#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vgw s ARG 3 N 0.00 4.48 0.29 1.64 3.52 -1.26 -5.03 118.95 122.59 1vgw s ARG 3 Ca 0.00 1.81 0.06 0.00 -0.13 0.00 0.00 55.73 57.47 1vgw s ARG 3 Cb 0.00 -3.29 -0.02 0.00 -1.56 0.00 0.00 34.95 30.08 1vgw s ARG 3 CO 0.00 -0.14 0.40 0.15 -0.81 0.00 0.00 175.30 174.90 1vgw s LYS 4 N 0.34 3.24 -0.24 5.12 1.02 -1.26 -5.01 119.74 122.95 1vgw s LYS 4 Ca 0.55 -0.91 0.00 0.00 0.02 0.00 0.00 55.97 55.63 1vgw s LYS 4 Cb -0.31 -2.83 0.06 0.00 -0.52 0.00 0.00 37.83 34.24 1vgw s LYS 4 CO 0.33 0.25 -0.03 -0.80 -0.92 0.00 0.00 175.35 174.18 1vgw s ASN 5 N -4.06 3.79 -0.22 2.83 0.01 -1.26 -1.77 114.94 114.26 1vgw s ASN 5 Ca 0.39 -1.20 -0.04 0.00 -0.71 0.00 0.00 52.86 51.31 1vgw s ASN 5 Cb -0.09 -1.11 -0.00 0.00 0.41 0.00 0.00 41.25 40.45 1vgw s ASN 5 CO 0.30 -0.26 -0.05 -0.63 -1.51 0.00 0.00 177.10 174.95 1vgw s ILE 6 N 1.44 3.29 0.13 0.60 1.01 -0.16 -1.49 121.20 126.01 1vgw s ILE 6 Ca -0.04 -0.55 -0.29 0.00 0.00 0.00 0.00 60.65 59.77 1vgw s ILE 6 Cb -0.19 -2.50 -0.06 0.00 0.01 0.00 0.00 42.46 39.72 1vgw s ILE 6 CO -0.07 0.41 0.92 0.00 0.00 0.00 0.00 174.94 176.20 1vgw s ALA 7 N 1.46 3.29 -0.06 9.38 0.00 -0.28 -0.67 121.76 134.89 1vgw s ALA 7 Ca 0.05 0.53 0.01 0.00 0.00 0.00 0.00 51.96 52.56 1vgw s ALA 7 Cb -0.14 -3.21 0.02 0.00 0.00 0.00 0.00 23.12 19.79 1vgw s ALA 7 CO -0.04 0.05 -0.08 -1.17 0.00 0.00 0.00 175.76 174.52 1vgw s LEU 8 N -0.31 1.44 -0.22 0.00 2.96 0.18 -1.03 118.68 121.70 1vgw s LEU 8 Ca 0.44 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 54.14 1vgw s LEU 8 Cb -0.23 -0.65 0.05 0.00 0.50 0.00 0.00 46.19 45.85 1vgw s LEU 8 CO 0.29 -0.02 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.59 1vgw s ILE 9 N 0.90 1.61 -0.28 6.68 1.01 0.03 -1.56 121.20 129.60 1vgw s ILE 9 Ca -0.11 -1.15 -0.29 0.00 0.00 0.00 0.00 60.65 59.10 1vgw s ILE 9 Cb -0.15 -1.78 0.01 0.00 0.01 0.00 0.00 42.46 40.55 1vgw s ILE 9 CO 0.01 0.02 1.13 -2.16 0.00 0.00 0.00 174.94 173.93 1vgw s PRO 10 N 1.38 4.11 -0.30 2.79 0.04 -1.26 -1.24 135.00 140.51 1vgw s PRO 10 Ca -0.04 1.24 0.19 0.00 0.04 0.00 0.00 61.00 62.43 1vgw s PRO 10 Cb -0.18 -3.74 0.47 0.00 0.04 0.00 0.00 34.50 31.09 1vgw s PRO 10 CO -0.07 -0.85 1.08 0.00 0.04 0.00 0.00 177.00 177.20 1vgw n ALA 11 N 6.83 2.89 -1.66 8.56 0.00 -0.06 -4.43 120.51 132.64 1vgw n ALA 11 Ca 0.13 -2.71 -0.34 0.00 0.00 0.00 0.00 53.44 50.51 1vgw n ALA 11 Cb 0.46 -0.91 0.06 0.00 0.00 0.00 0.00 19.45 19.06 1vgw n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vgw n ALA 12 N -0.42 6.13 -0.73 0.00 0.00 -1.16 -4.39 120.51 119.94 1vgw n ALA 12 Ca 0.06 -3.75 0.00 0.00 0.00 0.00 0.00 53.44 49.75 1vgw n ALA 12 Cb 0.82 -1.56 0.00 0.00 0.00 0.00 0.00 19.45 18.71 1vgw n ALA 12 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1vgw n PRO 23 N -0.76 0.00 -3.52 0.00 -0.04 -1.26 -4.46 135.00 124.96 1vgw n PRO 23 Ca 0.56 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.64 1vgw n PRO 23 Cb 0.59 -0.87 -0.10 0.00 -0.04 0.00 0.00 33.50 33.07 1vgw n PRO 23 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1vgw s LYS 24 N -0.91 3.89 0.00 0.54 1.02 -1.26 -4.84 119.74 118.18 1vgw s LYS 24 Ca 0.00 -0.27 0.24 0.00 0.02 0.00 0.00 55.97 55.96 1vgw s LYS 24 Cb 0.00 -3.68 0.18 0.00 -0.52 0.00 0.00 37.83 33.81 1vgw s LYS 24 CO 0.00 -0.26 1.22 0.00 -0.92 0.00 0.00 175.35 175.40 1vgw n GLN 25 N 5.16 1.55 -0.57 1.68 10.64 -1.26 -3.90 117.38 130.68 1vgw n GLN 25 Ca -0.12 -1.24 0.09 0.00 -1.83 0.00 0.00 57.00 53.90 1vgw n GLN 25 Cb 0.51 -1.47 0.33 0.00 -0.86 0.00 0.00 30.24 28.75 1vgw n GLN 25 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1vgw n TYR 26 N 0.35 1.36 -2.37 2.61 0.53 -1.26 -1.00 117.16 117.39 1vgw n TYR 26 Ca 0.12 -0.62 -0.38 0.00 -1.02 0.00 0.00 57.90 55.99 1vgw n TYR 26 Cb 0.49 -0.23 -0.03 0.00 -1.03 0.00 0.00 39.34 38.55 1vgw n TYR 26 CO 0.00 0.00 0.00 0.08 -1.02 0.00 0.00 176.86 175.92 1vgw s VAL 27 N -1.85 3.32 -0.38 -0.72 1.01 -1.25 -4.81 120.40 115.71 1vgw s VAL 27 Ca 0.48 1.08 -0.15 0.00 0.00 0.00 0.00 61.98 63.39 1vgw s VAL 27 Cb 0.31 -3.59 0.01 0.00 0.00 0.00 0.00 36.38 33.11 1vgw s VAL 27 CO 0.23 0.07 0.32 -1.83 0.00 0.00 0.00 175.10 173.89 1vgw s GLU 28 N -2.34 3.22 -0.03 2.72 1.03 -1.26 -2.45 118.70 119.59 1vgw s GLU 28 Ca 0.57 -0.78 0.03 0.00 0.03 0.00 0.00 54.97 54.82 1vgw s GLU 28 Cb -0.28 -3.91 0.00 0.00 -0.80 0.00 0.00 34.13 29.14 1vgw s GLU 28 CO 0.35 -0.66 -0.10 0.42 -1.33 0.00 0.00 175.26 173.94 1vgw s ILE 29 N 1.83 0.88 0.00 1.83 1.01 -0.83 -5.00 121.20 120.92 1vgw s ILE 29 Ca 0.08 -0.41 0.00 0.00 0.00 0.00 0.00 60.65 60.32 1vgw s ILE 29 Cb -0.18 -0.78 0.00 0.00 0.01 0.00 0.00 42.46 41.51 1vgw s ILE 29 CO 0.11 0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.93 1vgw n GLY 30 N 3.30 1.55 1.33 6.18 0.00 -1.26 -2.64 105.19 113.65 1vgw n GLY 30 Ca -0.18 -0.64 0.12 0.00 0.00 0.00 0.00 46.02 45.31 1vgw n GLY 30 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vgw n SER 31 N 0.97 3.86 -3.47 1.61 3.41 -1.26 -4.98 113.62 113.76 1vgw n SER 31 Ca 0.00 -2.00 -0.17 0.00 -0.26 0.00 0.00 58.87 56.44 1vgw n SER 31 Cb 0.00 -0.47 -0.08 0.00 -0.26 0.00 0.00 64.21 63.41 1vgw n SER 31 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1vgw s LYS 32 N -1.06 1.70 0.76 4.33 3.01 -1.08 -5.16 119.74 122.24 1vgw s LYS 32 Ca 0.48 -1.89 -0.12 0.00 -1.01 0.00 0.00 55.97 53.43 1vgw s LYS 32 Cb 0.25 0.34 0.05 0.00 -1.01 0.00 0.00 37.83 37.47 1vgw s LYS 32 CO 0.33 -0.64 1.14 0.95 0.51 0.00 0.00 175.35 177.64 1vgw s THR 33 N -3.49 2.64 0.13 2.17 -4.23 -1.26 -1.97 115.64 109.64 1vgw s THR 33 Ca 0.38 0.20 -0.18 0.00 -1.18 0.00 0.00 61.69 60.91 1vgw s THR 33 Cb 0.02 -3.20 -0.03 0.00 1.34 0.00 0.00 72.50 70.64 1vgw s THR 33 CO 0.23 -0.27 1.74 0.58 -0.54 0.00 0.00 174.62 176.37 1vgw h VAL 34 N -0.88 1.13 -0.07 2.29 2.07 -1.09 -1.39 116.25 118.30 1vgw h VAL 34 Ca -0.46 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 66.76 1vgw h VAL 34 Cb 1.30 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 1vgw h VAL 34 CO 0.65 0.13 -0.06 0.25 0.02 0.00 0.00 177.57 178.56 1vgw h LEU 35 N 0.41 -0.18 -1.21 2.57 5.85 -1.29 0.47 115.31 121.93 1vgw h LEU 35 Ca 0.11 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.91 1vgw h LEU 35 Cb 0.04 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 1vgw h LEU 35 CO -0.02 -0.08 0.55 -0.33 -0.34 0.00 0.00 178.44 178.22 1vgw h GLU 36 N -0.07 0.98 -0.42 1.25 5.08 -1.79 0.18 114.58 119.79 1vgw h GLU 36 Ca 0.05 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1vgw h GLU 36 Cb 0.14 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1vgw h GLU 36 CO -0.11 0.65 0.05 0.45 -1.00 0.00 0.00 179.01 179.04 1vgw h HIS 37 N 1.01 0.68 0.16 4.33 3.86 -0.42 -2.31 115.15 122.46 1vgw h HIS 37 Ca 0.34 -0.07 -0.01 0.00 -1.16 0.00 0.00 60.37 59.47 1vgw h HIS 37 Cb 0.08 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.35 1vgw h HIS 37 CO -0.00 0.62 -0.08 0.28 0.86 0.00 0.00 177.93 179.61 1vgw h VAL 38 N 0.63 0.95 -0.74 2.45 2.07 0.13 -3.26 116.25 118.48 1vgw h VAL 38 Ca 0.14 -1.02 0.12 0.00 0.82 0.00 0.00 66.70 66.75 1vgw h VAL 38 Cb 0.32 1.52 -0.05 0.00 -1.52 0.00 0.00 31.29 31.56 1vgw h VAL 38 CO 0.01 0.22 0.49 -0.07 0.02 0.00 0.00 177.57 178.23 1vgw h LEU 39 N -0.75 0.50 -1.34 2.57 3.38 -0.75 -2.29 115.31 116.63 1vgw h LEU 39 Ca -0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1vgw h LEU 39 Cb 0.52 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1vgw h LEU 39 CO 0.04 0.28 0.39 1.23 0.09 0.00 0.00 178.44 180.47 1vgw h GLY 40 N 0.55 0.89 1.19 0.83 0.00 -1.45 -0.95 103.07 104.12 1vgw h GLY 40 Ca 0.35 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 1vgw h GLY 40 CO -0.12 0.34 0.27 -2.22 0.00 0.00 0.00 176.54 174.81 1vgw h ILE 41 N 0.85 1.24 0.04 2.60 2.04 -1.48 -2.24 117.51 120.57 1vgw h ILE 41 Ca 0.23 -0.77 -0.24 0.00 1.00 0.00 0.00 64.86 65.08 1vgw h ILE 41 Cb -0.06 0.42 0.02 0.00 -0.74 0.00 0.00 36.82 36.46 1vgw h ILE 41 CO -0.05 0.31 -0.95 -0.26 0.00 0.00 0.00 178.15 177.20 1vgw h PHE 42 N 1.01 0.88 -0.57 1.37 0.04 -1.50 -3.17 116.94 115.02 1vgw h PHE 42 Ca 0.23 -0.51 -0.03 0.00 2.80 0.00 0.00 57.97 60.46 1vgw h PHE 42 Cb 0.21 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 38.24 1vgw h PHE 42 CO 0.02 1.35 0.22 0.93 -0.60 0.00 0.00 178.31 180.23 1vgw h GLU 43 N 0.17 0.82 -0.02 1.51 4.39 -1.16 -1.17 114.58 119.13 1vgw h GLU 43 Ca -0.13 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.44 1vgw h GLU 43 Cb 1.64 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 30.14 1vgw h GLU 43 CO 0.19 0.68 0.00 2.89 -1.16 0.00 0.00 179.01 181.60 1vgw n ARG 44 N -4.33 1.35 -3.31 2.33 1.85 -0.85 -4.82 116.66 108.88 1vgw n ARG 44 Ca 0.05 -0.51 -0.39 0.00 -1.00 0.00 0.00 57.85 55.99 1vgw n ARG 44 Cb 0.16 -1.47 -0.08 0.00 -1.05 0.00 0.00 32.46 30.02 1vgw n ARG 44 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 1vgw s HIS 45 N -1.99 3.28 0.46 2.89 2.46 -0.44 -4.96 115.29 117.00 1vgw s HIS 45 Ca 0.41 0.56 0.14 0.00 0.47 0.00 0.00 55.06 56.64 1vgw s HIS 45 Cb 0.21 -2.63 1.09 0.00 -0.13 0.00 0.00 32.58 31.11 1vgw s HIS 45 CO 0.34 -0.21 2.05 0.93 -2.47 0.00 0.00 174.74 175.38 1vgw h GLU 46 N 7.93 0.28 -0.00 2.88 5.08 -1.87 -2.24 114.58 126.64 1vgw h GLU 46 Ca -0.31 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1vgw h GLU 46 Cb 1.15 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1vgw h GLU 46 CO 0.69 0.19 -0.10 0.00 -1.00 0.00 0.00 179.01 178.79 1vgw n ALA 47 N -2.53 2.60 -2.64 3.43 0.00 -1.26 -4.70 120.51 115.41 1vgw n ALA 47 Ca 0.04 -0.16 -0.39 0.00 0.00 0.00 0.00 53.44 52.93 1vgw n ALA 47 Cb 0.23 -1.40 -0.08 0.00 0.00 0.00 0.00 19.45 18.21 1vgw n ALA 47 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1vgw s VAL 48 N -2.90 5.16 -0.65 0.00 1.01 -0.84 -4.55 120.40 117.63 1vgw s VAL 48 Ca 0.17 0.72 0.25 0.00 0.00 0.00 0.00 61.98 63.11 1vgw s VAL 48 Cb 0.19 -3.74 0.12 0.00 0.00 0.00 0.00 36.38 32.94 1vgw s VAL 48 CO 0.55 0.19 1.44 0.44 0.00 0.00 0.00 175.10 177.72 1vgw h ASP 49 N 7.69 0.00 -3.41 3.32 3.32 -1.54 -3.47 116.42 122.32 1vgw h ASP 49 Ca -0.34 -0.15 0.15 0.00 0.02 0.00 0.00 57.03 56.72 1vgw h ASP 49 Cb 1.16 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.45 1vgw h ASP 49 CO 0.70 0.07 0.72 -0.22 -1.72 0.00 0.00 179.24 178.79 1vgw s LEU 50 N -4.38 -0.22 -0.07 1.55 2.96 -1.24 -5.03 118.68 112.24 1vgw s LEU 50 Ca 0.07 0.29 0.02 0.00 -0.22 0.00 0.00 54.13 54.29 1vgw s LEU 50 Cb 0.13 1.50 0.02 0.00 0.50 0.00 0.00 46.19 48.33 1vgw s LEU 50 CO 0.69 -0.17 -0.11 -0.89 -1.32 0.00 0.00 176.35 174.55 1vgw s THR 51 N -0.77 1.10 0.03 3.68 2.01 -1.26 -1.12 115.64 119.30 1vgw s THR 51 Ca 0.04 -0.44 0.09 0.00 0.31 0.00 0.00 61.69 61.69 1vgw s THR 51 Cb -0.02 -1.03 -0.03 0.00 0.01 0.00 0.00 72.50 71.44 1vgw s THR 51 CO -0.05 0.35 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.29 1vgw s VAL 52 N 0.86 2.04 -0.11 3.82 1.01 -0.20 -1.76 120.40 126.06 1vgw s VAL 52 Ca -0.11 -1.29 0.02 0.00 0.00 0.00 0.00 61.98 60.60 1vgw s VAL 52 Cb -0.15 -1.74 0.01 0.00 0.00 0.00 0.00 36.38 34.50 1vgw s VAL 52 CO 0.01 0.39 -0.17 -0.69 0.00 0.00 0.00 175.10 174.65 1vgw s VAL 53 N -0.75 1.62 -0.24 2.92 1.01 -0.43 -0.79 120.40 123.75 1vgw s VAL 53 Ca 0.11 -0.72 -0.07 0.00 0.00 0.00 0.00 61.98 61.30 1vgw s VAL 53 Cb -0.10 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 1vgw s VAL 53 CO 0.01 0.47 0.05 -0.69 0.00 0.00 0.00 175.10 174.94 1vgw s VAL 54 N 0.91 4.19 0.42 2.92 1.01 -0.38 -0.66 120.40 128.81 1vgw s VAL 54 Ca -0.08 -0.22 0.06 0.00 0.00 0.00 0.00 61.98 61.75 1vgw s VAL 54 Cb -0.15 -2.95 -0.07 0.00 0.00 0.00 0.00 36.38 33.21 1vgw s VAL 54 CO -0.01 0.36 0.05 0.68 0.00 0.00 0.00 175.10 176.17 1vgw s VAL 55 N 1.54 1.95 0.37 2.92 -7.23 0.94 -0.88 120.40 120.02 1vgw s VAL 55 Ca 0.06 -1.94 -0.17 0.00 -1.81 0.00 0.00 61.98 58.12 1vgw s VAL 55 Cb -0.15 -2.89 -0.10 0.00 0.56 0.00 0.00 36.38 33.80 1vgw s VAL 55 CO 0.03 0.00 0.83 -0.94 -0.31 0.00 0.00 175.10 174.70 1vgw s SER 56 N -3.77 6.83 0.00 4.85 1.04 -1.26 -2.03 113.70 119.35 1vgw s SER 56 Ca 0.33 1.44 0.00 0.00 0.48 0.00 0.00 55.95 58.20 1vgw s SER 56 Cb 0.08 -2.44 0.00 0.00 0.10 0.00 0.00 66.02 63.76 1vgw s SER 56 CO 0.17 -0.28 0.58 -0.81 0.98 0.00 0.00 173.24 173.88 1vgw n PRO 57 N -0.53 0.00 -0.06 4.02 -0.04 -1.25 -0.41 135.00 136.73 1vgw n PRO 57 Ca 0.05 0.11 0.02 0.00 -0.04 0.00 0.00 63.50 63.64 1vgw n PRO 57 Cb 0.54 -1.51 0.05 0.00 -0.04 0.00 0.00 33.50 32.54 1vgw n PRO 57 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1vgw n GLU 58 N -1.08 2.47 -2.39 0.54 4.71 -1.26 -5.00 120.64 118.63 1vgw n GLU 58 Ca 0.00 -1.57 -0.43 0.00 -0.01 0.00 0.00 57.16 55.15 1vgw n GLU 58 Cb 0.01 -1.10 -0.02 0.00 -1.01 0.00 0.00 31.44 29.32 1vgw n GLU 58 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1vgw s ASP 59 N -0.91 6.35 0.02 1.62 3.68 0.46 -4.92 116.67 122.96 1vgw s ASP 59 Ca 0.08 0.71 -0.20 0.00 2.13 0.00 0.00 52.55 55.28 1vgw s ASP 59 Cb 0.04 -2.54 -0.11 0.00 -1.45 0.00 0.00 42.92 38.86 1vgw s ASP 59 CO 0.06 -1.45 1.06 0.74 0.13 0.00 0.00 175.17 175.71 1vgw h THR 60 N 6.43 0.00 0.00 1.71 2.02 -1.94 -3.20 112.91 117.93 1vgw h THR 60 Ca -0.27 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 66.75 1vgw h THR 60 Cb 1.10 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1vgw h THR 60 CO 1.10 0.00 0.35 0.15 0.37 0.00 0.00 175.52 177.49 1vgw h PHE 61 N -0.86 0.00 -0.62 3.16 3.57 -2.01 -2.94 116.94 117.24 1vgw h PHE 61 Ca -0.07 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.50 1vgw h PHE 61 Cb 0.54 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.22 1vgw h PHE 61 CO 0.06 0.00 0.30 0.00 -2.23 0.00 0.00 178.31 176.43 1vgw h ALA 62 N 1.31 0.82 -0.92 2.41 0.00 -1.97 -2.60 119.26 118.30 1vgw h ALA 62 Ca 0.00 0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.04 1vgw h ALA 62 Cb 0.69 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.37 1vgw h ALA 62 CO 0.00 -0.08 0.57 -0.44 0.00 0.00 0.00 179.25 179.30 1vgw h ASP 63 N 0.54 0.89 0.31 0.00 3.32 -1.71 -1.07 116.42 118.69 1vgw h ASP 63 Ca 0.29 0.03 -0.14 0.00 0.02 0.00 0.00 57.03 57.23 1vgw h ASP 63 Cb 0.27 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1vgw h ASP 63 CO -0.23 0.54 -0.56 0.11 -1.72 0.00 0.00 179.24 177.38 1vgw h LYS 64 N 1.01 0.26 -0.43 3.56 1.57 -1.69 -2.19 116.57 118.67 1vgw h LYS 64 Ca 0.42 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 59.01 1vgw h LYS 64 Cb 0.26 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1vgw h LYS 64 CO -0.20 0.75 0.18 0.28 -0.57 0.00 0.00 179.45 179.89 1vgw h VAL 65 N 0.20 1.20 -0.38 0.50 2.07 -1.02 -2.02 116.25 116.79 1vgw h VAL 65 Ca 0.00 -0.60 0.04 0.00 0.82 0.00 0.00 66.70 66.96 1vgw h VAL 65 Cb 1.05 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 1vgw h VAL 65 CO 0.09 0.22 0.16 -0.61 0.02 0.00 0.00 177.57 177.44 1vgw h GLN 66 N 0.55 0.32 -0.94 1.57 5.75 -0.96 -2.44 115.11 118.96 1vgw h GLN 66 Ca 0.14 -0.02 0.07 0.00 -0.15 0.00 0.00 58.65 58.69 1vgw h GLN 66 Cb 0.18 -0.07 -0.07 0.00 1.07 0.00 0.00 27.48 28.59 1vgw h GLN 66 CO -0.01 0.21 0.60 1.15 -2.65 0.00 0.00 178.83 178.12 1vgw h THR 67 N 0.33 1.05 0.00 2.39 2.02 -1.10 -1.22 112.91 116.37 1vgw h THR 67 Ca 0.17 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1vgw h THR 67 Cb 0.12 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.42 1vgw h THR 67 CO -0.15 0.19 0.00 0.00 0.37 0.00 0.00 175.52 175.93 1vgw h ALA 68 N 1.44 1.00 -2.39 6.16 0.00 -0.96 -3.37 119.26 121.13 1vgw h ALA 68 Ca 0.42 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.74 1vgw h ALA 68 Cb 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 17.79 17.61 1vgw h ALA 68 CO -0.19 0.00 -0.95 1.19 0.00 0.00 0.00 179.25 179.30 1vgw n PHE 69 N -2.38 -0.49 0.27 0.00 3.01 -0.47 -5.00 117.46 112.39 1vgw n PHE 69 Ca 0.04 -3.42 0.16 0.00 1.01 0.00 0.00 57.45 55.24 1vgw n PHE 69 Cb 0.34 0.14 0.68 0.00 -0.01 0.00 0.00 39.48 40.63 1vgw n PHE 69 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1vgw h PRO 70 N 5.47 0.00 0.00 -1.08 0.13 -1.71 -2.78 132.00 132.03 1vgw h PRO 70 Ca 0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.37 1vgw h PRO 70 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1vgw h PRO 70 CO 0.41 0.06 -0.44 1.04 -0.23 0.00 0.00 178.00 178.84 1vgw n GLN 71 N -3.21 0.07 -2.94 0.86 6.02 -1.26 -4.81 117.38 112.11 1vgw n GLN 71 Ca -0.00 0.02 -0.40 0.00 -0.01 0.00 0.00 57.00 56.61 1vgw n GLN 71 Cb 0.31 -1.54 -0.05 0.00 1.02 0.00 0.00 30.24 29.97 1vgw n GLN 71 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1vgw s VAL 72 N -3.04 4.59 -0.25 5.09 1.01 -1.05 -4.74 120.40 122.02 1vgw s VAL 72 Ca 0.10 1.72 -0.20 0.00 0.00 0.00 0.00 61.98 63.60 1vgw s VAL 72 Cb 0.17 -4.15 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 1vgw s VAL 72 CO 0.68 0.40 0.60 -0.13 0.00 0.00 0.00 175.10 176.65 1vgw s ARG 73 N -0.35 4.11 -0.44 2.72 1.81 -0.72 -5.00 118.95 121.08 1vgw s ARG 73 Ca 0.39 0.50 -0.10 0.00 -1.72 0.00 0.00 55.73 54.80 1vgw s ARG 73 Cb -0.22 -3.64 0.09 0.00 -0.45 0.00 0.00 34.95 30.73 1vgw s ARG 73 CO 0.25 -0.38 0.30 0.08 -0.68 0.00 0.00 175.30 174.87 1vgw s VAL 74 N 2.40 4.37 -0.13 3.52 1.01 -1.26 -1.31 120.40 129.00 1vgw s VAL 74 Ca 0.25 -1.44 -0.06 0.00 0.00 0.00 0.00 61.98 60.73 1vgw s VAL 74 Cb -0.16 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1vgw s VAL 74 CO 0.09 -0.58 0.11 0.26 0.00 0.00 0.00 175.10 174.98 1vgw s TRP 75 N 1.44 3.49 -0.66 5.22 0.51 0.16 -4.99 118.94 124.12 1vgw s TRP 75 Ca 0.04 0.43 -0.01 0.00 -2.12 0.00 0.00 56.10 54.44 1vgw s TRP 75 Cb -0.24 -1.94 0.42 0.00 -0.81 0.00 0.00 33.47 30.90 1vgw s TRP 75 CO 0.02 0.62 1.88 1.63 -0.51 0.00 0.00 176.95 180.59 1vgw n LYS 76 N 2.24 2.86 -2.04 4.98 5.02 -1.26 -0.04 118.16 129.92 1vgw n LYS 76 Ca -0.19 -3.53 -0.26 0.00 -2.02 0.00 0.00 58.31 52.31 1vgw n LYS 76 Cb 0.54 -2.28 0.02 0.00 -0.02 0.00 0.00 35.03 33.30 1vgw n LYS 76 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1vgw n ASN 77 N -0.77 5.27 -4.77 4.39 6.94 -1.20 -3.91 115.26 121.22 1vgw n ASN 77 Ca 0.57 -3.75 -0.35 0.00 -0.02 0.00 0.00 54.58 51.03 1vgw n ASN 77 Cb 0.58 -0.46 0.01 0.00 -2.36 0.00 0.00 39.78 37.55 1vgw n ASN 77 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1vgw s GLY 78 N -3.31 2.64 0.00 4.83 0.00 -0.86 -4.75 107.32 105.87 1vgw s GLY 78 Ca 0.52 0.86 0.00 0.00 0.00 0.00 0.00 44.72 46.10 1vgw s GLY 78 CO -0.03 1.22 0.00 0.61 0.00 0.00 0.00 173.10 174.90 1vgw n GLY 79 N 0.21 1.83 0.01 0.20 0.00 -1.26 -4.84 105.19 101.34 1vgw n GLY 79 Ca 0.12 -1.75 0.09 0.00 0.00 0.00 0.00 46.02 44.49 1vgw n GLY 79 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1vgw n GLN 80 N 0.00 0.63 -4.27 1.61 6.02 -1.26 -4.85 117.38 115.26 1vgw n GLN 80 Ca 0.00 -0.14 -0.15 0.00 -0.01 0.00 0.00 57.00 56.69 1vgw n GLN 80 Cb 0.00 -1.43 -0.10 0.00 1.02 0.00 0.00 30.24 29.73 1vgw n GLN 80 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1vgw s THR 81 N -3.20 1.23 0.31 5.09 -1.32 -1.26 -5.02 115.64 111.47 1vgw s THR 81 Ca -0.05 -2.08 0.02 0.00 -1.21 0.00 0.00 61.69 58.37 1vgw s THR 81 Cb 0.12 -1.93 0.29 0.00 -1.51 0.00 0.00 72.50 69.46 1vgw s THR 81 CO 0.77 -0.68 1.90 -0.09 -2.21 0.00 0.00 174.62 174.31 1vgw h ARG 82 N 2.71 0.94 -0.66 7.08 2.43 -1.97 0.40 114.38 125.31 1vgw h ARG 82 Ca -0.37 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 58.73 1vgw h ARG 82 Cb 1.20 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 30.50 1vgw h ARG 82 CO 0.63 0.62 0.37 0.00 -1.51 0.00 0.00 179.97 180.08 1vgw h ALA 83 N 1.53 0.85 -0.34 2.80 0.00 -1.96 -1.49 119.26 120.64 1vgw h ALA 83 Ca 0.40 -0.11 -0.17 0.00 0.00 0.00 0.00 54.91 55.04 1vgw h ALA 83 Cb 0.28 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1vgw h ALA 83 CO -0.16 0.36 -0.44 1.49 0.00 0.00 0.00 179.25 180.50 1vgw h GLU 84 N 0.90 0.88 0.00 0.00 4.81 -1.58 -2.37 114.58 117.23 1vgw h GLU 84 Ca 0.23 -0.49 -0.08 0.00 -0.13 0.00 0.00 59.36 58.89 1vgw h GLU 84 Cb 0.04 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1vgw h GLU 84 CO -0.04 1.14 -0.37 1.79 -0.73 0.00 0.00 179.01 180.80 1vgw h THR 85 N 0.71 1.15 -0.11 0.32 1.35 -0.57 -0.59 112.91 115.16 1vgw h THR 85 Ca 0.05 -1.33 -0.21 0.00 -0.55 0.00 0.00 66.41 64.37 1vgw h THR 85 Cb 1.03 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 69.19 1vgw h THR 85 CO 0.10 0.36 -0.78 0.58 -0.25 0.00 0.00 175.52 175.54 1vgw h VAL 86 N 0.00 1.32 -0.58 6.82 2.07 -1.28 -2.60 116.25 122.00 1vgw h VAL 86 Ca -0.00 -2.07 -0.05 0.00 0.82 0.00 0.00 66.70 65.40 1vgw h VAL 86 Cb 0.71 2.06 -0.02 0.00 -1.52 0.00 0.00 31.29 32.52 1vgw h VAL 86 CO 0.05 0.64 0.18 -0.09 0.02 0.00 0.00 177.57 178.37 1vgw h ARG 87 N 0.42 0.90 -0.52 1.57 2.43 -0.98 -1.79 114.38 116.41 1vgw h ARG 87 Ca -0.05 -0.19 -0.10 0.00 -0.81 0.00 0.00 59.98 58.83 1vgw h ARG 87 Cb 1.39 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.79 1vgw h ARG 87 CO 0.15 0.81 -0.07 -0.91 -1.51 0.00 0.00 179.97 178.44 1vgw h ASN 88 N 0.81 0.96 0.27 -3.80 2.35 -1.05 -1.61 115.58 113.52 1vgw h ASN 88 Ca 0.19 -0.34 -0.01 0.00 -0.55 0.00 0.00 56.30 55.59 1vgw h ASN 88 Cb 0.28 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1vgw h ASN 88 CO -0.01 1.08 -0.19 1.23 -1.65 0.00 0.00 177.43 177.89 1vgw h GLY 89 N 0.83 -0.47 0.99 2.83 0.00 -1.31 -1.29 103.07 104.66 1vgw h GLY 89 Ca 0.14 0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.67 1vgw h GLY 89 CO 0.04 -0.19 0.30 -2.08 0.00 0.00 0.00 176.54 174.61 1vgw h VAL 90 N -0.46 1.17 -0.42 4.60 2.07 -1.32 -2.19 116.25 119.70 1vgw h VAL 90 Ca -0.02 -0.41 0.02 0.00 0.82 0.00 0.00 66.70 67.11 1vgw h VAL 90 Cb 0.39 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 1vgw h VAL 90 CO 0.01 0.18 0.23 0.00 0.02 0.00 0.00 177.57 178.01 1vgw h ALA 91 N 1.13 0.53 -0.68 1.67 0.00 -1.16 -2.92 119.26 117.83 1vgw h ALA 91 Ca 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 1vgw h ALA 91 Cb 0.02 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1vgw h ALA 91 CO -0.03 -0.11 0.27 -0.22 0.00 0.00 0.00 179.25 179.16 1vgw h LYS 92 N 0.47 1.02 -0.71 0.00 3.64 -0.98 0.07 116.57 120.08 1vgw h LYS 92 Ca 0.17 -0.19 0.06 0.00 -1.27 0.00 0.00 60.65 59.43 1vgw h LYS 92 Cb 0.04 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 31.65 1vgw h LYS 92 CO -0.10 0.85 0.47 -0.07 -2.27 0.00 0.00 179.45 178.33 1vgw h LEU 93 N 0.96 0.64 0.02 5.20 3.38 -1.32 0.97 115.31 125.18 1vgw h LEU 93 Ca 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 1vgw h LEU 93 Cb 0.21 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1vgw h LEU 93 CO -0.02 0.42 -0.01 -0.07 0.09 0.00 0.00 178.44 178.85 1vgw h LEU 94 N 0.73 -0.02 -0.98 1.67 4.07 -1.21 -2.44 115.31 117.12 1vgw h LEU 94 Ca 0.31 -0.73 -0.03 0.00 0.08 0.00 0.00 57.88 57.51 1vgw h LEU 94 Cb 0.26 0.01 -0.04 0.00 1.08 0.00 0.00 40.66 41.97 1vgw h LEU 94 CO -0.10 0.76 0.37 -0.08 -1.08 0.00 0.00 178.44 178.32 1vgw h GLU 95 N -0.85 1.10 0.00 1.13 4.22 -0.85 -2.41 114.58 116.91 1vgw h GLU 95 Ca -0.00 -0.15 -0.04 0.00 0.08 0.00 0.00 59.36 59.25 1vgw h GLU 95 Cb 0.75 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1vgw h GLU 95 CO 0.00 0.84 -0.17 0.00 -2.18 0.00 0.00 179.01 177.51 1vgw h THR 96 N 1.09 0.56 0.00 0.32 1.03 -0.90 -3.47 112.91 111.55 1vgw h THR 96 Ca 0.27 -0.81 0.00 0.00 -0.01 0.00 0.00 66.41 65.85 1vgw h THR 96 Cb 0.10 1.54 0.00 0.00 -1.07 0.00 0.00 68.15 68.72 1vgw h THR 96 CO -0.03 0.17 0.00 0.61 -0.01 0.00 0.00 175.52 176.25 1vgw n GLY 97 N -0.29 1.33 0.27 2.99 0.00 -0.91 -4.90 105.19 103.68 1vgw n GLY 97 Ca -0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.12 1vgw n GLY 97 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1vgw h LEU 98 N 0.00 0.00 -8.04 0.99 3.38 -1.73 -3.41 115.31 106.51 1vgw h LEU 98 Ca 0.00 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.53 1vgw h LEU 98 Cb 0.00 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 40.45 1vgw h LEU 98 CO 0.00 0.04 -0.79 0.00 0.09 0.00 0.00 178.44 177.78 1vgw s ALA 99 N -4.73 0.94 0.55 1.53 0.00 -0.99 -5.05 121.76 114.02 1vgw s ALA 99 Ca -0.05 -0.41 -0.09 0.00 0.00 0.00 0.00 51.96 51.41 1vgw s ALA 99 Cb 0.16 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.92 1vgw s ALA 99 CO 0.61 0.18 0.93 0.00 0.00 0.00 0.00 175.76 177.48 1vgw s ALA 100 N 0.04 3.22 0.56 0.00 0.00 -1.26 -4.39 121.76 119.93 1vgw s ALA 100 Ca -0.01 -0.22 0.28 0.00 0.00 0.00 0.00 51.96 52.00 1vgw s ALA 100 Cb -0.08 -2.89 1.47 0.00 0.00 0.00 0.00 23.12 21.63 1vgw s ALA 100 CO 0.00 -0.51 1.97 0.93 0.00 0.00 0.00 175.76 178.16 1vgw h GLU 101 N 0.03 0.00 -0.36 0.00 5.08 -1.97 0.29 114.58 117.66 1vgw h GLU 101 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1vgw h GLU 101 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1vgw h GLU 101 CO 0.62 0.00 0.00 0.25 -1.00 0.00 0.00 179.01 178.88 1vgw n THR 102 N -4.06 0.46 -2.71 1.13 -2.24 -1.26 -0.78 114.28 104.82 1vgw n THR 102 Ca 0.09 -0.72 -0.29 0.00 -2.27 0.00 0.00 64.05 60.86 1vgw n THR 102 Cb 0.62 0.99 -0.02 0.00 -2.10 0.00 0.00 70.33 69.82 1vgw n THR 102 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1vgw s ASP 103 N -1.53 6.42 -0.01 3.42 1.01 0.10 -4.84 116.67 121.24 1vgw s ASP 103 Ca 0.38 1.10 -0.20 0.00 0.71 0.00 0.00 52.55 54.54 1vgw s ASP 103 Cb 0.23 -2.31 -0.05 0.00 1.01 0.00 0.00 42.92 41.79 1vgw s ASP 103 CO 0.32 -0.49 0.57 0.20 0.21 0.00 0.00 175.17 175.98 1vgw s ASN 104 N -3.53 6.94 -0.19 0.27 0.01 -0.73 -0.76 114.94 116.96 1vgw s ASN 104 Ca 0.50 1.12 -0.04 0.00 -0.71 0.00 0.00 52.86 53.74 1vgw s ASN 104 Cb -0.10 -2.35 -0.02 0.00 0.41 0.00 0.00 41.25 39.19 1vgw s ASN 104 CO 0.37 0.11 -0.04 -0.63 -1.51 0.00 0.00 177.10 175.40 1vgw s ILE 105 N -0.18 3.57 -0.53 0.60 -1.09 -0.66 -0.99 121.20 121.92 1vgw s ILE 105 Ca 0.30 -0.45 -0.11 0.00 -2.23 0.00 0.00 60.65 58.17 1vgw s ILE 105 Cb -0.18 -2.59 0.13 0.00 -1.58 0.00 0.00 42.46 38.24 1vgw s ILE 105 CO 0.16 0.45 0.42 -0.76 -1.23 0.00 0.00 174.94 173.99 1vgw s LEU 106 N 0.97 5.87 -0.15 2.97 1.02 0.16 -1.26 118.68 128.27 1vgw s LEU 106 Ca 0.00 -2.03 -0.28 0.00 0.02 0.00 0.00 54.13 51.84 1vgw s LEU 106 Cb -0.15 -2.06 -0.01 0.00 0.02 0.00 0.00 46.19 44.00 1vgw s LEU 106 CO 0.01 -0.69 0.94 -0.69 0.02 0.00 0.00 176.35 175.94 1vgw s VAL 107 N 1.19 4.81 0.02 -1.59 1.01 -0.58 -0.65 120.40 124.61 1vgw s VAL 107 Ca 0.07 1.88 0.05 0.00 0.00 0.00 0.00 61.98 63.99 1vgw s VAL 107 Cb -0.25 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 31.87 1vgw s VAL 107 CO -0.01 -0.02 -0.16 -2.28 0.00 0.00 0.00 175.10 172.63 1vgw s HIS 108 N 2.25 1.42 0.20 5.22 5.04 -0.60 -1.62 115.29 127.20 1vgw s HIS 108 Ca 0.44 -0.32 -0.30 0.00 -1.54 0.00 0.00 55.06 53.34 1vgw s HIS 108 Cb -0.17 -0.88 -0.08 0.00 0.04 0.00 0.00 32.58 31.49 1vgw s HIS 108 CO 0.14 0.02 1.19 -0.51 -2.34 0.00 0.00 174.74 173.24 1vgw s ASP 109 N -0.80 7.09 0.58 9.88 -0.00 -1.26 -4.28 116.67 127.88 1vgw s ASP 109 Ca 0.05 2.25 0.35 0.00 -0.00 0.00 0.00 52.55 55.20 1vgw s ASP 109 Cb -0.07 -2.61 1.73 0.00 -0.00 0.00 0.00 42.92 41.97 1vgw s ASP 109 CO 0.01 -0.36 2.13 0.00 -0.00 0.00 0.00 175.17 176.95 1vgw h ALA 110 N 5.10 1.08 -0.03 5.23 0.00 -1.96 -2.26 119.26 126.41 1vgw h ALA 110 Ca -0.45 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1vgw h ALA 110 Cb 1.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1vgw h ALA 110 CO 0.74 0.05 -0.05 0.00 0.00 0.00 0.00 179.25 179.99 1vgw n ALA 111 N -2.14 2.60 -2.56 0.00 0.00 -1.26 -4.48 120.51 112.67 1vgw n ALA 111 Ca -0.01 -0.63 -0.43 0.00 0.00 0.00 0.00 53.44 52.37 1vgw n ALA 111 Cb 0.21 -0.88 0.01 0.00 0.00 0.00 0.00 19.45 18.79 1vgw n ALA 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1vgw n ARG 112 N 0.96 4.03 -0.44 0.00 1.74 -0.85 -1.88 116.66 120.22 1vgw n ARG 112 Ca 0.14 -3.92 -0.06 0.00 -0.77 0.00 0.00 57.85 53.25 1vgw n ARG 112 Cb 0.54 -2.75 0.10 0.00 -1.02 0.00 0.00 32.46 29.33 1vgw n ARG 112 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1vgw n LEU 115 N -0.12 2.88 -4.72 0.00 7.94 -1.24 -4.50 117.00 117.24 1vgw n LEU 115 Ca 0.00 1.05 -0.42 0.00 -1.11 0.00 0.00 56.01 55.53 1vgw n LEU 115 Cb 0.48 -1.32 -0.03 0.00 0.53 0.00 0.00 43.42 43.08 1vgw n LEU 115 CO 0.00 -0.34 0.90 -2.84 -1.11 0.00 0.00 177.39 174.00 1vgw s PRO 116 N 2.46 4.44 0.43 1.96 0.02 -1.26 -4.93 135.00 138.12 1vgw s PRO 116 Ca 0.88 1.83 0.16 0.00 0.02 0.00 0.00 61.00 63.89 1vgw s PRO 116 Cb -0.79 -3.30 1.06 0.00 0.02 0.00 0.00 34.50 31.48 1vgw s PRO 116 CO 0.49 -0.22 1.93 0.66 -0.33 0.00 0.00 177.00 179.54 1vgw h SER 117 N 6.31 0.37 0.39 2.53 4.64 -1.94 0.42 113.55 126.28 1vgw h SER 117 Ca -0.43 0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 60.87 1vgw h SER 117 Cb 1.21 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 1vgw h SER 117 CO 0.80 0.20 -0.21 -0.08 -0.87 0.00 0.00 176.83 176.67 1vgw h GLU 118 N 0.40 0.00 0.04 4.77 4.81 -1.99 -1.27 114.58 121.34 1vgw h GLU 118 Ca 0.35 0.00 -0.26 0.00 -0.13 0.00 0.00 59.36 59.32 1vgw h GLU 118 Cb 0.81 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.16 1vgw h GLU 118 CO -0.11 0.21 -1.35 0.00 -0.73 0.00 0.00 179.01 177.03 1vgw h ALA 119 N 1.79 0.41 -0.34 2.92 0.00 -0.56 -2.51 119.26 120.98 1vgw h ALA 119 Ca -0.00 -1.10 -0.06 0.00 0.00 0.00 0.00 54.91 53.75 1vgw h ALA 119 Cb 0.46 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1vgw h ALA 119 CO 0.03 1.28 -0.04 1.25 0.00 0.00 0.00 179.25 181.77 1vgw h LEU 120 N 0.03 0.51 -0.35 0.00 5.85 -1.14 -0.45 115.31 119.76 1vgw h LEU 120 Ca -0.15 -0.11 -0.08 0.00 0.84 0.00 0.00 57.88 58.37 1vgw h LEU 120 Cb 1.92 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.80 1vgw h LEU 120 CO 0.13 0.61 -0.11 0.00 -0.34 0.00 0.00 178.44 178.73 1vgw h ALA 121 N 1.46 0.48 -0.28 1.25 0.00 -1.19 -2.21 119.26 118.77 1vgw h ALA 121 Ca 0.11 -0.31 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1vgw h ALA 121 Cb 0.38 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1vgw h ALA 121 CO 0.02 0.35 0.07 0.00 0.00 0.00 0.00 179.25 179.69 1vgw h ARG 122 N 0.48 0.18 -0.08 0.00 3.08 -0.94 0.24 114.38 117.35 1vgw h ARG 122 Ca 0.09 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.16 1vgw h ARG 122 Cb 0.62 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 1vgw h ARG 122 CO 0.04 0.12 -0.14 1.25 -1.07 0.00 0.00 179.97 180.17 1vgw h LEU 123 N 0.19 -0.41 -0.47 3.04 5.85 -0.87 0.16 115.31 122.79 1vgw h LEU 123 Ca 0.13 0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.84 1vgw h LEU 123 Cb 0.12 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 1vgw h LEU 123 CO -0.15 -0.18 -0.03 0.40 -0.34 0.00 0.00 178.44 178.13 1vgw h ILE 124 N -0.19 1.27 -0.26 4.05 2.04 -1.12 -0.95 117.51 122.34 1vgw h ILE 124 Ca 0.07 -1.12 -0.07 0.00 1.00 0.00 0.00 64.86 64.75 1vgw h ILE 124 Cb 0.29 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 1vgw h ILE 124 CO -0.19 0.39 -0.15 -0.08 0.00 0.00 0.00 178.15 178.12 1vgw h GLU 125 N 0.70 0.44 0.00 2.37 4.57 -0.23 -0.60 114.58 121.82 1vgw h GLU 125 Ca 0.13 -0.13 -0.21 0.00 -1.18 0.00 0.00 59.36 57.97 1vgw h GLU 125 Cb 0.55 -0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 29.06 1vgw h GLU 125 CO 0.03 0.58 -1.82 1.04 -1.18 0.00 0.00 179.01 177.67 1vgw n GLN 126 N -4.20 0.65 0.00 1.92 6.02 0.53 -4.45 117.38 117.85 1vgw n GLN 126 Ca 0.00 0.09 0.02 0.00 -0.01 0.00 0.00 57.00 57.11 1vgw n GLN 126 Cb 0.33 -1.68 0.01 0.00 1.02 0.00 0.00 30.24 29.92 1vgw n GLN 126 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1vgw n ALA 127 N -2.49 2.50 -0.29 -1.58 0.00 -0.37 -4.66 120.51 113.62 1vgw n ALA 127 Ca -0.16 -0.47 0.02 0.00 0.00 0.00 0.00 53.44 52.83 1vgw n ALA 127 Cb 0.90 -0.16 0.15 0.00 0.00 0.00 0.00 19.45 20.34 1vgw n ALA 127 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1vgw h GLY 128 N 0.95 1.26 -2.63 0.00 0.00 -1.20 -2.79 103.07 98.66 1vgw h GLY 128 Ca 0.00 -0.34 -0.21 0.00 0.00 0.00 0.00 47.33 46.79 1vgw h GLY 128 CO 0.00 0.18 0.14 0.70 0.00 0.00 0.00 176.54 177.56 1vgw n ASN 129 N -4.70 3.52 -4.57 0.19 3.02 -1.26 -4.97 115.26 106.50 1vgw n ASN 129 Ca 0.13 -3.46 -0.34 0.00 -0.03 0.00 0.00 54.58 50.88 1vgw n ASN 129 Cb 0.23 -0.67 -0.11 0.00 -0.61 0.00 0.00 39.78 38.61 1vgw n ASN 129 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vgw s ALA 130 N -3.11 3.08 0.40 5.41 0.00 -1.05 -5.00 121.76 121.49 1vgw s ALA 130 Ca 0.49 -0.83 0.29 0.00 0.00 0.00 0.00 51.96 51.91 1vgw s ALA 130 Cb 0.41 -1.49 1.51 0.00 0.00 0.00 0.00 23.12 23.55 1vgw s ALA 130 CO 0.07 0.38 2.08 0.00 0.00 0.00 0.00 175.76 178.28 1vgw h ALA 131 N 6.04 1.23 -0.00 0.00 0.00 -1.94 -2.68 119.26 121.90 1vgw h ALA 131 Ca -0.40 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1vgw h ALA 131 Cb 1.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1vgw h ALA 131 CO 0.59 0.13 -0.41 -0.85 0.00 0.00 0.00 179.25 178.71 1vgw n GLU 132 N -3.54 0.31 0.00 0.00 0.00 -1.26 -4.86 120.64 111.29 1vgw n GLU 132 Ca -0.02 -0.18 0.00 0.00 0.00 0.00 0.00 57.16 56.96 1vgw n GLU 132 Cb 0.24 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.18 1vgw n GLU 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1vgw n GLY 133 N 1.44 -1.37 3.58 -1.84 0.00 -1.01 -4.09 105.19 101.89 1vgw n GLY 133 Ca 0.08 -1.24 -0.05 0.00 0.00 0.00 0.00 46.02 44.81 1vgw n GLY 133 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1vgw s GLY 134 N -2.34 -0.32 0.12 -0.02 0.00 -0.71 -1.99 107.32 102.06 1vgw s GLY 134 Ca 0.00 1.50 0.04 0.00 0.00 0.00 0.00 44.72 46.26 1vgw s GLY 134 CO 0.00 0.50 -0.10 -0.26 0.00 0.00 0.00 173.10 173.25 1vgw s ILE 135 N -2.53 0.98 0.25 0.90 -4.36 -0.92 -0.34 121.20 115.18 1vgw s ILE 135 Ca 0.09 -1.84 -0.25 0.00 -0.26 0.00 0.00 60.65 58.39 1vgw s ILE 135 Cb -0.01 -1.59 -0.09 0.00 1.25 0.00 0.00 42.46 42.02 1vgw s ILE 135 CO -0.05 -0.68 0.84 -0.76 0.24 0.00 0.00 174.94 174.53 1vgw s LEU 136 N -2.81 4.44 0.04 0.37 1.43 -1.07 -1.43 118.68 119.65 1vgw s LEU 136 Ca 0.11 1.69 -0.22 0.00 -1.03 0.00 0.00 54.13 54.67 1vgw s LEU 136 Cb 0.01 -3.68 0.05 0.00 0.03 0.00 0.00 46.19 42.59 1vgw s LEU 136 CO -0.01 0.05 0.52 0.00 0.23 0.00 0.00 176.35 177.14 1vgw s ALA 137 N -1.43 -1.32 -0.07 4.21 0.00 0.12 -1.17 121.76 122.10 1vgw s ALA 137 Ca 0.44 0.60 0.05 0.00 0.00 0.00 0.00 51.96 53.05 1vgw s ALA 137 Cb -0.20 0.37 -0.00 0.00 0.00 0.00 0.00 23.12 23.28 1vgw s ALA 137 CO 0.25 -0.50 -0.21 0.14 0.00 0.00 0.00 175.76 175.44 1vgw s VAL 138 N -2.39 1.78 0.34 0.00 -7.23 -0.62 -1.46 120.40 110.81 1vgw s VAL 138 Ca -0.06 -0.89 -0.28 0.00 -1.81 0.00 0.00 61.98 58.94 1vgw s VAL 138 Cb -0.01 -1.53 -0.12 0.00 0.56 0.00 0.00 36.38 35.28 1vgw s VAL 138 CO -0.01 0.50 1.34 -2.65 -0.31 0.00 0.00 175.10 173.96 1vgw n PRO 139 N 3.28 2.22 -2.05 4.82 -0.02 -1.26 -0.95 135.00 141.04 1vgw n PRO 139 Ca -0.19 0.78 -0.43 0.00 -2.02 0.00 0.00 63.50 61.65 1vgw n PRO 139 Cb 0.52 -2.40 -0.03 0.00 -0.02 0.00 0.00 33.50 31.58 1vgw n PRO 139 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1vgw s VAL 140 N -0.99 3.63 -0.12 -1.45 1.01 -0.57 -4.79 120.40 117.12 1vgw s VAL 140 Ca 0.56 0.74 0.20 0.00 0.00 0.00 0.00 61.98 63.48 1vgw s VAL 140 Cb -0.56 -3.56 -0.22 0.00 0.00 0.00 0.00 36.38 32.04 1vgw s VAL 140 CO 0.61 -0.15 0.53 0.00 0.00 0.00 0.00 175.10 176.09 1vgw n ALA 141 N 7.83 2.21 -2.63 5.51 0.00 -1.26 -4.94 120.51 127.23 1vgw n ALA 141 Ca 0.18 -0.70 -0.29 0.00 0.00 0.00 0.00 53.44 52.63 1vgw n ALA 141 Cb 0.44 -0.70 -0.04 0.00 0.00 0.00 0.00 19.45 19.15 1vgw n ALA 141 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1vgw s ASP 142 N -5.19 6.45 0.28 0.00 -0.00 -1.26 -5.06 116.67 111.88 1vgw s ASP 142 Ca -0.06 0.59 -0.30 0.00 -0.00 0.00 0.00 52.55 52.78 1vgw s ASP 142 Cb 0.10 -2.09 -0.12 0.00 -0.00 0.00 0.00 42.92 40.81 1vgw s ASP 142 CO 0.85 -0.08 1.56 0.41 -0.00 0.00 0.00 175.17 177.91 1vgw n THR 143 N -0.56 0.96 -3.95 -1.27 -1.04 -1.26 -4.93 114.28 102.24 1vgw n THR 143 Ca -0.03 -0.24 -0.32 0.00 -2.04 0.00 0.00 64.05 61.42 1vgw n THR 143 Cb 0.53 -1.85 -0.05 0.00 -1.82 0.00 0.00 70.33 67.14 1vgw n THR 143 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1vgw s LEU 144 N -0.27 4.25 0.05 -4.42 1.43 -1.26 -5.04 118.68 113.42 1vgw s LEU 144 Ca 0.65 0.25 0.03 0.00 -1.03 0.00 0.00 54.13 54.04 1vgw s LEU 144 Cb -0.53 -2.71 -0.02 0.00 0.03 0.00 0.00 46.19 42.95 1vgw s LEU 144 CO 0.48 0.21 -0.09 -0.54 0.23 0.00 0.00 176.35 176.64 1vgw s LYS 145 N -2.21 0.59 -0.16 1.70 -0.14 -1.26 -0.65 119.74 117.61 1vgw s LYS 145 Ca 0.30 -0.79 -0.07 0.00 -1.36 0.00 0.00 55.97 54.05 1vgw s LYS 145 Cb -0.13 -0.42 -0.04 0.00 -1.68 0.00 0.00 37.83 35.56 1vgw s LYS 145 CO 0.23 0.08 0.09 0.50 -0.76 0.00 0.00 175.35 175.49 1vgw s ARG 146 N -1.58 3.78 0.03 1.68 3.52 0.12 -4.88 118.95 121.62 1vgw s ARG 146 Ca -0.08 -0.27 -0.01 0.00 -0.13 0.00 0.00 55.73 55.25 1vgw s ARG 146 Cb -0.10 -3.21 -0.04 0.00 -1.56 0.00 0.00 34.95 30.05 1vgw s ARG 146 CO 0.01 0.46 0.17 0.00 -0.81 0.00 0.00 175.30 175.13 1vgw s ALA 147 N -0.14 3.90 -0.01 6.12 0.00 -1.26 -1.10 121.76 129.27 1vgw s ALA 147 Ca 0.08 -0.84 -0.03 0.00 0.00 0.00 0.00 51.96 51.18 1vgw s ALA 147 Cb -0.12 -1.78 -0.01 0.00 0.00 0.00 0.00 23.12 21.22 1vgw s ALA 147 CO 0.01 0.78 -0.06 -1.91 0.00 0.00 0.00 175.76 174.58 1vgw n GLU 148 N 0.61 0.09 -2.71 0.00 2.13 0.23 -4.84 120.64 116.15 1vgw n GLU 148 Ca -0.08 0.03 -0.06 0.00 0.66 0.00 0.00 57.16 57.71 1vgw n GLU 148 Cb 0.52 -0.48 0.04 0.00 0.27 0.00 0.00 31.44 31.79 1vgw n GLU 148 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1vgw n SER 149 N -3.04 1.34 0.00 4.31 7.64 -1.26 -4.83 113.62 117.78 1vgw n SER 149 Ca -0.02 -2.51 0.00 0.00 1.01 0.00 0.00 58.87 57.34 1vgw n SER 149 Cb 0.09 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.83 1vgw n SER 149 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vgw n GLY 150 N -0.24 0.66 3.59 0.23 0.00 -1.26 -5.08 105.19 103.09 1vgw n GLY 150 Ca 0.08 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 1vgw n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1vgw s GLN 151 N -0.62 2.01 -0.24 1.61 -0.21 -1.26 -5.10 119.66 115.84 1vgw s GLN 151 Ca 0.00 -1.71 -0.20 0.00 0.02 0.00 0.00 55.36 53.47 1vgw s GLN 151 Cb 0.00 -1.92 -0.02 0.00 1.00 0.00 0.00 33.01 32.07 1vgw s GLN 151 CO 0.00 0.23 0.61 0.42 -2.12 0.00 0.00 175.29 174.43 1vgw s ILE 152 N -2.49 5.00 -0.60 1.08 1.01 -1.26 -0.60 121.20 123.35 1vgw s ILE 152 Ca 0.33 1.11 0.22 0.00 0.00 0.00 0.00 60.65 62.31 1vgw s ILE 152 Cb -0.02 -3.92 -0.20 0.00 0.01 0.00 0.00 42.46 38.33 1vgw s ILE 152 CO 0.18 0.06 0.87 -1.54 0.00 0.00 0.00 174.94 174.51 1vgw n SER 153 N 5.51 0.59 -3.63 3.58 3.41 -0.26 -4.94 113.62 117.88 1vgw n SER 153 Ca -0.01 -0.40 -0.03 0.00 -0.26 0.00 0.00 58.87 58.17 1vgw n SER 153 Cb 0.49 1.12 -0.03 0.00 -0.26 0.00 0.00 64.21 65.53 1vgw n SER 153 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vgw s ALA 154 N -3.21 -2.12 -0.26 7.33 0.00 -1.21 -4.97 121.76 117.32 1vgw s ALA 154 Ca 0.02 1.82 -0.13 0.00 0.00 0.00 0.00 51.96 53.68 1vgw s ALA 154 Cb 0.15 -0.92 -0.04 0.00 0.00 0.00 0.00 23.12 22.30 1vgw s ALA 154 CO 0.84 -0.39 0.26 0.99 0.00 0.00 0.00 175.76 177.47 1vgw s THR 155 N -1.54 5.26 -0.19 0.00 2.01 -1.26 0.15 115.64 120.08 1vgw s THR 155 Ca 0.09 0.35 -0.09 0.00 0.31 0.00 0.00 61.69 62.35 1vgw s THR 155 Cb -0.01 -3.60 -0.05 0.00 0.01 0.00 0.00 72.50 68.85 1vgw s THR 155 CO -0.05 0.23 0.13 0.68 -0.69 0.00 0.00 174.62 174.92 1vgw s VAL 156 N 1.71 5.39 0.10 3.82 -7.23 0.18 -4.95 120.40 119.41 1vgw s VAL 156 Ca 0.11 0.18 -0.34 0.00 -1.81 0.00 0.00 61.98 60.12 1vgw s VAL 156 Cb -0.15 -3.44 -0.13 0.00 0.56 0.00 0.00 36.38 33.21 1vgw s VAL 156 CO 0.09 0.47 1.65 -0.67 -0.31 0.00 0.00 175.10 176.33 1vgw n ASP 157 N 3.26 3.18 -1.06 4.85 -0.08 -1.26 -4.00 116.55 121.45 1vgw n ASP 157 Ca -0.17 1.06 0.08 0.00 -1.51 0.00 0.00 54.79 54.25 1vgw n ASP 157 Cb 0.53 -1.42 0.24 0.00 2.34 0.00 0.00 41.12 42.81 1vgw n ASP 157 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1vgw n ARG 158 N 4.17 2.50 -1.70 -0.67 1.85 -1.26 -4.91 116.66 116.64 1vgw n ARG 158 Ca 0.18 -1.92 -0.42 0.00 -1.00 0.00 0.00 57.85 54.69 1vgw n ARG 158 Cb 0.29 -1.53 -0.03 0.00 -1.05 0.00 0.00 32.46 30.14 1vgw n ARG 158 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1vgw s SER 159 N -0.91 6.44 -1.54 2.89 0.15 -1.26 -2.26 113.70 117.22 1vgw s SER 159 Ca 0.35 2.70 0.00 0.00 0.70 0.00 0.00 55.95 59.70 1vgw s SER 159 Cb 0.20 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.97 1vgw s SER 159 CO 0.21 -1.03 0.00 0.61 1.20 0.00 0.00 173.24 174.23 1vgw n GLY 160 N 4.40 1.47 3.88 9.45 0.00 -1.26 -5.00 105.19 118.13 1vgw n GLY 160 Ca 0.19 -0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 1vgw n GLY 160 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vgw s LEU 161 N -3.31 4.36 0.04 0.99 1.43 -0.96 -5.07 118.68 116.17 1vgw s LEU 161 Ca 0.00 0.66 0.02 0.00 -1.03 0.00 0.00 54.13 53.79 1vgw s LEU 161 Cb 0.00 -2.79 -0.02 0.00 0.03 0.00 0.00 46.19 43.40 1vgw s LEU 161 CO 0.00 0.22 -0.08 0.26 0.23 0.00 0.00 176.35 176.98 1vgw s TRP 162 N -1.33 0.71 -0.24 0.29 0.52 -1.26 -1.52 118.94 116.11 1vgw s TRP 162 Ca 0.30 -0.44 -0.10 0.00 0.02 0.00 0.00 56.10 55.87 1vgw s TRP 162 Cb -0.14 -0.43 -0.05 0.00 -1.15 0.00 0.00 33.47 31.71 1vgw s TRP 162 CO 0.17 -0.06 0.15 -0.65 0.02 0.00 0.00 176.95 176.58 1vgw s GLN 163 N -1.40 4.04 0.30 4.98 -0.21 -0.13 -4.85 119.66 122.40 1vgw s GLN 163 Ca -0.07 -0.28 -0.28 0.00 0.02 0.00 0.00 55.36 54.74 1vgw s GLN 163 Cb -0.09 -3.52 -0.09 0.00 1.00 0.00 0.00 33.01 30.31 1vgw s GLN 163 CO 0.01 0.05 1.06 0.00 -2.12 0.00 0.00 175.29 174.29 1vgw s ALA 164 N 1.08 3.33 0.00 6.09 0.00 -1.26 -1.59 121.76 129.40 1vgw s ALA 164 Ca 0.07 0.81 0.00 0.00 0.00 0.00 0.00 51.96 52.84 1vgw s ALA 164 Cb -0.14 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.69 1vgw s ALA 164 CO 0.05 -0.11 0.00 1.04 0.00 0.00 0.00 175.76 176.74 1vgw n GLN 165 N 0.95 2.79 -4.26 0.00 6.02 -0.32 -4.95 117.38 117.62 1vgw n GLN 165 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 56.85 1vgw n GLN 165 Cb 0.46 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.62 1vgw n GLN 165 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1vgw s THR 166 N -0.17 1.06 0.91 5.09 -4.23 -1.26 -4.44 115.64 112.60 1vgw s THR 166 Ca 0.00 -2.04 -0.12 0.00 -1.18 0.00 0.00 61.69 58.35 1vgw s THR 166 Cb 0.00 -1.97 0.14 0.00 1.34 0.00 0.00 72.50 72.01 1vgw s THR 166 CO 0.00 -0.64 1.09 -2.84 -0.54 0.00 0.00 174.62 171.69 1vgw s PRO 167 N -3.79 1.11 -0.29 3.99 0.02 -1.26 -4.77 135.00 130.01 1vgw s PRO 167 Ca 0.20 0.84 0.03 0.00 0.02 0.00 0.00 61.00 62.08 1vgw s PRO 167 Cb 0.04 -1.79 0.07 0.00 0.02 0.00 0.00 34.50 32.84 1vgw s PRO 167 CO 0.02 -2.35 -0.05 -0.65 -0.33 0.00 0.00 177.00 173.65 1vgw s GLN 168 N -4.90 2.03 -0.34 5.54 -0.21 -0.64 -2.59 119.66 118.54 1vgw s GLN 168 Ca 0.64 -1.51 -0.16 0.00 0.02 0.00 0.00 55.36 54.35 1vgw s GLN 168 Cb -0.18 -3.02 -0.01 0.00 1.00 0.00 0.00 33.01 30.80 1vgw s GLN 168 CO 0.57 -0.69 0.43 -1.17 -2.12 0.00 0.00 175.29 172.31 1vgw s LEU 169 N 1.05 4.40 0.02 2.90 2.96 0.54 -1.52 118.68 129.02 1vgw s LEU 169 Ca -0.03 -0.14 0.00 0.00 -0.22 0.00 0.00 54.13 53.75 1vgw s LEU 169 Cb -0.20 -2.44 -0.02 0.00 0.50 0.00 0.00 46.19 44.03 1vgw s LEU 169 CO -0.06 -0.39 -0.03 -0.36 -1.32 0.00 0.00 176.35 174.19 1vgw s PHE 170 N 2.17 0.23 0.28 5.38 0.40 -0.39 -1.73 117.98 124.32 1vgw s PHE 170 Ca 0.15 -0.46 -0.30 0.00 -0.60 0.00 0.00 56.93 55.72 1vgw s PHE 170 Cb -0.16 -0.17 -0.13 0.00 0.51 0.00 0.00 43.02 43.08 1vgw s PHE 170 CO 0.12 -0.16 1.40 1.04 0.70 0.00 0.00 175.22 178.32 1vgw n GLN 171 N 1.81 2.18 -0.18 0.44 6.02 -1.26 -1.65 117.38 124.73 1vgw n GLN 171 Ca -0.22 0.77 -0.01 0.00 -0.01 0.00 0.00 57.00 57.52 1vgw n GLN 171 Cb 0.56 -2.42 0.07 0.00 1.02 0.00 0.00 30.24 29.46 1vgw n GLN 171 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1vgw h ALA 172 N 3.76 0.48 -0.48 -1.58 0.00 -0.98 -0.77 119.26 119.68 1vgw h ALA 172 Ca -0.46 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1vgw h ALA 172 Cb 1.27 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1vgw h ALA 172 CO 0.72 -0.41 0.22 0.78 0.00 0.00 0.00 179.25 180.57 1vgw h GLY 173 N 0.08 0.75 1.00 0.00 0.00 -1.23 -1.45 103.07 102.21 1vgw h GLY 173 Ca 0.27 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1vgw h GLY 173 CO -0.49 0.36 0.11 -2.00 0.00 0.00 0.00 176.54 174.52 1vgw h LEU 174 N 0.63 0.19 -0.65 3.11 5.85 -1.68 -2.70 115.31 120.07 1vgw h LEU 174 Ca 0.16 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 1vgw h LEU 174 Cb 0.13 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1vgw h LEU 174 CO -0.02 0.14 0.27 0.25 -0.34 0.00 0.00 178.44 178.74 1vgw h LEU 175 N 0.23 0.89 -0.45 2.25 5.85 -0.93 -1.96 115.31 121.18 1vgw h LEU 175 Ca 0.06 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.62 1vgw h LEU 175 Cb -0.02 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 1vgw h LEU 175 CO -0.01 0.81 0.29 -0.74 -0.34 0.00 0.00 178.44 178.45 1vgw h HIS 176 N 0.91 0.56 0.16 1.25 2.76 -1.24 -1.36 115.15 118.19 1vgw h HIS 176 Ca 0.22 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.40 1vgw h HIS 176 Cb 0.19 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 1vgw h HIS 176 CO 0.01 0.35 -0.15 -0.09 -1.30 0.00 0.00 177.93 176.75 1vgw h ARG 177 N 0.60 -0.32 -0.77 5.26 2.43 -1.23 -2.22 114.38 118.13 1vgw h ARG 177 Ca 0.17 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.37 1vgw h ARG 177 Cb -0.06 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.52 1vgw h ARG 177 CO -0.04 -0.21 0.51 0.00 -1.51 0.00 0.00 179.97 178.72 1vgw h ALA 178 N 0.48 1.48 -0.00 2.80 0.00 -1.23 -2.29 119.26 120.50 1vgw h ALA 178 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1vgw h ALA 178 Cb 0.31 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1vgw h ALA 178 CO -0.03 0.47 -0.13 1.28 0.00 0.00 0.00 179.25 180.84 1vgw n LEU 179 N -4.43 0.46 0.07 0.00 4.77 -0.53 -3.97 117.00 113.38 1vgw n LEU 179 Ca 0.09 0.03 -0.18 0.00 -0.03 0.00 0.00 56.01 55.92 1vgw n LEU 179 Cb 0.06 -0.21 -0.14 0.00 -2.33 0.00 0.00 43.42 40.80 1vgw n LEU 179 CO 0.36 0.09 -0.32 0.00 -1.33 0.00 0.00 177.39 176.18 1vgw h ALA 180 N 3.53 0.21 -3.00 -1.18 0.00 -0.79 -3.50 119.26 114.54 1vgw h ALA 180 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 53.83 1vgw h ALA 180 Cb 0.38 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1vgw h ALA 180 CO 0.00 1.08 0.00 0.00 0.00 0.00 0.00 179.25 180.33 1vgw n ALA 181 N -2.68 0.00 -0.94 0.00 0.00 -1.21 -5.12 120.51 110.56 1vgw n ALA 181 Ca -0.17 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.26 1vgw n ALA 181 Cb 1.05 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.49 1vgw n ALA 181 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vgw n GLY 186 N 0.00 0.02 3.88 0.00 0.00 -1.26 -5.12 105.19 102.71 1vgw n GLY 186 Ca 0.00 -0.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 1vgw n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vgw s ILE 187 N 3.02 5.12 0.00 -0.61 1.01 -1.26 -5.03 121.20 123.45 1vgw s ILE 187 Ca 0.03 0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.98 1vgw s ILE 187 Cb 0.01 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.85 1vgw s ILE 187 CO 0.01 0.20 0.00 0.35 0.00 0.00 0.00 174.94 175.51 1vgw n THR 188 N 0.63 0.00 -2.24 2.92 -2.24 -1.26 -5.08 114.28 107.01 1vgw n THR 188 Ca -0.06 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.45 1vgw n THR 188 Cb 0.52 -0.13 0.13 0.00 -2.10 0.00 0.00 70.33 68.74 1vgw n THR 188 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1vgw s ASP 189 N 0.55 4.00 0.22 3.42 3.84 -1.26 -4.96 116.67 122.48 1vgw s ASP 189 Ca 0.00 0.09 -0.06 0.00 -0.00 0.00 0.00 52.55 52.58 1vgw s ASP 189 Cb 0.00 -0.41 0.19 0.00 -1.38 0.00 0.00 42.92 41.32 1vgw s ASP 189 CO 0.00 -2.13 1.71 -0.33 -0.00 0.00 0.00 175.17 174.42 1vgw h GLU 190 N -0.97 0.98 -0.54 2.11 3.07 -1.99 -2.18 114.58 115.05 1vgw h GLU 190 Ca -0.41 -0.27 0.07 0.00 -0.50 0.00 0.00 59.36 58.24 1vgw h GLU 190 Cb 1.27 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 29.04 1vgw h GLU 190 CO 0.45 0.94 0.36 0.00 -1.40 0.00 0.00 179.01 179.35 1vgw h ALA 191 N 1.13 1.91 -0.28 3.43 0.00 -1.96 -1.86 119.26 121.63 1vgw h ALA 191 Ca 0.18 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1vgw h ALA 191 Cb 0.47 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1vgw h ALA 191 CO 0.02 -0.01 -0.19 0.66 0.00 0.00 0.00 179.25 179.73 1vgw h SER 192 N 0.47 0.49 0.68 0.00 4.64 -1.76 -0.09 113.55 117.97 1vgw h SER 192 Ca 0.24 -0.15 -0.13 0.00 -0.47 0.00 0.00 61.79 61.28 1vgw h SER 192 Cb 0.35 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.28 1vgw h SER 192 CO -0.07 0.70 -0.63 0.00 -0.87 0.00 0.00 176.83 175.96 1vgw h ALA 193 N 1.35 0.93 -0.15 5.18 0.00 -1.31 -3.12 119.26 122.14 1vgw h ALA 193 Ca 0.08 -0.57 -0.19 0.00 0.00 0.00 0.00 54.91 54.23 1vgw h ALA 193 Cb 0.59 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1vgw h ALA 193 CO 0.04 0.78 -0.67 0.28 0.00 0.00 0.00 179.25 179.69 1vgw h VAL 194 N 0.00 1.33 -0.32 0.00 2.07 -0.86 -2.98 116.25 115.49 1vgw h VAL 194 Ca -0.01 -1.95 0.01 0.00 0.82 0.00 0.00 66.70 65.57 1vgw h VAL 194 Cb 1.14 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 32.81 1vgw h VAL 194 CO 0.08 0.60 0.21 -0.33 0.02 0.00 0.00 177.57 178.16 1vgw h GLU 195 N 0.43 0.39 0.00 1.57 5.08 -1.02 -2.62 114.58 118.40 1vgw h GLU 195 Ca -0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1vgw h GLU 195 Cb 1.25 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1vgw h GLU 195 CO 0.13 0.26 0.00 0.87 -1.00 0.00 0.00 179.01 179.27 1vgw h LYS 196 N 0.40 0.00 0.00 2.33 1.57 -1.46 -2.36 116.57 117.05 1vgw h LYS 196 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1vgw h LYS 196 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1vgw h LYS 196 CO -0.03 0.00 -0.70 1.28 -0.57 0.00 0.00 179.45 179.43 1vgw n LEU 197 N -2.37 0.61 0.00 2.94 4.32 -0.99 -4.93 117.00 116.59 1vgw n LEU 197 Ca 0.01 0.04 0.00 0.00 -0.02 0.00 0.00 56.01 56.04 1vgw n LEU 197 Cb 0.19 -0.18 0.00 0.00 -1.62 0.00 0.00 43.42 41.82 1vgw n LEU 197 CO 0.19 0.06 0.00 0.61 -1.22 0.00 0.00 177.39 177.02 1vgw n GLY 198 N 1.42 1.02 3.86 -0.72 0.00 -0.89 -5.09 105.19 104.78 1vgw n GLY 198 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1vgw n GLY 198 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vgw s VAL 199 N -2.00 5.20 -0.38 1.61 1.01 -1.21 -5.04 120.40 119.59 1vgw s VAL 199 Ca 0.00 0.58 -0.05 0.00 0.00 0.00 0.00 61.98 62.50 1vgw s VAL 199 Cb 0.00 -3.60 0.08 0.00 0.00 0.00 0.00 36.38 32.86 1vgw s VAL 199 CO 0.00 0.56 0.16 -0.13 0.00 0.00 0.00 175.10 175.69 1vgw s ARG 200 N -1.16 2.38 0.59 2.72 0.52 -1.26 -3.80 118.95 118.94 1vgw s ARG 200 Ca 0.22 -1.49 -0.18 0.00 -0.52 0.00 0.00 55.73 53.76 1vgw s ARG 200 Cb -0.15 -3.54 -0.04 0.00 0.52 0.00 0.00 34.95 31.75 1vgw s ARG 200 CO 0.11 -0.88 1.11 -2.14 0.02 0.00 0.00 175.30 173.52 1vgw s PRO 201 N 1.29 3.17 0.66 3.54 0.02 -1.26 -4.88 135.00 137.55 1vgw s PRO 201 Ca 0.02 1.48 -0.13 0.00 0.02 0.00 0.00 61.00 62.39 1vgw s PRO 201 Cb -0.22 -1.99 -0.00 0.00 0.02 0.00 0.00 34.50 32.31 1vgw s PRO 201 CO -0.01 -0.97 1.07 -0.51 -0.33 0.00 0.00 177.00 176.26 1vgw s LEU 202 N -4.23 3.30 -0.27 -5.54 1.43 -0.84 -4.93 118.68 107.60 1vgw s LEU 202 Ca 0.69 1.80 -0.04 0.00 -1.03 0.00 0.00 54.13 55.56 1vgw s LEU 202 Cb -0.21 -4.52 0.02 0.00 0.03 0.00 0.00 46.19 41.50 1vgw s LEU 202 CO 0.33 -1.47 -0.00 -0.76 0.23 0.00 0.00 176.35 174.67 1vgw s LEU 203 N -5.08 3.47 -0.08 1.79 1.43 -1.26 -2.16 118.68 116.79 1vgw s LEU 203 Ca 0.62 -0.83 0.02 0.00 -1.03 0.00 0.00 54.13 52.91 1vgw s LEU 203 Cb -0.16 -1.75 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 1vgw s LEU 203 CO 0.46 -0.16 -0.12 -0.63 0.23 0.00 0.00 176.35 176.13 1vgw s ILE 204 N 1.39 3.22 -0.24 -0.59 1.01 -0.52 -4.92 121.20 120.55 1vgw s ILE 204 Ca 0.01 -0.64 -0.34 0.00 0.00 0.00 0.00 60.65 59.68 1vgw s ILE 204 Cb -0.17 -2.31 -0.11 0.00 0.01 0.00 0.00 42.46 39.88 1vgw s ILE 204 CO -0.02 0.57 2.06 1.67 0.00 0.00 0.00 174.94 179.22 1vgw n GLN 205 N 2.74 1.58 0.00 2.79 -0.06 -1.26 0.10 117.38 123.28 1vgw n GLN 205 Ca -0.18 0.51 0.00 0.00 -2.00 0.00 0.00 57.00 55.33 1vgw n GLN 205 Cb 0.52 -2.62 0.00 0.00 -4.06 0.00 0.00 30.24 24.09 1vgw n GLN 205 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1vgw n GLY 206 N 5.53 0.93 3.41 1.69 0.00 -0.54 -4.73 105.19 111.49 1vgw n GLY 206 Ca 0.32 -1.43 -0.15 0.00 0.00 0.00 0.00 46.02 44.76 1vgw n GLY 206 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vgw s ASP 207 N -1.00 -0.49 0.36 1.61 2.15 -1.26 -4.93 116.67 113.11 1vgw s ASP 207 Ca 0.00 0.70 0.05 0.00 0.43 0.00 0.00 52.55 53.74 1vgw s ASP 207 Cb 0.00 0.72 0.70 0.00 -0.30 0.00 0.00 42.92 44.04 1vgw s ASP 207 CO 0.00 -0.39 1.95 0.00 -0.17 0.00 0.00 175.17 176.57 1vgw h ALA 208 N 4.20 1.51 0.00 3.66 0.00 -2.01 -0.56 119.26 126.06 1vgw h ALA 208 Ca -0.28 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1vgw h ALA 208 Cb 1.16 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1vgw h ALA 208 CO 0.30 0.38 0.00 0.00 0.00 0.00 0.00 179.25 179.92 1vgw h ARG 209 N 0.55 0.00 -2.07 0.00 3.08 -1.96 -3.30 114.38 110.68 1vgw h ARG 209 Ca 0.13 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.04 1vgw h ARG 209 Cb 0.15 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.15 1vgw h ARG 209 CO -0.01 0.00 -0.26 -1.71 -1.07 0.00 0.00 179.97 176.92 1vgw n ASN 210 N -2.94 4.82 -4.92 7.04 5.15 -0.22 -4.61 115.26 119.58 1vgw n ASN 210 Ca -0.00 -2.38 -0.26 0.00 -0.60 0.00 0.00 54.58 51.33 1vgw n ASN 210 Cb 0.21 -1.25 0.07 0.00 -0.53 0.00 0.00 39.78 38.28 1vgw n ASN 210 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 1vgw s LEU 211 N 0.00 2.81 -0.09 1.20 0.05 -1.25 -4.91 118.68 116.49 1vgw s LEU 211 Ca 0.50 0.55 -0.01 0.00 0.05 0.00 0.00 54.13 55.22 1vgw s LEU 211 Cb 0.24 -3.19 -0.03 0.00 -2.05 0.00 0.00 46.19 41.15 1vgw s LEU 211 CO 0.00 -1.59 -0.04 -0.75 -0.55 0.00 0.00 176.35 173.43 1vgw s LYS 212 N -5.28 2.99 -0.80 1.48 2.20 -1.26 -4.41 119.74 114.66 1vgw s LYS 212 Ca 0.60 -0.49 -0.25 0.00 -0.36 0.00 0.00 55.97 55.47 1vgw s LYS 212 Cb -0.11 -2.72 0.04 0.00 -1.51 0.00 0.00 37.83 33.53 1vgw s LYS 212 CO 0.46 0.61 1.27 -1.17 -0.36 0.00 0.00 175.35 176.16 1vgw s LEU 213 N -0.65 3.47 -0.01 5.43 2.96 -0.79 -4.71 118.68 124.38 1vgw s LEU 213 Ca 0.10 -0.82 0.01 0.00 -0.22 0.00 0.00 54.13 53.21 1vgw s LEU 213 Cb -0.12 -2.54 0.02 0.00 0.50 0.00 0.00 46.19 44.05 1vgw s LEU 213 CO 0.02 -1.68 0.75 0.35 -1.32 0.00 0.00 176.35 174.47 1vgw n THR 214 N 6.41 0.24 0.00 3.68 -2.24 -1.26 -4.93 114.28 116.18 1vgw n THR 214 Ca 0.10 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1vgw n THR 214 Cb 0.49 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.43 1vgw n THR 214 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vgw n GLN 215 N -0.15 0.00 -0.30 -0.78 10.64 -1.26 -5.03 117.38 120.50 1vgw n GLN 215 Ca 0.01 0.00 0.10 0.00 -1.83 0.00 0.00 57.00 55.28 1vgw n GLN 215 Cb 0.54 0.00 0.26 0.00 -0.86 0.00 0.00 30.24 30.18 1vgw n GLN 215 CO 0.00 0.00 0.00 -1.35 -1.83 0.00 0.00 177.06 173.88 1vgw h PRO 216 N 0.00 0.49 -0.43 2.61 0.11 -1.99 0.95 132.00 133.74 1vgw h PRO 216 Ca 0.00 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.10 1vgw h PRO 216 Cb 0.00 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 30.97 1vgw h PRO 216 CO 0.00 0.33 0.26 1.96 -0.21 0.00 0.00 178.00 180.34 1vgw h GLN 217 N 0.51 0.52 -0.16 1.05 7.50 -2.00 0.19 115.11 122.72 1vgw h GLN 217 Ca 0.50 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.62 1vgw h GLN 217 Cb 0.83 -0.12 -0.01 0.00 0.05 0.00 0.00 27.48 28.24 1vgw h GLN 217 CO -0.44 0.34 0.10 -0.44 -1.50 0.00 0.00 178.83 176.90 1vgw h ASP 218 N 0.53 0.18 -0.70 1.46 3.45 -1.44 -2.85 116.42 117.05 1vgw h ASP 218 Ca 0.17 -0.01 0.10 0.00 0.43 0.00 0.00 57.03 57.72 1vgw h ASP 218 Cb -0.01 -0.04 -0.08 0.00 -0.56 0.00 0.00 39.33 38.64 1vgw h ASP 218 CO -0.07 0.13 0.32 0.00 -1.57 0.00 0.00 179.24 178.05 1vgw h ALA 219 N 1.05 0.96 -0.42 3.45 0.00 -0.28 0.27 119.26 124.29 1vgw h ALA 219 Ca 0.06 0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.06 1vgw h ALA 219 Cb -0.02 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1vgw h ALA 219 CO -0.01 -0.11 0.24 0.10 0.00 0.00 0.00 179.25 179.47 1vgw h TYR 220 N 0.53 0.45 -0.76 0.00 -0.00 -0.43 0.34 116.97 117.09 1vgw h TYR 220 Ca 0.35 0.02 -0.06 0.00 -0.00 0.00 0.00 58.73 59.04 1vgw h TYR 220 Cb 0.42 -0.14 -0.03 0.00 -0.00 0.00 0.00 36.73 36.98 1vgw h TYR 220 CO -0.13 0.26 0.25 0.82 -0.00 0.00 0.00 178.16 179.36 1vgw h ILE 221 N 0.49 1.26 0.10 -0.90 2.04 -0.96 -2.06 117.51 117.48 1vgw h ILE 221 Ca 0.17 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 1vgw h ILE 221 Cb 0.02 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 1vgw h ILE 221 CO -0.09 0.36 -0.05 0.58 0.00 0.00 0.00 178.15 178.95 1vgw h VAL 222 N 1.13 1.05 -0.81 1.67 2.07 0.04 -1.40 116.25 120.00 1vgw h VAL 222 Ca 0.25 -0.58 0.18 0.00 0.82 0.00 0.00 66.70 67.37 1vgw h VAL 222 Cb 0.29 1.42 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 1vgw h VAL 222 CO -0.01 0.14 0.55 -0.09 0.02 0.00 0.00 177.57 178.18 1vgw h ARG 223 N -0.40 0.33 0.04 1.57 9.65 -0.24 0.22 114.38 125.56 1vgw h ARG 223 Ca -0.01 -0.02 -0.24 0.00 -1.10 0.00 0.00 59.98 58.61 1vgw h ARG 223 Cb 0.33 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.82 1vgw h ARG 223 CO 0.02 0.22 -1.15 -0.07 2.80 0.00 0.00 179.97 181.79 1vgw h LEU 224 N 0.34 0.14 -0.71 3.80 -0.00 -1.23 -3.27 115.31 114.38 1vgw h LEU 224 Ca 0.41 -0.16 -0.11 0.00 -0.00 0.00 0.00 57.88 58.02 1vgw h LEU 224 Cb 1.07 -0.05 -0.02 0.00 -0.00 0.00 0.00 40.66 41.67 1vgw h LEU 224 CO -0.12 1.13 -0.52 -0.07 -0.00 0.00 0.00 178.44 178.85 1vgw h LEU 225 N 0.03 0.00 -3.23 1.67 3.38 0.11 -3.22 115.31 114.04 1vgw h LEU 225 Ca -0.08 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.72 1vgw h LEU 225 Cb 1.86 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.53 1vgw h LEU 225 CO 0.15 0.52 0.22 0.18 0.09 0.00 0.00 178.44 179.61 1vgw n LEU 226 N -3.58 5.90 0.00 1.67 4.77 -0.17 -5.10 117.00 120.49 1vgw n LEU 226 Ca -0.00 -2.87 0.00 0.00 -0.03 0.00 0.00 56.01 53.11 1vgw n LEU 226 Cb 0.60 -1.08 0.00 0.00 -2.33 0.00 0.00 43.42 40.62 1vgw n LEU 226 CO 0.40 1.11 0.00 0.47 -1.33 0.00 0.00 177.39 178.04