 0.00 54.79 52.44 1wix n ASP 65 Cb 0.08 0.24 -0.16 0.00 -0.64 0.00 0.00 41.12 40.64 1wix n ASP 65 CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 1wix s ASN 66 N -1.66 3.41 0.03 -2.24 0.01 0.56 -5.00 114.94 110.04 1wix s ASN 66 Ca 0.17 -0.45 0.22 0.00 -0.71 0.00 0.00 52.86 52.09 1wix s ASN 66 Cb 0.14 -1.21 -0.24 0.00 0.41 0.00 0.00 41.25 40.34 1wix s ASN 66 CO 0.31 0.21 0.63 -2.67 -1.51 0.00 0.00 177.10 174.07 1wix n TRP 67 N 3.21 0.28 -0.06 2.20 4.27 -1.26 -4.11 117.44 121.97 1wix n TRP 67 Ca -0.18 0.08 -0.14 0.00 -3.89 0.00 0.00 57.50 53.37 1wix n TRP 67 Cb 0.52 -0.65 -0.07 0.00 -1.36 0.00 0.00 31.31 29.76 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 0.54 -0.24 -2.67 3.08 -1.94 -3.02 114.38 110.13 1wix h ARG 68 Ca -0.02 -0.35 0.07 0.00 0.07 0.00 0.00 59.98 59.75 1wix h ARG 68 Cb 1.05 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 1wix h ARG 68 CO 0.00 0.96 0.28 0.82 -1.07 0.00 0.00 179.97 180.95 1wix h ILE 69 N 0.19 0.41 0.66 2.04 2.04 -1.94 -2.29 117.51 118.62 1wix h ILE 69 Ca 0.01 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 1wix h ILE 69 Cb 0.94 0.78 0.01 0.00 -0.74 0.00 0.00 36.82 37.80 1wix h ILE 69 CO 0.08 0.00 -0.32 0.11 0.00 0.00 0.00 178.15 178.02 1wix h LYS 70 N 0.00 -0.86 -0.26 2.37 1.57 -1.73 -3.08 116.57 114.58 1wix h LYS 70 Ca 0.11 0.06 0.06 0.00 -1.87 0.00 0.00 60.65 59.01 1wix h LYS 70 Cb 0.66 0.19 -0.07 0.00 0.08 0.00 0.00 32.23 33.09 1wix h LYS 70 CO -0.00 -0.53 -0.28 0.00 -0.57 0.00 0.00 179.45 178.06 1wix h ALA 71 N -0.84 -0.20 -0.98 3.86 0.00 -1.51 -1.37 119.26 118.23 1wix h ALA 71 Ca -0.09 0.07 0.24 0.00 0.00 0.00 0.00 54.91 55.13 1wix h ALA 71 Cb 0.72 0.59 -0.18 0.00 0.00 0.00 0.00 17.79 18.91 1wix h ALA 71 CO 0.15 -0.72 -0.08 1.03 0.00 0.00 0.00 179.25 179.64 1wix h SER 72 N -0.29 -0.65 0.56 0.00 0.87 -1.55 0.66 113.55 113.15 1wix h SER 72 Ca 0.14 0.28 -0.03 0.00 -1.23 0.00 0.00 61.79 60.95 1wix h SER 72 Cb 0.50 0.53 0.01 0.00 -0.44 0.00 0.00 62.40 63.00 1wix h SER 72 CO -0.42 -0.34 -0.27 0.78 -0.53 0.00 0.00 176.83 176.05 1wix h ASN 73 N 0.01 -0.64 -0.96 6.23 2.35 -1.18 -3.03 115.58 118.36 1wix h ASN 73 Ca 0.55 -0.04 0.29 0.00 -0.55 0.00 0.00 56.30 56.54 1wix h ASN 73 Cb 1.02 0.16 -0.15 0.00 0.05 0.00 0.00 38.32 39.41 1wix h ASN 73 CO -0.95 -0.31 0.42 -0.07 -1.65 0.00 0.00 177.43 174.87 1wix h LEU 74 N -0.98 0.28 0.40 1.61 4.07 -0.29 0.27 115.31 120.67 1wix h LEU 74 Ca -0.08 0.20 -0.01 0.00 0.08 0.00 0.00 57.88 58.07 1wix h LEU 74 Cb 0.64 0.20 -0.02 0.00 1.08 0.00 0.00 40.66 42.56 1wix h LEU 74 CO 0.13 -0.16 -0.45 0.11 -1.08 0.00 0.00 178.44 176.99 1wix h LYS 75 N 0.26 -0.82 -0.58 1.13 6.56 -0.89 -0.10 116.57 122.14 1wix h LYS 75 Ca 0.66 0.06 0.06 0.00 -1.06 0.00 0.00 60.65 60.37 1wix h LYS 75 Cb 1.45 0.19 -0.05 0.00 -0.57 0.00 0.00 32.23 33.25 1wix h LYS 75 CO -0.64 -0.55 0.28 0.87 -2.06 0.00 0.00 179.45 177.36 1wix h LYS 76 N -0.85 0.52 -0.42 3.15 1.57 -1.08 -0.27 116.57 119.18 1wix h LYS 76 Ca -0.05 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.78 1wix h LYS 76 Cb 0.75 -0.12 -0.07 0.00 0.08 0.00 0.00 32.23 32.87 1wix h LYS 76 CO -0.08 0.34 -0.03 0.28 -0.57 0.00 0.00 179.45 179.39 1wix h VAL 77 N 0.53 0.64 0.24 0.50 2.07 -0.71 0.34 116.25 119.87 1wix h VAL 77 Ca 0.27 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.75 1wix h VAL 77 Cb 0.21 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1wix h VAL 77 CO -0.20 0.01 -0.12 0.25 0.02 0.00 0.00 177.57 177.54 1wix h LEU 78 N 0.07 -0.28 -0.93 2.57 5.85 -0.48 -2.87 115.31 119.25 1wix h LEU 78 Ca 0.21 -0.18 0.14 0.00 0.84 0.00 0.00 57.88 58.89 1wix h LEU 78 Cb 0.31 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.32 1wix h LEU 78 CO -0.38 0.04 0.54 -0.74 -0.34 0.00 0.00 178.44 177.56 1wix h HIS 79 N -0.61 0.97 -0.99 1.25 2.76 -0.74 0.11 115.15 117.91 1wix h HIS 79 Ca -0.03 0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.20 1wix h HIS 79 Cb 0.44 -0.29 -0.06 0.00 1.55 0.00 0.00 27.41 29.05 1wix h HIS 79 CO 0.01 0.30 0.65 0.78 -1.30 0.00 0.00 177.93 178.37 1wix h GLY 80 N 0.79 1.43 0.15 5.26 0.00 -0.24 -1.51 103.07 108.95 1wix h GLY 80 Ca 0.49 -0.50 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wix h GLY 80 CO -0.32 0.43 -0.02 -2.22 0.00 0.00 0.00 176.54 174.42 1wix h ILE 81 N 1.26 1.32 -0.92 2.60 2.04 -0.91 -2.87 117.51 120.03 1wix h ILE 81 Ca 0.39 -1.76 0.22 0.00 1.00 0.00 0.00 64.86 64.71 1wix h ILE 81 Cb -0.02 2.40 -0.12 0.00 -0.74 0.00 0.00 36.82 38.34 1wix h ILE 81 CO -0.12 0.41 0.44 0.71 0.00 0.00 0.00 178.15 179.60 1wix h THR 82 N -0.90 0.51 -0.24 -0.27 1.35 -0.78 0.25 112.91 112.84 1wix h THR 82 Ca -0.00 -0.16 -0.14 0.00 -0.55 0.00 0.00 66.41 65.56 1wix h THR 82 Cb 0.70 0.01 -0.01 0.00 -1.73 0.00 0.00 68.15 67.12 1wix h THR 82 CO 0.01 0.08 -0.43 0.28 -0.25 0.00 0.00 175.52 175.21 1wix h SER 83 N 0.46 0.63 0.45 5.36 0.02 -1.37 -2.52 113.55 116.59 1wix h SER 83 Ca 0.57 -0.29 0.00 0.00 -0.84 0.00 0.00 61.79 61.23 1wix h SER 83 Cb 1.06 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.43 1wix h SER 83 CO -0.50 0.98 0.00 0.00 -1.14 0.00 0.00 176.83 176.16 1wix n TYR 84 N -4.02 0.40 -0.07 3.45 9.36 0.81 0.74 117.16 127.84 1wix n TYR 84 Ca -0.02 0.17 -0.11 0.00 3.32 0.00 0.00 57.90 61.26 1wix n TYR 84 Cb 0.53 -0.78 -0.15 0.00 -0.63 0.00 0.00 39.34 38.32 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 -1.88 0.40 0.03 2.98 4.01 -0.75 -2.31 117.16 119.64 1wix n TYR 85 Ca 0.02 0.13 0.05 0.00 -0.16 0.00 0.00 57.90 57.94 1wix n TYR 85 Cb 0.15 -1.07 -0.09 0.00 -0.31 0.00 0.00 39.34 38.02 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 -2.93 0.62 -0.02 -0.72 8.25 -0.65 0.17 115.22 119.94 1wix n HIS 86 Ca -0.29 0.20 -0.02 0.00 -0.26 0.00 0.00 57.72 57.35 1wix n HIS 86 Cb 1.10 -0.90 -0.01 0.00 1.12 0.00 0.00 29.99 31.31 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 -2.66 0.11 0.00 -0.41 1.02 0.23 -3.68 120.64 115.25 1wix n GLU 87 Ca -0.08 0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 1wix n GLU 87 Cb 0.73 -0.81 0.00 0.00 -0.02 0.00 0.00 31.44 31.34 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 -2.86 0.00 -0.14 -0.32 7.35 -1.18 -3.82 117.46 116.50 1wix n PHE 88 Ca -0.02 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.54 1wix n PHE 88 Cb 0.09 -0.44 -0.01 0.00 0.35 0.00 0.00 39.48 39.46 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 1.02 0.00 -2.13 3.38 -1.58 -3.48 115.31 112.53 1wix h LEU 89 Ca 0.00 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1wix h LEU 89 Cb 0.00 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.46 1wix h LEU 89 CO 0.00 1.24 0.00 0.61 0.09 0.00 0.00 178.44 180.38 1wix n GLY 90 N 0.05 2.98 2.83 0.83 0.00 0.33 -4.94 105.19 107.27 1wix n GLY 90 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.33 -3.16 -4.02 1.61 10.64 0.45 -4.36 117.38 118.21 1wix n GLN 91 Ca 0.00 -1.39 -0.23 0.00 -1.83 0.00 0.00 57.00 53.55 1wix n GLN 91 Cb 0.00 -1.40 -0.06 0.00 -0.86 0.00 0.00 30.24 27.92 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 -4.48 0.85 -5.00 2.61 10.64 -1.26 -1.63 117.38 119.11 1wix n GLN 92 Ca 0.12 -2.84 -0.29 0.00 -1.83 0.00 0.00 57.00 52.16 1wix n GLN 92 Cb 0.49 1.13 -0.16 0.00 -0.86 0.00 0.00 30.24 30.83 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 -2.60 1.70 0.41 -0.39 1.01 -1.26 -4.07 121.20 116.00 1wix s ILE 93 Ca 0.08 -0.84 -0.21 0.00 0.00 0.00 0.00 60.65 59.68 1wix s ILE 93 Cb 0.00 -1.47 -0.11 0.00 0.01 0.00 0.00 42.46 40.90 1wix s ILE 93 CO 0.06 0.48 0.94 -0.44 0.00 0.00 0.00 174.94 175.98 1wix s SER 94 N 0.19 6.97 0.41 3.58 0.01 -1.26 -4.89 113.70 118.71 1wix s SER 94 Ca -0.10 1.68 0.18 0.00 1.31 0.00 0.00 55.95 59.02 1wix s SER 94 Cb -0.15 -2.54 0.97 0.00 0.21 0.00 0.00 66.02 64.52 1wix s SER 94 CO 0.05 -0.32 1.48 -0.33 0.41 0.00 0.00 173.24 174.52 1wix h GLU 95 N 2.06 0.00 -0.01 12.44 5.08 -1.99 0.35 114.58 132.52 1wix h GLU 95 Ca -0.49 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.76 1wix h GLU 95 Cb 1.18 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 1wix h GLU 95 CO 0.62 0.00 -0.53 0.93 -1.00 0.00 0.00 179.01 179.02 1wix h GLU 96 N 0.00 0.03 0.00 2.33 4.39 -2.02 -3.15 114.58 116.16 1wix h GLU 96 Ca 0.00 -0.01 -0.20 0.00 0.34 0.00 0.00 59.36 59.49 1wix h GLU 96 Cb 0.58 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.20 1wix h GLU 96 CO 0.00 0.55 -1.84 1.28 -1.16 0.00 0.00 179.01 177.84 1wix n LEU 97 N -3.91 0.42 -4.47 1.33 4.77 0.12 -4.90 117.00 110.37 1wix n LEU 97 Ca -0.01 0.19 -0.47 0.00 -0.03 0.00 0.00 56.01 55.69 1wix n LEU 97 Cb 0.54 0.19 -0.08 0.00 -2.33 0.00 0.00 43.42 41.75 1wix n LEU 97 CO 0.41 0.23 1.91 -0.38 -1.33 0.00 0.00 177.39 178.23 1wix n ILE 98 N -2.72 0.11 -2.14 -0.08 2.08 -0.93 -4.59 119.36 111.08 1wix n ILE 98 Ca -0.16 -0.31 -0.43 0.00 0.56 0.00 0.00 62.75 62.41 1wix n ILE 98 Cb 0.89 -1.66 -0.03 0.00 -0.75 0.00 0.00 39.64 38.09 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 7.02 4.11 -0.88 0.38 0.04 -1.26 -4.93 135.00 139.48 1wix s PRO 99 Ca 1.12 1.93 -0.25 0.00 0.04 0.00 0.00 61.00 63.84 1wix s PRO 99 Cb -0.81 -3.94 -0.02 0.00 0.04 0.00 0.00 34.50 29.77 1wix s PRO 99 CO 0.45 -0.91 1.83 -0.51 0.04 0.00 0.00 177.00 177.90 1wix s ASP 100 N 3.17 5.43 0.23 6.66 1.11 -1.26 -4.81 116.67 127.21 1wix s ASP 100 Ca 0.68 -0.66 -0.07 0.00 0.18 0.00 0.00 52.55 52.67 1wix s ASP 100 Cb -0.28 -2.56 0.22 0.00 1.07 0.00 0.00 42.92 41.37 1wix s ASP 100 CO 0.25 -2.45 1.90 -0.07 1.18 0.00 0.00 175.17 175.99 1wix h LEU 101 N 16.62 1.07 -1.25 1.23 3.38 -1.95 -0.65 115.31 133.77 1wix h LEU 101 Ca 0.05 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.00 1wix h LEU 101 Cb 1.03 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.47 1wix h LEU 101 CO 1.25 0.80 0.52 0.78 0.09 0.00 0.00 178.44 181.87 1wix h ASN 102 N 1.25 0.86 0.86 -0.43 2.35 -1.99 0.43 115.58 118.92 1wix h ASN 102 Ca 0.33 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.07 1wix h ASN 102 Cb -0.11 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.05 1wix h ASN 102 CO -0.07 0.61 -0.21 0.00 -1.65 0.00 0.00 177.43 176.12 1wix n GLN 103 N -4.43 0.04 -0.05 0.81 6.02 -0.81 -1.70 117.38 117.26 1wix n GLN 103 Ca 0.09 0.02 -0.04 0.00 -0.01 0.00 0.00 57.00 57.07 1wix n GLN 103 Cb 0.07 -1.54 -0.14 0.00 1.02 0.00 0.00 30.24 29.65 1wix n GLN 103 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1wix n ILE 104 N -1.60 1.09 -0.05 5.09 5.41 -0.20 0.13 119.36 129.22 1wix n ILE 104 Ca 0.06 -0.75 -0.10 0.00 1.00 0.00 0.00 62.75 62.96 1wix n ILE 104 Cb 0.35 -0.48 -0.15 0.00 -0.71 0.00 0.00 39.64 38.66 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 -2.70 1.53 -0.07 1.39 -1.04 0.13 -2.49 114.28 111.03 1wix n THR 105 Ca -0.21 -0.81 -0.16 0.00 -2.04 0.00 0.00 64.05 60.83 1wix n THR 105 Cb 0.96 -0.87 -0.14 0.00 -1.82 0.00 0.00 70.33 68.47 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 -0.69 -4.70 120.64 111.10 1wix n GLU 106 Ca -0.25 0.18 -0.15 0.00 -0.02 0.00 0.00 57.16 56.92 1wix n GLU 106 Cb 1.09 -1.62 -0.07 0.00 -0.02 0.00 0.00 31.44 30.83 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 -3.37 -0.15 -1.65 0.00 0.00 0.35 -4.92 120.51 110.77 1wix n ALA 108 Ca -0.31 0.08 -0.42 0.00 0.00 0.00 0.00 53.44 52.79 1wix n ALA 108 Cb 0.77 -1.04 -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 0.78 1.96 0.17 0.00 2.03 -1.08 -4.73 116.55 115.68 1wix n ASP 109 Ca -0.08 1.13 0.02 0.00 0.52 0.00 0.00 54.79 56.39 1wix n ASP 109 Cb 0.39 -1.40 0.30 0.00 -0.72 0.00 0.00 41.12 39.69 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 2.05 0.00 -0.33 -0.67 0.13 -1.94 -1.86 132.00 129.38 1wix h PRO 110 Ca -0.44 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.57 1wix h PRO 110 Cb 1.31 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 1wix h PRO 110 CO 0.60 0.45 -0.27 0.28 -0.23 0.00 0.00 178.00 178.83 1wix h VAL 111 N 0.00 1.28 0.00 1.56 2.07 -1.95 -2.42 116.25 116.79 1wix h VAL 111 Ca -0.00 -1.38 -0.00 0.00 0.82 0.00 0.00 66.70 66.14 1wix h VAL 111 Cb 0.83 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 1wix h VAL 111 CO 0.06 0.45 -0.00 -0.33 0.02 0.00 0.00 177.57 177.77 1wix h GLU 112 N 0.59 -0.00 -0.55 1.57 4.39 -1.91 -3.33 114.58 115.34 1wix h GLU 112 Ca 0.08 0.00 0.11 0.00 0.34 0.00 0.00 59.36 59.89 1wix h GLU 112 Cb 0.77 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.31 1wix h GLU 112 CO 0.06 0.84 -0.14 1.25 -1.16 0.00 0.00 179.01 179.86 1wix h LEU 113 N -0.98 -0.51 -1.44 1.33 7.12 -1.40 0.12 115.31 119.55 1wix h LEU 113 Ca -0.00 0.16 0.27 0.00 0.13 0.00 0.00 57.88 58.44 1wix h LEU 113 Cb 0.84 0.34 -0.09 0.00 -0.53 0.00 0.00 40.66 41.23 1wix h LEU 113 CO 0.00 -0.18 0.68 1.23 -0.13 0.00 0.00 178.44 180.04 1wix h GLY 114 N 0.00 1.05 0.96 3.75 0.00 -1.57 0.15 103.07 107.41 1wix h GLY 114 Ca 0.26 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 1wix h GLY 114 CO -0.56 -0.11 0.16 3.21 0.00 0.00 0.00 176.54 179.23 1wix h ARG 115 N 0.35 0.37 -0.57 4.80 3.08 -0.85 -2.03 114.38 119.53 1wix h ARG 115 Ca 0.58 -0.04 0.07 0.00 0.07 0.00 0.00 59.98 60.66 1wix h ARG 115 Cb 1.54 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 31.46 1wix h ARG 115 CO -0.25 0.31 0.25 1.25 -1.07 0.00 0.00 179.97 180.45 1wix h LEU 116 N 0.33 0.30 -0.92 3.04 5.85 -0.89 -1.62 115.31 121.40 1wix h LEU 116 Ca 0.10 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 1wix h LEU 116 Cb 0.04 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 1wix h LEU 116 CO -0.02 0.20 0.56 -0.07 -0.34 0.00 0.00 178.44 178.77 1wix h LEU 117 N 0.46 1.09 -0.30 2.25 3.38 -1.25 -2.75 115.31 118.20 1wix h LEU 117 Ca 0.27 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.23 1wix h LEU 117 Cb 0.26 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 1wix h LEU 117 CO -0.23 0.83 -0.01 -0.61 0.09 0.00 0.00 178.44 178.51 1wix h GLN 118 N 1.26 0.07 -0.93 1.13 4.15 -0.57 -0.46 115.11 119.76 1wix h GLN 118 Ca 0.33 -0.00 0.19 0.00 0.77 0.00 0.00 58.65 59.94 1wix h GLN 118 Cb -0.07 -0.02 -0.08 0.00 0.21 0.00 0.00 27.48 27.52 1wix h GLN 118 CO -0.06 0.05 0.60 -0.07 -1.93 0.00 0.00 178.83 177.42 1wix h LEU 119 N 0.07 0.56 -0.10 -2.39 4.07 -1.16 0.12 115.31 116.48 1wix h LEU 119 Ca 0.15 0.06 -0.19 0.00 0.08 0.00 0.00 57.88 57.97 1wix h LEU 119 Cb 0.20 -0.05 0.01 0.00 1.08 0.00 0.00 40.66 41.90 1wix h LEU 119 CO -0.25 0.23 -0.67 0.40 -1.08 0.00 0.00 178.44 177.06 1wix h ILE 120 N 0.56 1.33 0.00 1.22 2.04 -1.15 -2.81 117.51 118.70 1wix h ILE 120 Ca 0.50 -1.95 -0.05 0.00 1.00 0.00 0.00 64.86 64.36 1wix h ILE 120 Cb 1.01 2.17 -0.01 0.00 -0.74 0.00 0.00 36.82 39.25 1wix h ILE 120 CO -0.24 0.60 -0.23 0.25 0.00 0.00 0.00 178.15 178.53 1wix h LEU 121 N 0.29 0.00 -0.08 1.44 5.85 0.41 -2.83 115.31 120.39 1wix h LEU 121 Ca -0.06 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.46 1wix h LEU 121 Cb 1.32 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.36 1wix h LEU 121 CO 0.14 0.23 -0.73 1.23 -0.34 0.00 0.00 178.44 178.97 1wix h GLY 122 N 0.81 0.71 2.00 3.75 0.00 -0.81 -2.20 103.07 107.33 1wix h GLY 122 Ca -0.00 -1.08 -0.02 0.00 0.00 0.00 0.00 47.33 46.23 1wix h GLY 122 CO 0.03 0.96 -0.08 0.00 0.00 0.00 0.00 176.54 177.45 1wix h ALA 124 N 1.92 0.11 0.00 0.00 0.00 -1.47 -3.30 119.26 116.52 1wix h ALA 124 Ca -0.00 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 53.93 1wix h ALA 124 Cb 0.28 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1wix h ALA 124 CO 0.01 0.70 0.00 1.33 0.00 0.00 0.00 179.25 181.29 1wix n VAL 125 N -3.99 0.00 -2.08 0.00 0.24 -0.83 -2.51 118.33 109.16 1wix n VAL 125 Ca -0.22 0.00 0.04 0.00 -2.04 0.00 0.00 64.34 62.12 1wix n VAL 125 Cb 0.87 -0.46 0.11 0.00 -1.47 0.00 0.00 33.84 32.89 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 -0.79 1.43 -4.28 -1.34 3.02 -0.94 -4.97 115.26 107.39 1wix n ASN 126 Ca 0.09 -2.93 -0.29 0.00 -0.03 0.00 0.00 54.58 51.42 1wix n ASN 126 Cb 0.04 -0.41 -0.07 0.00 -0.61 0.00 0.00 39.78 38.73 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 0.00 0.67 -0.00 0.00 4.11 -1.92 -2.99 114.58 114.44 1wix h GLU 128 Ca -0.37 -0.43 0.00 0.00 0.07 0.00 0.00 59.36 58.64 1wix h GLU 128 Cb 1.22 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1wix h GLU 128 CO 0.60 1.04 -0.07 1.63 0.07 0.00 0.00 179.01 182.29 1wix n LYS 129 N -4.21 0.47 -0.23 1.06 5.02 -1.26 -4.19 118.16 114.82 1wix n LYS 129 Ca -0.05 -0.09 0.13 0.00 -2.02 0.00 0.00 58.31 56.27 1wix n LYS 129 Cb 0.54 -1.50 0.24 0.00 -0.02 0.00 0.00 35.03 34.30 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 -1.19 -0.05 -0.18 1.97 2.85 -1.13 0.21 118.16 120.65 1wix n LYS 130 Ca 0.13 1.01 -0.01 0.00 -1.05 0.00 0.00 58.31 58.39 1wix n LYS 130 Cb 0.27 -1.64 0.09 0.00 -0.65 0.00 0.00 35.03 33.09 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 0.18 -0.50 -1.58 4.20 -1.82 0.33 115.11 115.93 1wix h GLN 131 Ca 0.45 -0.01 0.14 0.00 0.06 0.00 0.00 58.65 59.29 1wix h GLN 131 Cb 1.00 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.72 1wix h GLN 131 CO -0.62 0.12 0.51 1.49 -0.67 0.00 0.00 178.83 179.66 1wix h GLU 132 N 0.19 0.00 0.02 1.46 4.22 0.22 -1.81 114.58 118.88 1wix h GLU 132 Ca 0.29 0.00 -0.32 0.00 0.08 0.00 0.00 59.36 59.41 1wix h GLU 132 Cb 0.43 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 1wix h GLU 132 CO -0.41 0.00 -1.74 0.72 -2.18 0.00 0.00 179.01 175.39 1wix n HIS 133 N -3.75 0.79 -0.33 0.92 -0.00 0.83 -4.23 115.22 109.45 1wix n HIS 133 Ca 0.09 0.29 0.32 0.00 -0.00 0.00 0.00 57.72 58.42 1wix n HIS 133 Cb 0.71 -1.09 0.58 0.00 -0.00 0.00 0.00 29.99 30.19 1wix n HIS 133 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.34 177.16 1wix h ILE 134 N -0.74 0.02 -0.59 1.59 5.03 0.24 1.64 117.51 124.70 1wix h ILE 134 Ca -0.45 -0.01 -0.06 0.00 -0.12 0.00 0.00 64.86 64.22 1wix h ILE 134 Cb 1.54 -0.00 -0.03 0.00 -3.03 0.00 0.00 36.82 35.30 1wix h ILE 134 CO -0.19 0.00 0.13 0.07 -0.68 0.00 0.00 178.15 177.48 1wix h LYS 135 N 0.02 0.93 -0.08 2.37 2.10 -1.67 -2.22 116.57 118.03 1wix h LYS 135 Ca 0.84 -0.21 0.02 0.00 -2.00 0.00 0.00 60.65 59.31 1wix h LYS 135 Cb 2.22 -0.13 -0.00 0.00 -0.90 0.00 0.00 32.23 33.42 1wix h LYS 135 CO -0.75 0.84 0.07 -0.91 -2.00 0.00 0.00 179.45 176.70 1wix h ASN 136 N 0.89 0.00 0.03 7.07 2.35 0.22 -2.48 115.58 123.65 1wix h ASN 136 Ca 0.19 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1wix h ASN 136 Cb 0.34 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.71 1wix h ASN 136 CO 0.00 0.00 -0.01 0.40 -1.65 0.00 0.00 177.43 176.17 1wix h ILE 137 N 0.00 1.42 -0.91 2.81 5.03 -1.17 -3.10 117.51 121.58 1wix h ILE 137 Ca 0.04 -1.52 0.18 0.00 -0.12 0.00 0.00 64.86 63.45 1wix h ILE 137 Cb 0.17 2.42 -0.07 0.00 -3.03 0.00 0.00 36.82 36.31 1wix h ILE 137 CO -0.00 0.38 0.59 0.24 -0.68 0.00 0.00 178.15 178.68 1wix h MET 138 N -0.71 0.53 -0.30 2.37 2.86 -1.31 0.13 114.93 118.51 1wix h MET 138 Ca -0.00 -0.03 -0.08 0.00 -2.06 0.00 0.00 59.70 57.52 1wix h MET 138 Cb 0.65 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.17 1wix h MET 138 CO 0.01 0.35 -0.16 1.79 1.06 0.00 0.00 176.91 179.96 1wix h THR 139 N 0.55 1.24 -2.29 2.22 1.35 -1.49 -3.45 112.91 111.05 1wix h THR 139 Ca 0.48 -1.11 -0.30 0.00 -0.55 0.00 0.00 66.41 64.94 1wix h THR 139 Cb 0.99 1.19 0.17 0.00 -1.73 0.00 0.00 68.15 68.77 1wix h THR 139 CO -0.22 0.36 -0.35 0.18 -0.25 0.00 0.00 175.52 175.24 1wix n LEU 140 N -4.17 -1.25 -4.73 3.87 4.77 0.45 -4.91 117.00 111.02 1wix n LEU 140 Ca 0.00 -0.46 -0.41 0.00 -0.03 0.00 0.00 56.01 55.11 1wix n LEU 140 Cb 0.35 -0.87 -0.04 0.00 -2.33 0.00 0.00 43.42 40.53 1wix n LEU 140 CO 0.41 -3.57 0.72 -0.70 -1.33 0.00 0.00 177.39 172.92 1wix s GLU 141 N -3.89 4.67 0.00 3.23 2.56 -1.26 -4.76 118.70 119.25 1wix s GLU 141 Ca 0.48 1.57 0.00 0.00 0.00 0.00 0.00 54.97 57.01 1wix s GLU 141 Cb -0.09 -3.33 0.00 0.00 2.00 0.00 0.00 34.13 32.71 1wix s GLU 141 CO 0.45 0.18 0.43 0.39 -0.56 0.00 0.00 175.26 176.15 1wix n GLU 142 N 2.51 0.00 -0.30 4.30 1.02 -1.26 0.16 120.64 127.07 1wix n GLU 142 Ca 0.02 0.43 0.22 0.00 -0.02 0.00 0.00 57.16 57.82 1wix n GLU 142 Cb 0.48 -0.73 0.42 0.00 -0.02 0.00 0.00 31.44 31.59 1wix n GLU 142 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1wix n SER 143 N -1.65 0.14 0.13 1.62 2.88 -1.26 0.34 113.62 115.82 1wix n SER 143 Ca 0.00 1.52 -0.13 0.00 -1.33 0.00 0.00 58.87 58.93 1wix n SER 143 Cb 0.00 -0.66 -0.08 0.00 -0.75 0.00 0.00 64.21 62.72 1wix n SER 143 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1wix h VAL 144 N 0.00 0.79 -1.21 2.46 2.07 0.11 -3.00 116.25 117.48 1wix h VAL 144 Ca 0.68 -0.58 0.36 0.00 0.82 0.00 0.00 66.70 67.98 1wix h VAL 144 Cb 1.66 1.11 -0.11 0.00 -1.52 0.00 0.00 31.29 32.43 1wix h VAL 144 CO -0.76 0.12 0.78 1.56 0.02 0.00 0.00 177.57 179.29 1wix h GLN 145 N -0.66 0.20 0.64 1.57 4.20 0.40 -0.55 115.11 120.90 1wix h GLN 145 Ca -0.04 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 1wix h GLN 145 Cb 0.46 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.20 1wix h GLN 145 CO 0.06 0.13 -0.34 1.25 -0.67 0.00 0.00 178.83 179.26 1wix h HIS 146 N 0.20 -0.89 -0.75 2.96 -0.00 -1.23 0.42 115.15 115.87 1wix h HIS 146 Ca 0.72 -0.02 0.09 0.00 -0.00 0.00 0.00 60.37 61.16 1wix h HIS 146 Cb 2.14 0.31 -0.07 0.00 -0.00 0.00 0.00 27.41 29.79 1wix h HIS 146 CO -0.00 -0.53 0.40 0.28 -0.00 0.00 0.00 177.93 178.08 1wix h VAL 147 N -0.90 0.89 -0.76 5.26 2.07 -1.20 0.45 116.25 122.06 1wix h VAL 147 Ca -0.09 -0.23 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 1wix h VAL 147 Cb 0.70 0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 1wix h VAL 147 CO 0.12 0.12 0.29 0.58 0.02 0.00 0.00 177.57 178.71 1wix h VAL 148 N 0.68 1.26 -0.04 2.57 2.07 -1.06 -1.87 116.25 119.86 1wix h VAL 148 Ca 0.36 -0.82 -0.17 0.00 0.82 0.00 0.00 66.70 66.89 1wix h VAL 148 Cb 0.34 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1wix h VAL 148 CO -0.25 0.33 -0.73 0.24 0.02 0.00 0.00 177.57 177.18 1wix h MET 149 N 1.10 0.23 -0.11 1.57 2.86 0.86 -3.27 114.93 118.18 1wix h MET 149 Ca 0.25 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 1wix h MET 149 Cb 0.23 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 1wix h MET 149 CO -0.02 0.86 0.03 1.15 1.06 0.00 0.00 176.91 179.99 1wix h THR 150 N 0.15 1.18 -0.86 2.22 2.02 0.19 -3.05 112.91 114.76 1wix h THR 150 Ca -0.02 -0.57 0.20 0.00 0.77 0.00 0.00 66.41 66.79 1wix h THR 150 Cb 1.29 1.36 -0.15 0.00 -1.74 0.00 0.00 68.15 68.91 1wix h THR 150 CO 0.11 0.17 -0.02 0.00 0.37 0.00 0.00 175.52 176.15 1wix h ALA 151 N 0.83 0.88 -0.19 6.16 0.00 -1.39 0.49 119.26 126.04 1wix h ALA 151 Ca 0.03 0.29 0.05 0.00 0.00 0.00 0.00 54.91 55.29 1wix h ALA 151 Cb 0.23 0.52 -0.07 0.00 0.00 0.00 0.00 17.79 18.47 1wix h ALA 151 CO -0.00 -0.46 -0.28 0.82 0.00 0.00 0.00 179.25 179.32 1wix h ILE 152 N 0.06 0.33 -0.98 0.00 5.03 -1.64 0.19 117.51 120.50 1wix h ILE 152 Ca 0.48 0.00 0.14 0.00 -0.12 0.00 0.00 64.86 65.36 1wix h ILE 152 Cb 0.88 0.33 -0.09 0.00 -3.03 0.00 0.00 36.82 34.91 1wix h ILE 152 CO -0.79 0.00 0.60 1.56 -0.68 0.00 0.00 178.15 178.84 1wix h GLN 153 N -0.33 0.86 -0.32 2.37 1.08 -0.96 -0.14 115.11 117.68 1wix h GLN 153 Ca 0.12 -0.05 -0.13 0.00 -1.45 0.00 0.00 58.65 57.13 1wix h GLN 153 Cb 0.51 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 1wix h GLN 153 CO -0.37 0.57 -0.34 1.49 -0.95 0.00 0.00 178.83 179.23 1wix h GLU 154 N 0.89 0.71 -0.53 1.46 4.57 -0.50 -1.33 114.58 119.84 1wix h GLU 154 Ca 0.52 -0.33 -0.04 0.00 -1.18 0.00 0.00 59.36 58.32 1wix h GLU 154 Cb 0.62 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.18 1wix h GLU 154 CO -0.31 0.94 0.19 -0.07 -1.18 0.00 0.00 179.01 178.59 1wix h LEU 155 N 0.59 0.76 -0.46 1.64 3.38 0.11 -0.50 115.31 120.83 1wix h LEU 155 Ca 0.06 -0.19 -0.17 0.00 0.09 0.00 0.00 57.88 57.68 1wix h LEU 155 Cb 0.86 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1wix h LEU 155 CO 0.07 0.74 -0.52 0.24 0.09 0.00 0.00 178.44 179.06 1wix h MET 156 N 0.73 0.69 -0.31 1.13 2.86 -1.15 -1.45 114.93 117.43 1wix h MET 156 Ca 0.18 -0.42 -0.03 0.00 -2.06 0.00 0.00 59.70 57.36 1wix h MET 156 Cb 0.23 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 1wix h MET 156 CO -0.01 1.04 0.07 0.77 1.06 0.00 0.00 176.91 179.84 1wix h SER 157 N 0.54 0.47 -0.43 1.22 0.02 -1.04 -3.09 113.55 111.25 1wix h SER 157 Ca 0.02 -0.24 -0.11 0.00 -0.84 0.00 0.00 61.79 60.62 1wix h SER 157 Cb 1.08 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.49 1wix h SER 157 CO 0.11 0.59 -0.16 0.11 -1.14 0.00 0.00 176.83 176.34 1wix h LYS 158 N 0.34 0.87 -6.18 3.45 1.79 -1.09 -3.43 116.57 112.32 1wix h LYS 158 Ca 0.10 -0.36 -0.56 0.00 -2.18 0.00 0.00 60.65 57.65 1wix h LYS 158 Cb 0.31 -0.04 0.01 0.00 -1.58 0.00 0.00 32.23 30.93 1wix h LYS 158 CO 0.00 1.00 1.36 -1.12 -1.08 0.00 0.00 179.45 179.61 1wix s SER 159 N -6.54 5.96 0.00 0.86 0.01 -0.55 -4.32 113.70 109.11 1wix s SER 159 Ca -0.12 2.28 0.00 0.00 1.31 0.00 0.00 55.95 59.42 1wix s SER 159 Cb 0.11 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.82 1wix s SER 159 CO 0.84 -1.50 0.00 0.61 0.41 0.00 0.00 173.24 173.60 1wix n GLY 160 N 5.14 -0.23 0.00 3.44 0.00 -1.26 -4.87 105.19 107.41 1wix n GLY 160 Ca 0.25 -0.75 0.06 0.00 0.00 0.00 0.00 46.02 45.57 1wix n GLY 160 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wix n PRO 161 N 0.60 0.49 -3.83 1.61 -0.04 -1.26 -4.84 135.00 127.73 1wix n PRO 161 Ca 0.00 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.18 1wix n PRO 161 Cb 0.00 -1.36 -0.07 0.00 -0.04 0.00 0.00 33.50 32.03 1wix n PRO 161 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1wix n SER 162 N -0.86 -0.44 -3.46 3.54 3.41 -1.26 -4.83 113.62 109.71 1wix n SER 162 Ca 0.08 -0.95 -0.09 0.00 -0.26 0.00 0.00 58.87 57.65 1wix n SER 162 Cb 0.04 -1.20 -0.01 0.00 -0.26 0.00 0.00 64.21 62.77 1wix n SER 162 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1wix s SER 163 N -3.30 0.03 0.00 4.04 0.01 -1.26 -5.32 113.70 107.90 1wix s SER 163 Ca 0.35 -0.98 0.00 0.00 1.31 0.00 0.00 55.95 56.63 1wix s SER 163 Cb -0.21 0.74 0.00 0.00 0.21 0.00 0.00 66.02 66.76 1wix s SER 163 CO 0.77 -1.43 0.00 0.61 0.41 0.00 0.00 173.24 173.60