#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vgw s LEU 1 N 0.00 3.53 0.71 2.46 0.20 -1.26 -5.12 118.68 119.19 1vgw s LEU 1 Ca 0.00 -2.02 -0.08 0.00 0.69 0.00 0.00 54.13 52.72 1vgw s LEU 1 Cb 0.00 -1.26 0.05 0.00 -0.43 0.00 0.00 46.19 44.55 1vgw s LEU 1 CO 0.00 -0.38 1.05 -0.54 -0.29 0.00 0.00 176.35 176.19 1vgw s LYS 2 N 1.11 2.36 0.45 1.98 3.01 -1.26 -5.04 119.74 122.35 1vgw s LYS 2 Ca 0.11 -0.02 -0.23 0.00 -1.01 0.00 0.00 55.97 54.82 1vgw s LYS 2 Cb -0.19 -2.11 -0.08 0.00 -1.01 0.00 0.00 37.83 34.44 1vgw s LYS 2 CO -0.14 -1.20 1.13 1.03 0.51 0.00 0.00 175.35 176.68 1vgw s ARG 3 N -5.30 3.83 0.17 1.68 0.52 -1.26 -5.02 118.95 113.58 1vgw s ARG 3 Ca 0.59 1.69 -0.08 0.00 -0.52 0.00 0.00 55.73 57.42 1vgw s ARG 3 Cb -0.11 -2.41 -0.06 0.00 0.52 0.00 0.00 34.95 32.89 1vgw s ARG 3 CO 0.47 -0.47 0.45 0.15 0.02 0.00 0.00 175.30 175.92 1vgw s LYS 4 N -2.70 3.72 -0.31 3.54 1.02 -1.26 -4.94 119.74 118.80 1vgw s LYS 4 Ca 0.63 0.10 -0.05 0.00 0.02 0.00 0.00 55.97 56.67 1vgw s LYS 4 Cb -0.26 -2.79 0.03 0.00 -0.52 0.00 0.00 37.83 34.29 1vgw s LYS 4 CO 0.32 0.42 0.06 -0.80 -0.92 0.00 0.00 175.35 174.43 1vgw s ASN 5 N -2.30 5.10 -0.23 2.83 0.01 -1.26 -1.07 114.94 118.01 1vgw s ASN 5 Ca 0.42 -1.05 -0.02 0.00 -0.71 0.00 0.00 52.86 51.50 1vgw s ASN 5 Cb -0.12 -1.82 0.02 0.00 0.41 0.00 0.00 41.25 39.74 1vgw s ASN 5 CO 0.22 -0.27 -0.07 -0.63 -1.51 0.00 0.00 177.10 174.84 1vgw s ILE 6 N 1.39 2.89 0.08 0.60 1.01 -0.72 -0.19 121.20 126.25 1vgw s ILE 6 Ca -0.01 -0.90 -0.30 0.00 0.00 0.00 0.00 60.65 59.43 1vgw s ILE 6 Cb -0.19 -2.41 -0.05 0.00 0.01 0.00 0.00 42.46 39.82 1vgw s ILE 6 CO 0.01 0.29 1.03 0.00 0.00 0.00 0.00 174.94 176.27 1vgw s ALA 7 N 1.35 3.26 -0.11 9.38 0.00 -0.59 -1.64 121.76 133.42 1vgw s ALA 7 Ca 0.02 0.65 0.02 0.00 0.00 0.00 0.00 51.96 52.65 1vgw s ALA 7 Cb -0.16 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.64 1vgw s ALA 7 CO -0.05 -0.19 -0.16 -1.17 0.00 0.00 0.00 175.76 174.18 1vgw s LEU 8 N 0.45 1.79 -0.30 0.00 2.96 0.56 -0.51 118.68 123.61 1vgw s LEU 8 Ca 0.51 -0.45 0.03 0.00 -0.22 0.00 0.00 54.13 54.00 1vgw s LEU 8 Cb -0.25 -1.13 0.08 0.00 0.50 0.00 0.00 46.19 45.40 1vgw s LEU 8 CO 0.30 0.04 0.00 -0.63 -1.32 0.00 0.00 176.35 174.74 1vgw s ILE 9 N 0.89 1.94 -0.20 6.68 1.01 -0.39 -0.78 121.20 130.35 1vgw s ILE 9 Ca -0.08 -1.86 -0.29 0.00 0.00 0.00 0.00 60.65 58.41 1vgw s ILE 9 Cb -0.15 -2.31 0.00 0.00 0.01 0.00 0.00 42.46 40.02 1vgw s ILE 9 CO -0.00 -0.39 1.05 -2.16 0.00 0.00 0.00 174.94 173.44 1vgw s PRO 10 N 1.13 4.29 -0.40 2.79 0.04 -1.26 -1.45 135.00 140.14 1vgw s PRO 10 Ca 0.03 1.39 0.10 0.00 0.04 0.00 0.00 61.00 62.56 1vgw s PRO 10 Cb -0.19 -3.63 0.34 0.00 0.04 0.00 0.00 34.50 31.06 1vgw s PRO 10 CO -0.09 -0.57 0.83 0.00 0.04 0.00 0.00 177.00 177.20 1vgw n ALA 11 N 6.08 1.25 -2.36 8.56 0.00 0.14 -4.46 120.51 129.71 1vgw n ALA 11 Ca 0.12 -2.87 -0.21 0.00 0.00 0.00 0.00 53.44 50.47 1vgw n ALA 11 Cb 0.46 -0.99 -0.04 0.00 0.00 0.00 0.00 19.45 18.89 1vgw n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vgw s ALA 12 N -1.66 3.91 0.00 0.00 0.00 -1.21 -4.31 121.76 118.49 1vgw s ALA 12 Ca 0.35 -1.80 0.00 0.00 0.00 0.00 0.00 51.96 50.51 1vgw s ALA 12 Cb 0.33 -1.02 0.00 0.00 0.00 0.00 0.00 23.12 22.42 1vgw s ALA 12 CO -0.07 -0.11 0.00 0.41 0.00 0.00 0.00 175.76 175.99 1vgw n GLY 13 N -1.43 0.81 4.16 0.00 0.00 -1.26 -4.84 105.19 102.62 1vgw n GLY 13 Ca 0.01 -1.10 -0.36 0.00 0.00 0.00 0.00 46.02 44.56 1vgw n GLY 13 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1vgw n PRO 23 N 0.00 -0.97 -1.32 1.61 -0.02 -1.26 -4.95 135.00 128.09 1vgw n PRO 23 Ca 0.00 0.14 -0.47 0.00 -2.02 0.00 0.00 63.50 61.15 1vgw n PRO 23 Cb 0.00 -3.33 -0.04 0.00 -0.02 0.00 0.00 33.50 30.11 1vgw n PRO 23 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1vgw n LYS 24 N -4.72 0.00 -0.11 -0.52 4.01 -1.26 -4.87 118.16 110.68 1vgw n LYS 24 Ca -0.24 0.00 0.12 0.00 -0.51 0.00 0.00 58.31 57.68 1vgw n LYS 24 Cb 0.64 -1.04 0.19 0.00 -0.51 0.00 0.00 35.03 34.31 1vgw n LYS 24 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1vgw n GLN 25 N 1.04 2.40 0.00 1.97 0.00 -1.26 -3.89 117.38 117.64 1vgw n GLN 25 Ca 0.17 -2.09 0.13 0.00 0.00 0.00 0.00 57.00 55.21 1vgw n GLN 25 Cb 0.19 -1.49 0.25 0.00 0.00 0.00 0.00 30.24 29.19 1vgw n GLN 25 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1vgw n TYR 26 N 1.37 0.00 -1.68 2.61 0.53 -1.26 -1.17 117.16 117.57 1vgw n TYR 26 Ca 0.17 0.00 -0.48 0.00 -1.02 0.00 0.00 57.90 56.58 1vgw n TYR 26 Cb 0.59 -0.02 -0.05 0.00 -1.03 0.00 0.00 39.34 38.84 1vgw n TYR 26 CO 0.00 0.00 0.00 1.33 -1.02 0.00 0.00 176.86 177.17 1vgw n VAL 27 N 0.41 0.36 -2.33 -0.72 0.24 -1.25 -4.63 118.33 110.41 1vgw n VAL 27 Ca 0.14 -0.07 -0.43 0.00 -2.04 0.00 0.00 64.34 61.95 1vgw n VAL 27 Cb 0.46 -1.74 -0.02 0.00 -1.47 0.00 0.00 33.84 31.07 1vgw n VAL 27 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1vgw s GLU 28 N 2.89 4.23 -0.22 7.34 0.41 -1.26 -2.83 118.70 129.26 1vgw s GLU 28 Ca 0.88 1.79 -0.02 0.00 -0.41 0.00 0.00 54.97 57.20 1vgw s GLU 28 Cb -0.69 -3.79 0.07 0.00 -1.78 0.00 0.00 34.13 27.94 1vgw s GLU 28 CO 0.47 -0.71 0.05 0.42 -0.49 0.00 0.00 175.26 174.99 1vgw s ILE 29 N 3.46 0.59 0.00 -1.63 1.01 -1.00 -5.02 121.20 118.61 1vgw s ILE 29 Ca 0.59 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 60.49 1vgw s ILE 29 Cb -0.25 -1.17 0.00 0.00 0.01 0.00 0.00 42.46 41.05 1vgw s ILE 29 CO 0.19 -0.32 0.00 0.61 0.00 0.00 0.00 174.94 175.41 1vgw n GLY 30 N 5.01 0.34 0.05 6.18 0.00 -1.26 -3.47 105.19 112.04 1vgw n GLY 30 Ca -0.08 -0.81 0.11 0.00 0.00 0.00 0.00 46.02 45.24 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 5.75 0.34 -4.67 1.61 3.41 -1.26 -4.98 113.62 113.82 1vgw n SER 31 Ca 0.00 0.13 -0.24 0.00 -0.26 0.00 0.00 58.87 58.50 1vgw n SER 31 Cb 0.00 1.36 -0.08 0.00 -0.26 0.00 0.00 64.21 65.23 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 -3.44 2.16 0.77 4.33 3.01 -1.23 -5.07 119.74 120.28 1vgw s LYS 32 Ca -0.05 -1.74 -0.11 0.00 -1.01 0.00 0.00 55.97 53.06 1vgw s LYS 32 Cb 0.12 -1.98 0.05 0.00 -1.01 0.00 0.00 37.83 35.01 1vgw s LYS 32 CO 0.86 0.08 1.08 0.95 0.51 0.00 0.00 175.35 178.83 1vgw s THR 33 N -2.52 3.39 0.15 2.17 -4.23 -1.26 -2.37 115.64 110.97 1vgw s THR 33 Ca 0.37 0.45 -0.21 0.00 -1.18 0.00 0.00 61.69 61.12 1vgw s THR 33 Cb 0.01 -3.17 0.03 0.00 1.34 0.00 0.00 72.50 70.71 1vgw s THR 33 CO 0.21 -0.59 1.65 0.58 -0.54 0.00 0.00 174.62 175.93 1vgw h VAL 34 N -0.99 0.52 -0.50 2.29 2.07 -1.20 -0.96 116.25 117.48 1vgw h VAL 34 Ca -0.46 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.14 1vgw h VAL 34 Cb 1.25 0.52 -0.06 0.00 -1.52 0.00 0.00 31.29 31.47 1vgw h VAL 34 CO 0.58 0.00 0.14 0.25 0.02 0.00 0.00 177.57 178.56 1vgw h LEU 35 N -0.16 0.10 -1.42 2.57 5.85 -1.36 0.14 115.31 121.03 1vgw h LEU 35 Ca 0.14 0.08 -0.06 0.00 0.84 0.00 0.00 57.88 58.88 1vgw h LEU 35 Cb 0.37 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1vgw h LEU 35 CO -0.35 0.08 -0.29 -0.33 -0.34 0.00 0.00 178.44 177.21 1vgw h GLU 36 N 0.30 0.00 -0.36 1.25 5.08 -1.74 -1.45 114.58 117.65 1vgw h GLU 36 Ca 0.25 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.54 1vgw h GLU 36 Cb 0.30 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1vgw h GLU 36 CO -0.29 0.29 -0.04 0.45 -1.00 0.00 0.00 179.01 178.42 1vgw h HIS 37 N 0.00 0.74 -0.14 4.33 3.86 0.60 -2.94 115.15 121.59 1vgw h HIS 37 Ca -0.00 -0.14 -0.00 0.00 -1.16 0.00 0.00 60.37 59.06 1vgw h HIS 37 Cb 0.57 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 28.85 1vgw h HIS 37 CO 0.00 0.79 0.07 0.28 0.86 0.00 0.00 177.93 179.94 1vgw h VAL 38 N 0.47 1.10 -0.27 2.45 2.07 -0.54 -2.86 116.25 118.66 1vgw h VAL 38 Ca 0.10 -0.29 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 1vgw h VAL 38 Cb 0.53 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1vgw h VAL 38 CO 0.03 0.09 0.15 -0.07 0.02 0.00 0.00 177.57 177.79 1vgw h LEU 39 N 0.12 0.32 -1.49 2.57 3.38 -1.36 -1.20 115.31 117.66 1vgw h LEU 39 Ca 0.05 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1vgw h LEU 39 Cb 0.09 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1vgw h LEU 39 CO -0.01 0.26 0.18 1.23 0.09 0.00 0.00 178.44 180.19 1vgw h GLY 40 N 0.44 0.56 1.05 0.83 0.00 -1.31 0.03 103.07 104.66 1vgw h GLY 40 Ca 0.10 -0.24 -0.08 0.00 0.00 0.00 0.00 47.33 47.10 1vgw h GLY 40 CO -0.02 0.24 0.05 -2.22 0.00 0.00 0.00 176.54 174.59 1vgw h ILE 41 N 0.53 1.26 0.22 2.60 2.04 -1.20 -2.62 117.51 120.34 1vgw h ILE 41 Ca 0.13 -1.07 -0.31 0.00 1.00 0.00 0.00 64.86 64.61 1vgw h ILE 41 Cb 0.07 0.78 0.04 0.00 -0.74 0.00 0.00 36.82 36.96 1vgw h ILE 41 CO -0.02 0.39 -1.34 -0.26 0.00 0.00 0.00 178.15 176.93 1vgw h PHE 42 N 0.93 0.93 -0.06 1.37 0.04 -1.40 -3.23 116.94 115.51 1vgw h PHE 42 Ca 0.18 -0.66 -0.02 0.00 2.80 0.00 0.00 57.97 60.26 1vgw h PHE 42 Cb 0.49 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.59 1vgw h PHE 42 CO 0.04 1.51 -0.07 0.93 -0.60 0.00 0.00 178.31 180.12 1vgw h GLU 43 N 0.09 0.08 -0.08 1.51 4.39 -1.08 -2.34 114.58 117.15 1vgw h GLU 43 Ca -0.23 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.46 1vgw h GLU 43 Cb 2.04 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.68 1vgw h GLU 43 CO 0.25 0.16 0.00 2.89 -1.16 0.00 0.00 179.01 181.15 1vgw n ARG 44 N -4.41 1.86 -3.31 2.33 1.85 -0.99 -4.81 116.66 109.19 1vgw n ARG 44 Ca -0.02 -1.27 -0.39 0.00 -1.00 0.00 0.00 57.85 55.17 1vgw n ARG 44 Cb 0.17 -1.46 -0.08 0.00 -1.05 0.00 0.00 32.46 30.05 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 -1.91 3.32 0.31 2.89 2.46 -0.88 -4.98 115.29 116.49 1vgw s HIS 45 Ca 0.35 0.63 0.00 0.00 0.47 0.00 0.00 55.06 56.51 1vgw s HIS 45 Cb 0.20 -2.63 0.53 0.00 -0.13 0.00 0.00 32.58 30.55 1vgw s HIS 45 CO 0.31 -0.15 1.96 0.93 -2.47 0.00 0.00 174.74 175.32 1vgw h GLU 46 N 7.73 0.99 -0.00 2.88 5.08 -1.87 -2.68 114.58 126.71 1vgw h GLU 46 Ca -0.32 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 1vgw h GLU 46 Cb 1.15 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1vgw h GLU 46 CO 0.71 0.65 -0.01 0.00 -1.00 0.00 0.00 179.01 179.37 1vgw n ALA 47 N -2.42 2.55 -2.62 3.43 0.00 -1.26 -4.71 120.51 115.48 1vgw n ALA 47 Ca 0.10 -0.16 -0.38 0.00 0.00 0.00 0.00 53.44 52.99 1vgw n ALA 47 Cb 0.09 -1.49 -0.06 0.00 0.00 0.00 0.00 19.45 18.00 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 -2.44 5.06 -0.09 0.00 1.01 -1.01 -4.33 120.40 118.60 1vgw s VAL 48 Ca 0.33 1.11 0.20 0.00 0.00 0.00 0.00 61.98 63.62 1vgw s VAL 48 Cb 0.21 -3.88 -0.30 0.00 0.00 0.00 0.00 36.38 32.41 1vgw s VAL 48 CO 0.44 0.37 0.32 0.47 0.00 0.00 0.00 175.10 176.70 1vgw n ASP 49 N 3.21 0.10 -3.48 3.32 8.00 0.74 -4.94 116.55 123.49 1vgw n ASP 49 Ca -0.07 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.29 1vgw n ASP 49 Cb 0.51 1.61 -0.04 0.00 -0.02 0.00 0.00 41.12 43.18 1vgw n ASP 49 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1vgw s LEU 50 N -4.85 -0.52 -0.05 0.64 2.96 -1.22 -5.03 118.68 110.61 1vgw s LEU 50 Ca -0.09 0.30 0.02 0.00 -0.22 0.00 0.00 54.13 54.14 1vgw s LEU 50 Cb 0.11 2.50 0.02 0.00 0.50 0.00 0.00 46.19 49.32 1vgw s LEU 50 CO 0.86 -0.79 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.13 1vgw s THR 51 N -2.57 0.79 -0.02 3.68 2.01 -1.26 -1.54 115.64 116.73 1vgw s THR 51 Ca -0.05 -0.29 0.05 0.00 0.31 0.00 0.00 61.69 61.71 1vgw s THR 51 Cb -0.01 -0.76 -0.01 0.00 0.01 0.00 0.00 72.50 71.74 1vgw s THR 51 CO -0.02 0.28 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.33 1vgw s VAL 52 N 0.72 1.33 -0.06 3.82 1.01 0.33 -1.82 120.40 125.73 1vgw s VAL 52 Ca -0.12 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.22 1vgw s VAL 52 Cb -0.14 -1.13 -0.01 0.00 0.00 0.00 0.00 36.38 35.10 1vgw s VAL 52 CO 0.02 0.38 -0.24 -0.69 0.00 0.00 0.00 175.10 174.57 1vgw s VAL 53 N -0.21 1.94 -0.23 2.92 1.01 -0.65 -1.26 120.40 123.93 1vgw s VAL 53 Ca 0.02 -1.00 -0.03 0.00 0.00 0.00 0.00 61.98 60.97 1vgw s VAL 53 Cb -0.08 -1.65 -0.00 0.00 0.00 0.00 0.00 36.38 34.65 1vgw s VAL 53 CO 0.00 0.54 -0.05 -0.69 0.00 0.00 0.00 175.10 174.91 1vgw s VAL 54 N -0.10 3.25 0.24 2.92 1.01 -0.53 -1.32 120.40 125.87 1vgw s VAL 54 Ca -0.04 -0.61 0.11 0.00 0.00 0.00 0.00 61.98 61.43 1vgw s VAL 54 Cb -0.14 -2.51 -0.05 0.00 0.00 0.00 0.00 36.38 33.69 1vgw s VAL 54 CO 0.04 0.38 -0.17 0.68 0.00 0.00 0.00 175.10 176.02 1vgw s VAL 55 N 1.45 2.68 0.87 2.92 -7.23 -0.08 -0.69 120.40 120.33 1vgw s VAL 55 Ca 0.05 -2.14 -0.11 0.00 -1.81 0.00 0.00 61.98 57.97 1vgw s VAL 55 Cb -0.15 -2.37 0.12 0.00 0.56 0.00 0.00 36.38 34.54 1vgw s VAL 55 CO -0.04 -0.28 1.10 -0.94 -0.31 0.00 0.00 175.10 174.63 1vgw s SER 56 N -3.22 3.50 0.00 4.85 1.04 -1.26 -2.99 113.70 115.62 1vgw s SER 56 Ca 0.27 1.85 0.19 0.00 0.48 0.00 0.00 55.95 58.74 1vgw s SER 56 Cb -0.06 -2.45 0.91 0.00 0.10 0.00 0.00 66.02 64.52 1vgw s SER 56 CO 0.14 -2.68 1.59 -0.81 0.98 0.00 0.00 173.24 172.46 1vgw n PRO 57 N -3.94 0.20 0.02 4.02 -0.04 -1.26 -2.44 135.00 131.56 1vgw n PRO 57 Ca 0.09 0.13 0.11 0.00 -0.04 0.00 0.00 63.50 63.79 1vgw n PRO 57 Cb 0.53 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.37 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 -1.34 0.63 -1.57 0.54 4.71 -1.26 -4.94 120.64 117.41 1vgw n GLU 58 Ca 0.08 -0.11 -0.48 0.00 -0.01 0.00 0.00 57.16 56.63 1vgw n GLU 58 Cb 0.17 -1.60 -0.05 0.00 -1.01 0.00 0.00 31.44 28.95 1vgw n GLU 58 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 1vgw n ASP 59 N -2.35 2.86 0.03 1.62 4.64 -1.02 -4.86 116.55 117.46 1vgw n ASP 59 Ca -0.03 0.59 -0.21 0.00 -1.38 0.00 0.00 54.79 53.75 1vgw n ASP 59 Cb 0.56 -1.36 -0.14 0.00 -1.04 0.00 0.00 41.12 39.14 1vgw n ASP 59 CO 0.00 0.00 0.00 0.74 -0.82 0.00 0.00 177.20 177.12 1vgw h THR 60 N 6.47 1.11 0.00 5.18 2.02 -1.92 -3.37 112.91 122.40 1vgw h THR 60 Ca -0.39 -2.45 -0.03 0.00 0.77 0.00 0.00 66.41 64.32 1vgw h THR 60 Cb 1.29 2.81 -0.00 0.00 -1.74 0.00 0.00 68.15 70.50 1vgw h THR 60 CO 0.98 0.73 -0.13 0.15 0.37 0.00 0.00 175.52 177.62 1vgw h PHE 61 N -0.26 0.00 -0.96 3.16 3.57 -2.01 -3.00 116.94 117.44 1vgw h PHE 61 Ca -0.28 0.00 0.19 0.00 3.53 0.00 0.00 57.97 61.41 1vgw h PHE 61 Cb 1.79 0.00 -0.09 0.00 2.79 0.00 0.00 35.95 40.45 1vgw h PHE 61 CO 0.13 0.13 0.61 0.00 -2.23 0.00 0.00 178.31 176.95 1vgw h ALA 62 N 1.87 1.89 -0.97 2.41 0.00 -1.98 -1.04 119.26 121.45 1vgw h ALA 62 Ca -0.00 0.05 0.16 0.00 0.00 0.00 0.00 54.91 55.12 1vgw h ALA 62 Cb 0.37 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 17.99 1vgw h ALA 62 CO 0.02 -0.22 0.58 -0.44 0.00 0.00 0.00 179.25 179.19 1vgw h ASP 63 N 0.63 0.76 0.59 0.00 5.19 -1.78 -0.89 116.42 120.93 1vgw h ASP 63 Ca 0.53 0.08 -0.17 0.00 -0.62 0.00 0.00 57.03 56.85 1vgw h ASP 63 Cb 0.98 -0.05 -0.02 0.00 0.18 0.00 0.00 39.33 40.42 1vgw h ASP 63 CO -0.28 0.32 -0.77 0.11 -3.12 0.00 0.00 179.24 175.50 1vgw h LYS 64 N 0.79 0.13 -0.17 3.56 1.57 -1.40 -3.20 116.57 117.85 1vgw h LYS 64 Ca 0.54 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 59.18 1vgw h LYS 64 Cb 0.75 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 1vgw h LYS 64 CO -0.35 0.83 0.06 0.28 -0.57 0.00 0.00 179.45 179.70 1vgw h VAL 65 N 0.08 1.18 -0.92 0.50 2.07 -1.13 -2.23 116.25 115.80 1vgw h VAL 65 Ca -0.02 -0.54 0.24 0.00 0.82 0.00 0.00 66.70 67.20 1vgw h VAL 65 Cb 1.34 1.22 -0.05 0.00 -1.52 0.00 0.00 31.29 32.28 1vgw h VAL 65 CO 0.11 0.17 0.64 -0.61 0.02 0.00 0.00 177.57 177.89 1vgw h GLN 66 N 0.11 0.19 -0.15 1.57 5.75 -1.42 -0.24 115.11 120.91 1vgw h GLN 66 Ca 0.06 -0.01 -0.18 0.00 -0.15 0.00 0.00 58.65 58.37 1vgw h GLN 66 Cb 0.21 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 28.71 1vgw h GLN 66 CO -0.00 0.13 -0.63 1.15 -2.65 0.00 0.00 178.83 176.82 1vgw h THR 67 N 0.19 1.33 0.00 2.39 2.02 -1.40 -3.08 112.91 114.37 1vgw h THR 67 Ca 0.47 -1.92 0.00 0.00 0.77 0.00 0.00 66.41 65.72 1vgw h THR 67 Cb 1.51 1.90 0.00 0.00 -1.74 0.00 0.00 68.15 69.81 1vgw h THR 67 CO -0.10 0.59 -0.34 0.00 0.37 0.00 0.00 175.52 176.04 1vgw n ALA 68 N -2.53 2.82 -3.47 6.16 0.00 -0.17 -4.21 120.51 119.11 1vgw n ALA 68 Ca -0.04 -0.19 -0.26 0.00 0.00 0.00 0.00 53.44 52.94 1vgw n ALA 68 Cb 0.66 -1.28 -0.09 0.00 0.00 0.00 0.00 19.45 18.73 1vgw n ALA 68 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1vgw n PHE 69 N -1.87 1.40 0.06 0.00 3.01 -0.80 -4.96 117.46 114.30 1vgw n PHE 69 Ca 0.05 -3.83 0.03 0.00 1.01 0.00 0.00 57.45 54.70 1vgw n PHE 69 Cb 0.39 -0.32 0.40 0.00 -0.01 0.00 0.00 39.48 39.94 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 4.78 0.40 0.00 -1.08 0.13 -1.71 -1.84 132.00 132.69 1vgw h PRO 70 Ca 0.17 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1vgw h PRO 70 Cb 0.80 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1vgw h PRO 70 CO 0.60 0.38 0.00 1.04 -0.23 0.00 0.00 178.00 179.79 1vgw n GLN 71 N -4.37 0.46 -3.34 0.86 6.02 -1.26 -4.81 117.38 110.93 1vgw n GLN 71 Ca 0.01 0.04 -0.38 0.00 -0.01 0.00 0.00 57.00 56.65 1vgw n GLN 71 Cb 0.17 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.87 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 -2.46 4.87 -0.45 5.09 1.01 -0.69 -4.69 120.40 123.08 1vgw s VAL 72 Ca 0.27 1.08 -0.22 0.00 0.00 0.00 0.00 61.98 63.12 1vgw s VAL 72 Cb 0.17 -3.84 0.03 0.00 0.00 0.00 0.00 36.38 32.74 1vgw s VAL 72 CO 0.37 0.54 0.70 -0.13 0.00 0.00 0.00 175.10 176.59 1vgw s ARG 73 N -0.93 3.31 -0.42 2.72 1.81 -0.76 -4.99 118.95 119.70 1vgw s ARG 73 Ca 0.27 -0.31 -0.20 0.00 -1.72 0.00 0.00 55.73 53.78 1vgw s ARG 73 Cb -0.18 -3.96 0.02 0.00 -0.45 0.00 0.00 34.95 30.38 1vgw s ARG 73 CO 0.17 -1.08 0.61 0.08 -0.68 0.00 0.00 175.30 174.39 1vgw s VAL 74 N 3.02 4.88 -0.02 3.52 1.01 -1.26 -1.63 120.40 129.91 1vgw s VAL 74 Ca 0.25 0.11 -0.00 0.00 0.00 0.00 0.00 61.98 62.34 1vgw s VAL 74 Cb -0.14 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 1vgw s VAL 74 CO 0.20 -0.52 0.04 0.26 0.00 0.00 0.00 175.10 175.08 1vgw s TRP 75 N 2.69 3.21 -0.74 5.22 0.51 -0.44 -5.00 118.94 124.40 1vgw s TRP 75 Ca 0.21 0.18 0.02 0.00 -2.12 0.00 0.00 56.10 54.39 1vgw s TRP 75 Cb -0.15 -1.73 0.35 0.00 -0.81 0.00 0.00 33.47 31.13 1vgw s TRP 75 CO 0.17 0.52 1.37 1.63 -0.51 0.00 0.00 176.95 180.13 1vgw n LYS 76 N 1.45 3.95 -2.78 4.98 5.02 -1.26 -0.90 118.16 128.62 1vgw n LYS 76 Ca -0.15 -4.62 -0.19 0.00 -2.02 0.00 0.00 58.31 51.33 1vgw n LYS 76 Cb 0.53 -2.32 -0.00 0.00 -0.02 0.00 0.00 35.03 33.22 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 -0.25 2.70 -4.87 4.39 6.94 -1.17 -4.20 115.26 118.80 1vgw n ASN 77 Ca 0.40 -3.21 -0.30 0.00 -0.02 0.00 0.00 54.58 51.44 1vgw n ASN 77 Cb 0.37 -0.54 0.05 0.00 -2.36 0.00 0.00 39.78 37.30 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 -3.14 1.63 0.00 4.83 0.00 -1.16 -4.77 107.32 104.71 1vgw s GLY 78 Ca 0.39 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.81 1vgw s GLY 78 CO -0.08 0.06 0.00 0.61 0.00 0.00 0.00 173.10 173.70 1vgw n GLY 79 N -2.87 3.35 0.12 0.20 0.00 -1.26 -4.84 105.19 99.89 1vgw n GLY 79 Ca 0.07 -2.17 -0.01 0.00 0.00 0.00 0.00 46.02 43.92 1vgw n GLY 79 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1vgw h GLN 80 N 0.00 0.00 -5.91 1.61 4.20 -1.98 -3.44 115.11 109.59 1vgw h GLN 80 Ca 0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 1vgw h GLN 80 Cb 0.00 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 27.64 1vgw h GLN 80 CO 0.00 0.66 -0.71 0.95 -0.67 0.00 0.00 178.83 179.06 1vgw s THR 81 N -3.14 2.16 0.44 -0.54 -4.23 -1.26 -5.01 115.64 104.06 1vgw s THR 81 Ca 0.01 -2.26 0.11 0.00 -1.18 0.00 0.00 61.69 58.36 1vgw s THR 81 Cb 0.10 -2.41 0.23 0.00 1.34 0.00 0.00 72.50 71.76 1vgw s THR 81 CO 0.76 -0.34 2.04 -0.09 -0.54 0.00 0.00 174.62 176.45 1vgw h ARG 82 N 2.22 0.28 -0.20 3.99 2.43 -1.96 -1.34 114.38 119.81 1vgw h ARG 82 Ca -0.40 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 58.59 1vgw h ARG 82 Cb 1.25 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 1vgw h ARG 82 CO 0.65 0.26 -0.47 0.00 -1.51 0.00 0.00 179.97 178.90 1vgw h ALA 83 N 1.79 0.82 -0.32 2.80 0.00 -1.96 -1.71 119.26 120.68 1vgw h ALA 83 Ca 0.07 -0.47 -0.16 0.00 0.00 0.00 0.00 54.91 54.35 1vgw h ALA 83 Cb 0.10 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1vgw h ALA 83 CO -0.00 0.66 -0.44 1.49 0.00 0.00 0.00 179.25 180.96 1vgw h GLU 84 N 0.41 0.86 -0.33 0.00 4.81 -1.64 -2.32 114.58 116.38 1vgw h GLU 84 Ca 0.02 -0.50 -0.12 0.00 -0.13 0.00 0.00 59.36 58.63 1vgw h GLU 84 Cb 0.98 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 1vgw h GLU 84 CO 0.09 1.14 -0.30 1.79 -0.73 0.00 0.00 179.01 180.99 1vgw h THR 85 N 0.65 1.28 -0.70 0.32 1.35 -1.40 0.36 112.91 114.76 1vgw h THR 85 Ca 0.04 -1.43 -0.06 0.00 -0.55 0.00 0.00 66.41 64.41 1vgw h THR 85 Cb 1.04 1.35 -0.03 0.00 -1.73 0.00 0.00 68.15 68.78 1vgw h THR 85 CO 0.10 0.46 0.20 0.58 -0.25 0.00 0.00 175.52 176.61 1vgw h VAL 86 N 0.59 1.26 -0.27 6.82 2.07 -1.30 -1.95 116.25 123.45 1vgw h VAL 86 Ca 0.07 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 1vgw h VAL 86 Cb 0.81 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1vgw h VAL 86 CO 0.07 0.36 0.12 -0.09 0.02 0.00 0.00 177.57 178.05 1vgw h ARG 87 N 1.05 0.40 -0.05 1.57 2.43 -1.03 -2.12 114.38 116.63 1vgw h ARG 87 Ca 0.22 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.25 1vgw h ARG 87 Cb 0.33 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 1vgw h ARG 87 CO -0.00 0.40 -0.33 -0.91 -1.51 0.00 0.00 179.97 177.62 1vgw h ASN 88 N 0.30 0.10 -0.22 -3.80 2.35 -0.72 -2.24 115.58 111.35 1vgw h ASN 88 Ca 0.09 -0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 55.71 1vgw h ASN 88 Cb 0.15 -0.03 -0.00 0.00 0.05 0.00 0.00 38.32 38.49 1vgw h ASN 88 CO -0.01 0.43 -0.24 1.23 -1.65 0.00 0.00 177.43 177.19 1vgw h GLY 89 N 1.05 0.60 0.85 2.83 0.00 -1.01 -1.44 103.07 105.94 1vgw h GLY 89 Ca 0.01 -0.63 -0.04 0.00 0.00 0.00 0.00 47.33 46.68 1vgw h GLY 89 CO 0.05 0.56 0.01 -2.08 0.00 0.00 0.00 176.54 175.08 1vgw h VAL 90 N 0.23 1.25 -0.48 4.60 2.07 -1.27 -1.28 116.25 121.37 1vgw h VAL 90 Ca 0.03 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.67 1vgw h VAL 90 Cb 0.80 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 1vgw h VAL 90 CO 0.06 0.27 0.28 0.00 0.02 0.00 0.00 177.57 178.21 1vgw h ALA 91 N 0.82 0.61 -0.08 1.67 0.00 -1.47 -1.62 119.26 119.19 1vgw h ALA 91 Ca 0.07 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1vgw h ALA 91 Cb 0.39 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1vgw h ALA 91 CO 0.01 0.11 -0.35 -0.22 0.00 0.00 0.00 179.25 178.81 1vgw h LYS 92 N 0.64 0.16 -0.60 0.00 3.64 -1.20 0.39 116.57 119.60 1vgw h LYS 92 Ca 0.17 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 1vgw h LYS 92 Cb 0.01 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 1vgw h LYS 92 CO -0.03 0.49 0.26 -0.07 -2.27 0.00 0.00 179.45 177.84 1vgw h LEU 93 N 0.14 0.78 0.04 5.20 3.38 -0.30 -1.45 115.31 123.11 1vgw h LEU 93 Ca 0.02 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1vgw h LEU 93 Cb 0.68 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1vgw h LEU 93 CO 0.05 0.69 -0.02 -0.07 0.09 0.00 0.00 178.44 179.18 1vgw h LEU 94 N 0.86 -0.05 -2.17 1.67 -0.00 -0.73 -2.35 115.31 112.54 1vgw h LEU 94 Ca 0.21 -0.60 0.06 0.00 -0.00 0.00 0.00 57.88 57.55 1vgw h LEU 94 Cb 0.13 0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 40.80 1vgw h LEU 94 CO -0.02 0.70 0.21 -0.08 -0.00 0.00 0.00 178.44 179.25 1vgw h GLU 95 N -0.92 0.00 0.00 1.13 4.22 -0.22 -1.50 114.58 117.28 1vgw h GLU 95 Ca -0.01 0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.39 1vgw h GLU 95 Cb 0.65 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 1vgw h GLU 95 CO 0.01 0.00 -0.69 1.15 -2.18 0.00 0.00 179.01 177.30 1vgw h THR 96 N 0.00 0.21 0.00 0.32 2.02 -1.35 -3.48 112.91 110.63 1vgw h THR 96 Ca 0.10 -1.35 0.00 0.00 0.77 0.00 0.00 66.41 65.94 1vgw h THR 96 Cb 0.52 1.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 1vgw h THR 96 CO -0.00 0.12 0.00 0.61 0.37 0.00 0.00 175.52 176.62 1vgw n GLY 97 N 1.20 1.40 0.21 2.16 0.00 -0.57 -4.90 105.19 104.69 1vgw n GLY 97 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 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 0.05 -8.72 0.99 3.38 -1.78 -3.42 115.31 105.81 1vgw h LEU 98 Ca 0.00 -0.01 -0.70 0.00 0.09 0.00 0.00 57.88 57.26 1vgw h LEU 98 Cb 0.00 -0.01 -0.27 0.00 0.09 0.00 0.00 40.66 40.46 1vgw h LEU 98 CO 0.00 0.33 -0.87 0.00 0.09 0.00 0.00 178.44 177.99 1vgw s ALA 99 N -4.40 2.26 0.33 1.53 0.00 -0.90 -5.06 121.76 115.52 1vgw s ALA 99 Ca -0.04 -1.20 0.06 0.00 0.00 0.00 0.00 51.96 50.79 1vgw s ALA 99 Cb 0.15 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 1vgw s ALA 99 CO 0.72 0.54 0.47 0.00 0.00 0.00 0.00 175.76 177.48 1vgw s ALA 100 N -0.74 4.15 0.32 0.00 0.00 -1.26 -4.48 121.76 119.75 1vgw s ALA 100 Ca 0.11 -1.38 0.10 0.00 0.00 0.00 0.00 51.96 50.79 1vgw s ALA 100 Cb -0.10 -1.73 0.93 0.00 0.00 0.00 0.00 23.12 22.22 1vgw s ALA 100 CO 0.01 -0.01 1.69 0.93 0.00 0.00 0.00 175.76 178.38 1vgw h GLU 101 N 0.90 0.40 -0.11 0.00 4.39 -1.98 0.72 114.58 118.91 1vgw h GLU 101 Ca -0.47 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.21 1vgw h GLU 101 Cb 1.25 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 1vgw h GLU 101 CO 0.55 0.27 0.00 0.25 -1.16 0.00 0.00 179.01 178.91 1vgw n THR 102 N -5.01 0.12 -2.61 1.13 -2.24 -1.26 -0.96 114.28 103.45 1vgw n THR 102 Ca 0.28 -0.36 -0.34 0.00 -2.27 0.00 0.00 64.05 61.35 1vgw n THR 102 Cb 0.82 0.61 -0.04 0.00 -2.10 0.00 0.00 70.33 69.62 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 -1.79 6.57 0.06 3.42 1.01 0.24 -4.80 116.67 121.38 1vgw s ASP 103 Ca 0.35 1.89 -0.27 0.00 0.71 0.00 0.00 52.55 55.23 1vgw s ASP 103 Cb 0.20 -2.56 -0.05 0.00 1.01 0.00 0.00 42.92 41.51 1vgw s ASP 103 CO 0.30 -0.62 0.86 0.20 0.21 0.00 0.00 175.17 176.13 1vgw s ASN 104 N -1.94 7.33 -0.20 0.27 0.01 -0.24 -0.99 114.94 119.18 1vgw s ASN 104 Ca 0.64 1.59 -0.02 0.00 -0.71 0.00 0.00 52.86 54.36 1vgw s ASN 104 Cb -0.16 -2.52 0.00 0.00 0.41 0.00 0.00 41.25 38.98 1vgw s ASN 104 CO 0.20 -0.05 -0.10 -0.63 -1.51 0.00 0.00 177.10 175.00 1vgw s ILE 105 N 0.12 2.91 -0.74 0.60 1.01 0.49 -1.75 121.20 123.84 1vgw s ILE 105 Ca 0.43 -0.66 -0.12 0.00 0.00 0.00 0.00 60.65 60.31 1vgw s ILE 105 Cb -0.21 -2.29 0.19 0.00 0.01 0.00 0.00 42.46 40.16 1vgw s ILE 105 CO 0.26 0.47 0.66 -0.76 0.00 0.00 0.00 174.94 175.57 1vgw s LEU 106 N 1.29 6.35 -0.31 2.97 1.02 -0.65 -1.66 118.68 127.69 1vgw s LEU 106 Ca 0.03 -2.60 -0.29 0.00 0.02 0.00 0.00 54.13 51.29 1vgw s LEU 106 Cb -0.14 -2.13 0.01 0.00 0.02 0.00 0.00 46.19 43.95 1vgw s LEU 106 CO -0.05 -0.56 1.18 -0.69 0.02 0.00 0.00 176.35 176.24 1vgw s VAL 107 N 0.31 4.33 0.01 -1.59 1.01 -1.03 -0.33 120.40 123.11 1vgw s VAL 107 Ca 0.16 1.52 0.06 0.00 0.00 0.00 0.00 61.98 63.72 1vgw s VAL 107 Cb -0.15 -4.30 -0.02 0.00 0.00 0.00 0.00 36.38 31.92 1vgw s VAL 107 CO -0.06 -0.48 -0.19 -2.28 0.00 0.00 0.00 175.10 172.08 1vgw s HIS 108 N 3.97 1.67 0.26 5.22 5.04 0.04 -0.84 115.29 130.65 1vgw s HIS 108 Ca 0.50 -0.34 -0.30 0.00 -1.54 0.00 0.00 55.06 53.39 1vgw s HIS 108 Cb -0.14 -1.04 -0.10 0.00 0.04 0.00 0.00 32.58 31.34 1vgw s HIS 108 CO 0.19 0.02 1.49 -0.51 -2.34 0.00 0.00 174.74 173.59 1vgw s ASP 109 N -0.75 6.58 0.52 9.88 -0.00 -1.26 -4.16 116.67 127.48 1vgw s ASP 109 Ca 0.07 2.74 0.31 0.00 -0.00 0.00 0.00 52.55 55.67 1vgw s ASP 109 Cb -0.08 -2.62 1.26 0.00 -0.00 0.00 0.00 42.92 41.48 1vgw s ASP 109 CO 0.00 -0.76 1.95 0.00 -0.00 0.00 0.00 175.17 176.36 1vgw h ALA 110 N 5.08 1.02 -0.40 5.23 0.00 -1.95 -2.94 119.26 125.30 1vgw h ALA 110 Ca -0.46 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1vgw h ALA 110 Cb 1.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1vgw h ALA 110 CO 0.79 0.07 0.00 0.00 0.00 0.00 0.00 179.25 180.11 1vgw n ALA 111 N -2.13 2.44 -2.86 0.00 0.00 -1.26 -4.33 120.51 112.37 1vgw n ALA 111 Ca 0.00 -0.76 -0.41 0.00 0.00 0.00 0.00 53.44 52.28 1vgw n ALA 111 Cb 0.33 -0.98 0.01 0.00 0.00 0.00 0.00 19.45 18.81 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 0.78 4.79 0.00 0.00 1.74 -1.11 -1.45 116.66 121.41 1vgw n ARG 112 Ca 0.16 -4.62 0.01 0.00 -0.77 0.00 0.00 57.85 52.62 1vgw n ARG 112 Cb 0.39 -2.47 0.03 0.00 -1.02 0.00 0.00 32.46 29.39 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 -0.55 2.10 -4.77 0.00 7.94 -1.23 -4.44 117.00 116.04 1vgw n LEU 115 Ca 0.02 1.09 -0.40 0.00 -1.11 0.00 0.00 56.01 55.62 1vgw n LEU 115 Cb 0.34 -1.13 -0.02 0.00 0.53 0.00 0.00 43.42 43.15 1vgw n LEU 115 CO 0.00 -0.62 0.93 -2.84 -1.11 0.00 0.00 177.39 173.75 1vgw s PRO 116 N 2.81 4.28 0.49 1.96 0.02 -1.26 -4.93 135.00 138.36 1vgw s PRO 116 Ca 0.96 2.09 0.16 0.00 0.02 0.00 0.00 61.00 64.23 1vgw s PRO 116 Cb -1.08 -2.97 1.19 0.00 0.02 0.00 0.00 34.50 31.66 1vgw s PRO 116 CO 0.63 -0.21 2.08 1.03 -0.33 0.00 0.00 177.00 180.20 1vgw h SER 117 N 3.20 0.13 0.98 2.53 0.87 -1.96 0.35 113.55 119.65 1vgw h SER 117 Ca -0.49 -0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 59.98 1vgw h SER 117 Cb 1.23 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.15 1vgw h SER 117 CO 0.65 0.09 -0.42 -0.08 -0.53 0.00 0.00 176.83 176.53 1vgw h GLU 118 N 0.15 0.00 -0.12 2.24 4.81 -2.00 -2.63 114.58 117.04 1vgw h GLU 118 Ca 0.12 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.12 1vgw h GLU 118 Cb 0.28 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.67 1vgw h GLU 118 CO -0.02 0.42 -0.81 0.00 -0.73 0.00 0.00 179.01 177.87 1vgw h ALA 119 N 1.58 0.26 -1.01 2.92 0.00 -0.68 -2.65 119.26 119.67 1vgw h ALA 119 Ca -0.00 -0.61 0.02 0.00 0.00 0.00 0.00 54.91 54.31 1vgw h ALA 119 Cb 1.03 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.77 1vgw h ALA 119 CO 0.06 0.66 0.67 1.25 0.00 0.00 0.00 179.25 181.88 1vgw h LEU 120 N 0.48 1.14 0.14 0.00 5.85 -1.36 -2.38 115.31 119.18 1vgw h LEU 120 Ca -0.07 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1vgw h LEU 120 Cb 1.45 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1vgw h LEU 120 CO 0.17 0.80 -0.07 0.00 -0.34 0.00 0.00 178.44 179.00 1vgw h ALA 121 N 1.39 -0.19 -0.68 1.25 0.00 -1.40 -1.99 119.26 117.63 1vgw h ALA 121 Ca 0.38 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.30 1vgw h ALA 121 Cb -0.10 0.07 -0.11 0.00 0.00 0.00 0.00 17.79 17.66 1vgw h ALA 121 CO -0.10 -0.49 0.07 0.00 0.00 0.00 0.00 179.25 178.73 1vgw h ARG 122 N -0.44 0.17 0.15 0.00 3.08 -1.32 0.73 114.38 116.75 1vgw h ARG 122 Ca -0.02 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1vgw h ARG 122 Cb 0.35 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 1vgw h ARG 122 CO 0.03 0.11 -0.08 1.25 -1.07 0.00 0.00 179.97 180.21 1vgw h LEU 123 N 0.17 -0.19 -0.67 3.04 5.85 -1.28 0.31 115.31 122.54 1vgw h LEU 123 Ca 0.37 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 59.04 1vgw h LEU 123 Cb 0.62 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.68 1vgw h LEU 123 CO -0.54 -0.13 0.19 0.40 -0.34 0.00 0.00 178.44 178.01 1vgw h ILE 124 N -0.21 1.26 -0.19 4.05 2.04 -0.57 0.12 117.51 124.01 1vgw h ILE 124 Ca -0.02 -0.91 -0.03 0.00 1.00 0.00 0.00 64.86 64.91 1vgw h ILE 124 Cb 0.17 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 1vgw h ILE 124 CO 0.02 0.35 0.02 -0.08 0.00 0.00 0.00 178.15 178.46 1vgw h GLU 125 N 0.98 0.32 0.00 2.37 4.57 0.58 -1.86 114.58 121.55 1vgw h GLU 125 Ca 0.21 -0.10 -0.08 0.00 -1.18 0.00 0.00 59.36 58.21 1vgw h GLU 125 Cb 0.33 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.87 1vgw h GLU 125 CO -0.00 0.51 -1.04 1.96 -1.18 0.00 0.00 179.01 179.26 1vgw h GLN 126 N 0.10 0.00 0.00 1.92 4.20 -0.23 -3.39 115.11 117.71 1vgw h GLN 126 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1vgw h GLN 126 Cb 0.35 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.13 1vgw h GLN 126 CO 0.01 0.18 -0.79 0.00 -0.67 0.00 0.00 178.83 177.55 1vgw n ALA 127 N -2.27 2.35 0.24 3.87 0.00 0.42 -4.63 120.51 120.50 1vgw n ALA 127 Ca -0.03 -0.12 0.08 0.00 0.00 0.00 0.00 53.44 53.37 1vgw n ALA 127 Cb 0.69 -0.16 0.61 0.00 0.00 0.00 0.00 19.45 20.59 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 0.00 -1.32 0.00 0.00 -1.30 -2.85 103.07 98.54 1vgw h GLY 128 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1vgw h GLY 128 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.24 1vgw n ASN 129 N -4.13 3.58 -4.12 0.19 3.02 -1.26 -4.94 115.26 107.59 1vgw n ASN 129 Ca -0.02 -2.96 -0.33 0.00 -0.03 0.00 0.00 54.58 51.23 1vgw n ASN 129 Cb 0.21 -0.50 -0.16 0.00 -0.61 0.00 0.00 39.78 38.72 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 -2.71 2.42 0.46 5.41 0.00 -1.08 -5.02 121.76 121.23 1vgw s ALA 130 Ca 0.39 -1.34 0.19 0.00 0.00 0.00 0.00 51.96 51.20 1vgw s ALA 130 Cb 0.32 -1.31 1.16 0.00 0.00 0.00 0.00 23.12 23.29 1vgw s ALA 130 CO 0.08 -0.54 1.93 0.00 0.00 0.00 0.00 175.76 177.23 1vgw h ALA 131 N 7.92 2.25 0.00 0.00 0.00 -1.92 -1.33 119.26 126.18 1vgw h ALA 131 Ca -0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1vgw h ALA 131 Cb 1.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1vgw h ALA 131 CO 0.60 -0.45 0.00 -0.85 0.00 0.00 0.00 179.25 178.55 1vgw n GLU 132 N -4.44 0.32 0.00 0.00 0.00 -1.26 -4.76 120.64 110.50 1vgw n GLU 132 Ca 0.14 0.08 0.00 0.00 0.00 0.00 0.00 57.16 57.38 1vgw n GLU 132 Cb 0.58 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.52 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 0.44 -1.10 0.00 -1.84 0.00 -0.50 -3.98 105.19 98.21 1vgw n GLY 133 Ca 0.10 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1vgw n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vgw n GLY 134 N 0.00 2.04 3.32 -0.02 0.00 -0.89 -1.59 105.19 108.05 1vgw n GLY 134 Ca 0.00 -0.64 -0.19 0.00 0.00 0.00 0.00 46.02 45.20 1vgw n GLY 134 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vgw s ILE 135 N -2.00 1.63 0.13 -0.61 -4.36 0.01 -2.07 121.20 113.93 1vgw s ILE 135 Ca 0.00 -2.05 -0.30 0.00 -0.26 0.00 0.00 60.65 58.04 1vgw s ILE 135 Cb 0.00 -1.90 -0.06 0.00 1.25 0.00 0.00 42.46 41.75 1vgw s ILE 135 CO 0.00 -0.52 0.94 -0.76 0.24 0.00 0.00 174.94 174.84 1vgw s LEU 136 N -3.02 4.53 0.15 0.37 1.43 -1.19 0.33 118.68 121.28 1vgw s LEU 136 Ca 0.18 1.80 -0.18 0.00 -1.03 0.00 0.00 54.13 54.90 1vgw s LEU 136 Cb -0.02 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.67 1vgw s LEU 136 CO 0.06 -0.02 0.48 0.00 0.23 0.00 0.00 176.35 177.10 1vgw s ALA 137 N -0.23 -1.08 -0.03 4.21 0.00 0.21 -1.91 121.76 122.93 1vgw s ALA 137 Ca 0.45 0.01 0.02 0.00 0.00 0.00 0.00 51.96 52.45 1vgw s ALA 137 Cb -0.24 0.79 0.01 0.00 0.00 0.00 0.00 23.12 23.68 1vgw s ALA 137 CO 0.30 -0.72 -0.09 0.14 0.00 0.00 0.00 175.76 175.39 1vgw s VAL 138 N -3.81 0.78 0.34 0.00 -7.23 -0.59 -0.47 120.40 109.40 1vgw s VAL 138 Ca 0.04 -0.33 -0.28 0.00 -1.81 0.00 0.00 61.98 59.60 1vgw s VAL 138 Cb 0.00 -0.72 -0.12 0.00 0.56 0.00 0.00 36.38 36.10 1vgw s VAL 138 CO -0.09 0.26 1.29 -2.65 -0.31 0.00 0.00 175.10 173.59 1vgw n PRO 139 N 3.52 2.11 -2.20 4.82 -0.02 -1.26 -1.13 135.00 140.83 1vgw n PRO 139 Ca -0.20 0.74 -0.38 0.00 -2.02 0.00 0.00 63.50 61.64 1vgw n PRO 139 Cb 0.53 -2.32 -0.03 0.00 -0.02 0.00 0.00 33.50 31.66 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 -1.04 3.50 0.00 -1.45 1.01 -0.57 -4.79 120.40 117.05 1vgw s VAL 140 Ca 0.56 0.11 0.11 0.00 0.00 0.00 0.00 61.98 62.76 1vgw s VAL 140 Cb -0.57 -4.27 -0.11 0.00 0.00 0.00 0.00 36.38 31.42 1vgw s VAL 140 CO 0.62 -1.22 1.29 0.00 0.00 0.00 0.00 175.10 175.78 1vgw h ALA 141 N 12.88 0.50 -2.69 5.51 0.00 -1.89 -3.47 119.26 130.09 1vgw h ALA 141 Ca -0.19 -0.78 -0.59 0.00 0.00 0.00 0.00 54.91 53.36 1vgw h ALA 141 Cb 1.10 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 1vgw h ALA 141 CO 1.25 1.03 -0.29 -0.51 0.00 0.00 0.00 179.25 180.73 1vgw s ASP 142 N -6.55 6.56 0.30 0.00 -0.00 -1.26 -5.05 116.67 110.67 1vgw s ASP 142 Ca 0.02 0.68 -0.28 0.00 -0.00 0.00 0.00 52.55 52.96 1vgw s ASP 142 Cb 0.09 -2.13 -0.14 0.00 -0.00 0.00 0.00 42.92 40.74 1vgw s ASP 142 CO 0.79 0.13 1.05 0.41 -0.00 0.00 0.00 175.17 177.56 1vgw n THR 143 N 0.60 2.01 -4.26 -1.27 -1.04 -1.26 -4.96 114.28 104.10 1vgw n THR 143 Ca -0.06 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.05 61.11 1vgw n THR 143 Cb 0.52 -1.10 -0.09 0.00 -1.82 0.00 0.00 70.33 67.85 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 0.18 3.71 -0.01 -4.42 1.43 -1.26 -5.05 118.68 113.26 1vgw s LEU 144 Ca 0.58 0.15 0.04 0.00 -1.03 0.00 0.00 54.13 53.87 1vgw s LEU 144 Cb -0.67 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 43.57 1vgw s LEU 144 CO 0.60 0.34 -0.13 -0.54 0.23 0.00 0.00 176.35 176.86 1vgw s LYS 145 N -1.19 1.05 -0.07 1.70 -0.14 -1.26 -1.47 119.74 118.35 1vgw s LYS 145 Ca 0.17 -0.47 -0.15 0.00 -1.36 0.00 0.00 55.97 54.16 1vgw s LYS 145 Cb -0.12 -1.02 -0.05 0.00 -1.68 0.00 0.00 37.83 34.97 1vgw s LYS 145 CO 0.06 0.28 0.37 0.50 -0.76 0.00 0.00 175.35 175.80 1vgw s ARG 146 N -0.31 4.04 -0.02 1.68 3.52 0.27 -4.92 118.95 123.22 1vgw s ARG 146 Ca 0.05 0.30 0.03 0.00 -0.13 0.00 0.00 55.73 55.98 1vgw s ARG 146 Cb -0.05 -3.31 -0.03 0.00 -1.56 0.00 0.00 34.95 30.00 1vgw s ARG 146 CO -0.00 0.49 -0.07 0.00 -0.81 0.00 0.00 175.30 174.90 1vgw s ALA 147 N -0.39 2.98 0.00 6.12 0.00 -1.26 -0.62 121.76 128.59 1vgw s ALA 147 Ca 0.22 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.20 1vgw s ALA 147 Cb -0.15 -1.14 0.00 0.00 0.00 0.00 0.00 23.12 21.82 1vgw s ALA 147 CO 0.10 0.60 0.00 0.39 0.00 0.00 0.00 175.76 176.85 1vgw n GLU 148 N 1.80 0.00 -2.60 0.00 1.02 -0.48 -4.85 120.64 115.52 1vgw n GLU 148 Ca -0.16 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.60 1vgw n GLU 148 Cb 0.53 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.96 1vgw n GLU 148 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1vgw n SER 149 N 0.00 6.85 0.00 1.62 7.64 -1.26 -4.51 113.62 123.96 1vgw n SER 149 Ca 0.00 -3.71 0.00 0.00 1.01 0.00 0.00 58.87 56.17 1vgw n SER 149 Cb 0.00 -1.04 0.00 0.00 -1.01 0.00 0.00 64.21 62.16 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 -0.16 0.64 3.42 0.23 0.00 -1.26 -5.04 105.19 103.03 1vgw n GLY 150 Ca 0.45 -0.03 -0.21 0.00 0.00 0.00 0.00 46.02 46.22 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 -0.34 1.54 -0.18 1.61 -0.21 -1.26 -5.11 119.66 115.70 1vgw s GLN 151 Ca 0.00 -1.76 -0.27 0.00 0.02 0.00 0.00 55.36 53.35 1vgw s GLN 151 Cb 0.00 -1.21 -0.01 0.00 1.00 0.00 0.00 33.01 32.79 1vgw s GLN 151 CO 0.00 0.08 0.90 0.42 -2.12 0.00 0.00 175.29 174.57 1vgw s ILE 152 N -2.96 4.82 -0.90 1.08 1.01 -1.26 -1.38 121.20 121.60 1vgw s ILE 152 Ca 0.29 1.78 0.15 0.00 0.00 0.00 0.00 60.65 62.86 1vgw s ILE 152 Cb 0.03 -4.20 -0.11 0.00 0.01 0.00 0.00 42.46 38.18 1vgw s ILE 152 CO 0.12 -0.03 0.68 -1.54 0.00 0.00 0.00 174.94 174.16 1vgw n SER 153 N 5.53 0.95 -3.62 3.58 3.41 0.21 -4.91 113.62 118.77 1vgw n SER 153 Ca 0.07 -0.97 -0.04 0.00 -0.26 0.00 0.00 58.87 57.67 1vgw n SER 153 Cb 0.48 0.84 -0.03 0.00 -0.26 0.00 0.00 64.21 65.24 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 -2.21 -2.10 -0.35 7.33 0.00 -1.20 -4.97 121.76 118.27 1vgw s ALA 154 Ca 0.08 1.78 -0.10 0.00 0.00 0.00 0.00 51.96 53.72 1vgw s ALA 154 Cb 0.11 -0.88 0.02 0.00 0.00 0.00 0.00 23.12 22.37 1vgw s ALA 154 CO 0.53 -0.39 0.17 0.99 0.00 0.00 0.00 175.76 177.07 1vgw s THR 155 N -1.56 4.46 0.25 0.00 2.01 -1.26 0.98 115.64 120.52 1vgw s THR 155 Ca 0.08 -0.75 -0.07 0.00 0.31 0.00 0.00 61.69 61.26 1vgw s THR 155 Cb -0.01 -3.42 -0.06 0.00 0.01 0.00 0.00 72.50 69.02 1vgw s THR 155 CO -0.05 -0.12 0.53 0.68 -0.69 0.00 0.00 174.62 174.97 1vgw s VAL 156 N 1.55 5.00 0.14 3.82 -7.23 -0.54 -4.96 120.40 118.19 1vgw s VAL 156 Ca 0.02 0.22 -0.30 0.00 -1.81 0.00 0.00 61.98 60.11 1vgw s VAL 156 Cb -0.18 -3.67 -0.07 0.00 0.56 0.00 0.00 36.38 33.01 1vgw s VAL 156 CO 0.06 -0.18 1.21 -0.62 -0.31 0.00 0.00 175.10 175.26 1vgw s ASP 157 N -2.75 7.07 -0.04 4.85 2.15 -1.26 -4.01 116.67 122.67 1vgw s ASP 157 Ca 0.45 2.17 0.13 0.00 0.43 0.00 0.00 52.55 55.74 1vgw s ASP 157 Cb -0.11 -2.60 0.41 0.00 -0.30 0.00 0.00 42.92 40.32 1vgw s ASP 157 CO 0.26 -0.42 1.34 -2.11 -0.17 0.00 0.00 175.17 174.07 1vgw n ARG 158 N 3.03 2.94 -1.68 4.34 0.00 -1.26 -4.98 116.66 119.05 1vgw n ARG 158 Ca 0.06 -2.31 -0.44 0.00 -0.00 0.00 0.00 57.85 55.16 1vgw n ARG 158 Cb 0.45 -1.45 -0.04 0.00 -0.00 0.00 0.00 32.46 31.43 1vgw n ARG 158 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1vgw n SER 159 N 0.48 3.78 -1.19 2.89 2.88 -1.26 -1.47 113.62 119.72 1vgw n SER 159 Ca 0.16 1.00 -0.15 0.00 -1.33 0.00 0.00 58.87 58.54 1vgw n SER 159 Cb 0.56 -1.49 -0.06 0.00 -0.75 0.00 0.00 64.21 62.47 1vgw n SER 159 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vgw n GLY 160 N 4.14 1.40 3.84 0.46 0.00 -1.26 -4.99 105.19 108.77 1vgw n GLY 160 Ca 0.19 -0.31 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.48 4.04 0.04 0.99 1.43 -0.54 -5.05 118.68 116.10 1vgw s LEU 161 Ca 0.00 0.10 -0.00 0.00 -1.03 0.00 0.00 54.13 53.20 1vgw s LEU 161 Cb 0.00 -2.68 -0.03 0.00 0.03 0.00 0.00 46.19 43.51 1vgw s LEU 161 CO 0.00 0.16 -0.03 0.26 0.23 0.00 0.00 176.35 176.97 1vgw s TRP 162 N -1.46 0.41 -0.16 0.29 0.52 -1.26 -1.52 118.94 115.76 1vgw s TRP 162 Ca 0.32 -0.78 -0.04 0.00 0.02 0.00 0.00 56.10 55.62 1vgw s TRP 162 Cb -0.12 -0.30 -0.03 0.00 -1.15 0.00 0.00 33.47 31.87 1vgw s TRP 162 CO 0.25 -0.27 -0.02 -0.65 0.02 0.00 0.00 176.95 176.28 1vgw s GLN 163 N -2.62 3.73 0.19 4.98 -0.21 -0.28 -4.84 119.66 120.61 1vgw s GLN 163 Ca -0.05 -0.49 -0.21 0.00 0.02 0.00 0.00 55.36 54.64 1vgw s GLN 163 Cb -0.02 -2.97 -0.08 0.00 1.00 0.00 0.00 33.01 30.95 1vgw s GLN 163 CO -0.05 0.25 0.71 0.00 -2.12 0.00 0.00 175.29 174.08 1vgw s ALA 164 N 0.35 3.45 0.00 6.09 0.00 -1.26 -1.55 121.76 128.83 1vgw s ALA 164 Ca -0.03 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.11 1vgw s ALA 164 Cb -0.14 -2.81 0.00 0.00 0.00 0.00 0.00 23.12 20.17 1vgw s ALA 164 CO 0.02 0.33 0.00 1.04 0.00 0.00 0.00 175.76 177.16 1vgw n GLN 165 N 1.02 3.97 -4.07 0.00 6.02 -0.80 -4.99 117.38 118.53 1vgw n GLN 165 Ca -0.04 0.00 -0.08 0.00 -0.01 0.00 0.00 57.00 56.87 1vgw n GLN 165 Cb 0.51 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.67 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 1.03 0.19 0.70 5.09 -4.23 -1.26 -4.58 115.64 112.57 1vgw s THR 166 Ca 0.00 -1.75 -0.14 0.00 -1.18 0.00 0.00 61.69 58.61 1vgw s THR 166 Cb 0.00 -1.61 0.02 0.00 1.34 0.00 0.00 72.50 72.25 1vgw s THR 166 CO 0.00 -0.85 1.12 -2.84 -0.54 0.00 0.00 174.62 171.52 1vgw s PRO 167 N -3.94 2.54 -0.35 3.99 0.02 -1.26 -4.79 135.00 131.21 1vgw s PRO 167 Ca 0.10 1.43 -0.05 0.00 0.02 0.00 0.00 61.00 62.50 1vgw s PRO 167 Cb 0.07 -1.91 0.06 0.00 0.02 0.00 0.00 34.50 32.74 1vgw s PRO 167 CO -0.08 -1.46 0.12 -0.65 -0.33 0.00 0.00 177.00 174.60 1vgw s GLN 168 N -4.20 2.44 -0.31 5.54 -0.21 -0.02 -3.15 119.66 119.75 1vgw s GLN 168 Ca 0.67 -1.37 -0.19 0.00 0.02 0.00 0.00 55.36 54.49 1vgw s GLN 168 Cb -0.21 -3.45 -0.01 0.00 1.00 0.00 0.00 33.01 30.33 1vgw s GLN 168 CO 0.45 -0.78 0.54 -1.17 -2.12 0.00 0.00 175.29 172.21 1vgw s LEU 169 N 1.31 4.18 0.01 2.90 2.96 -0.88 -2.47 118.68 126.69 1vgw s LEU 169 Ca 0.00 0.28 -0.06 0.00 -0.22 0.00 0.00 54.13 54.14 1vgw s LEU 169 Cb -0.21 -2.67 -0.01 0.00 0.50 0.00 0.00 46.19 43.81 1vgw s LEU 169 CO 0.00 -0.41 0.10 -0.36 -1.32 0.00 0.00 176.35 174.36 1vgw s PHE 170 N 2.42 0.12 0.44 5.38 0.40 -0.66 -2.09 117.98 124.00 1vgw s PHE 170 Ca 0.21 -0.30 -0.25 0.00 -0.60 0.00 0.00 56.93 56.00 1vgw s PHE 170 Cb -0.15 -0.10 -0.09 0.00 0.51 0.00 0.00 43.02 43.19 1vgw s PHE 170 CO 0.12 -0.29 1.28 1.04 0.70 0.00 0.00 175.22 178.07 1vgw n GLN 171 N 1.31 1.90 -0.04 0.44 6.02 -1.26 -0.38 117.38 125.36 1vgw n GLN 171 Ca -0.22 0.68 -0.08 0.00 -0.01 0.00 0.00 57.00 57.36 1vgw n GLN 171 Cb 0.56 -2.41 -0.03 0.00 1.02 0.00 0.00 30.24 29.38 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 1.98 0.14 -0.68 -1.58 0.00 -0.92 -0.37 119.26 117.83 1vgw h ALA 172 Ca -0.48 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 1vgw h ALA 172 Cb 1.30 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 19.21 1vgw h ALA 172 CO 0.59 -0.47 0.36 0.78 0.00 0.00 0.00 179.25 180.51 1vgw h GLY 173 N 0.01 1.02 1.00 0.00 0.00 -1.31 0.18 103.07 103.95 1vgw h GLY 173 Ca 0.10 -0.46 -0.12 0.00 0.00 0.00 0.00 47.33 46.85 1vgw h GLY 173 CO -0.21 0.44 -0.28 -2.00 0.00 0.00 0.00 176.54 174.49 1vgw h LEU 174 N 0.95 0.79 -0.43 3.11 5.85 -1.66 -2.59 115.31 121.33 1vgw h LEU 174 Ca 0.24 -0.46 -0.14 0.00 0.84 0.00 0.00 57.88 58.36 1vgw h LEU 174 Cb 0.05 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 1vgw h LEU 174 CO -0.04 1.08 -0.27 0.25 -0.34 0.00 0.00 178.44 179.13 1vgw h LEU 175 N 0.51 0.99 -0.23 2.25 5.85 -0.82 -1.50 115.31 122.36 1vgw h LEU 175 Ca 0.05 -0.42 0.01 0.00 0.84 0.00 0.00 57.88 58.36 1vgw h LEU 175 Cb 0.85 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 1vgw h LEU 175 CO 0.07 1.20 0.13 -0.74 -0.34 0.00 0.00 178.44 178.76 1vgw h HIS 176 N 0.79 0.24 0.25 1.25 2.76 -0.99 -1.90 115.15 117.55 1vgw h HIS 176 Ca 0.09 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.26 1vgw h HIS 176 Cb 0.86 -0.08 -0.00 0.00 1.55 0.00 0.00 27.41 29.74 1vgw h HIS 176 CO 0.06 0.15 -0.15 -0.09 -1.30 0.00 0.00 177.93 176.59 1vgw h ARG 177 N 0.27 -0.37 -0.74 5.26 1.12 -1.26 -2.85 114.38 115.81 1vgw h ARG 177 Ca 0.09 0.03 0.12 0.00 -1.11 0.00 0.00 59.98 59.11 1vgw h ARG 177 Cb 0.00 0.08 -0.05 0.00 -0.01 0.00 0.00 29.97 30.00 1vgw h ARG 177 CO -0.05 -0.25 0.49 0.00 -3.11 0.00 0.00 179.97 177.05 1vgw h ALA 178 N 0.35 1.95 0.00 2.80 0.00 -1.15 -2.75 119.26 120.47 1vgw h ALA 178 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1vgw h ALA 178 Cb 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1vgw h ALA 178 CO 0.03 -0.13 -0.27 1.28 0.00 0.00 0.00 179.25 180.16 1vgw n LEU 179 N -4.49 0.34 -2.23 0.00 4.77 -0.73 -4.83 117.00 109.82 1vgw n LEU 179 Ca 0.13 0.27 -0.23 0.00 -0.03 0.00 0.00 56.01 56.15 1vgw n LEU 179 Cb 0.42 -0.35 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 1vgw n LEU 179 CO 0.33 0.03 1.42 0.00 -1.33 0.00 0.00 177.39 177.84 1vgw n ALA 180 N -1.55 5.89 0.00 -1.18 0.00 -1.04 -5.05 120.51 117.57 1vgw n ALA 180 Ca 0.06 -2.50 0.00 0.00 0.00 0.00 0.00 53.44 51.00 1vgw n ALA 180 Cb 0.35 -1.80 0.00 0.00 0.00 0.00 0.00 19.45 18.01 1vgw n ALA 180 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1vgw n ILE 187 N 0.54 0.00 0.00 0.00 0.00 -1.26 -5.11 119.36 113.53 1vgw n ILE 187 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 62.75 63.17 1vgw n ILE 187 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 39.64 40.21 1vgw n ILE 187 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1vgw n THR 188 N -0.42 0.00 -2.55 9.51 -2.24 -1.26 -5.06 114.28 112.26 1vgw n THR 188 Ca 0.00 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.55 1vgw n THR 188 Cb 0.00 -0.49 0.06 0.00 -2.10 0.00 0.00 70.33 67.81 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 0.23 4.91 0.21 3.42 3.84 -1.26 -4.99 116.67 123.03 1vgw s ASP 189 Ca 0.00 -0.05 -0.09 0.00 -0.00 0.00 0.00 52.55 52.41 1vgw s ASP 189 Cb 0.00 -0.64 0.29 0.00 -1.38 0.00 0.00 42.92 41.19 1vgw s ASP 189 CO 0.00 -1.44 1.75 -0.33 -0.00 0.00 0.00 175.17 175.15 1vgw h GLU 190 N -0.23 0.44 -0.41 2.11 3.07 -1.98 -2.34 114.58 115.24 1vgw h GLU 190 Ca -0.41 -0.03 0.07 0.00 -0.50 0.00 0.00 59.36 58.50 1vgw h GLU 190 Cb 1.29 -0.10 -0.07 0.00 -0.84 0.00 0.00 28.75 29.04 1vgw h GLU 190 CO 0.50 0.29 0.01 0.00 -1.40 0.00 0.00 179.01 178.40 1vgw h ALA 191 N 1.42 0.38 -0.38 3.43 0.00 -1.96 -1.76 119.26 120.39 1vgw h ALA 191 Ca 0.31 0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.37 1vgw h ALA 191 Cb 0.37 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1vgw h ALA 191 CO -0.29 -0.39 0.26 0.66 0.00 0.00 0.00 179.25 179.49 1vgw h SER 192 N 0.12 0.35 -0.54 0.00 4.64 -1.81 -0.18 113.55 116.13 1vgw h SER 192 Ca 0.20 -0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.40 1vgw h SER 192 Cb 0.29 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.28 1vgw h SER 192 CO -0.33 0.24 -0.12 0.00 -0.87 0.00 0.00 176.83 175.75 1vgw h ALA 193 N 1.78 0.75 -0.21 5.18 0.00 -1.30 -3.14 119.26 122.32 1vgw h ALA 193 Ca 0.16 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.55 1vgw h ALA 193 Cb 0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1vgw h ALA 193 CO -0.04 0.67 -0.51 0.28 0.00 0.00 0.00 179.25 179.65 1vgw h VAL 194 N 0.92 1.31 -0.46 0.00 2.07 -0.87 -3.11 116.25 116.11 1vgw h VAL 194 Ca 0.14 -1.74 -0.02 0.00 0.82 0.00 0.00 66.70 65.91 1vgw h VAL 194 Cb 0.69 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 1vgw h VAL 194 CO 0.05 0.54 0.22 -0.33 0.02 0.00 0.00 177.57 178.08 1vgw h GLU 195 N 0.47 0.64 0.00 1.57 5.08 -1.10 -2.26 114.58 118.99 1vgw h GLU 195 Ca 0.02 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1vgw h GLU 195 Cb 1.05 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1vgw h GLU 195 CO 0.10 0.50 0.00 0.87 -1.00 0.00 0.00 179.01 179.48 1vgw h LYS 196 N 0.65 0.00 -0.21 2.33 1.57 -1.49 -1.56 116.57 117.86 1vgw h LYS 196 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1vgw h LYS 196 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1vgw h LYS 196 CO -0.02 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.14 1vgw n LEU 197 N -2.71 1.68 0.00 2.94 4.32 -0.85 -4.88 117.00 117.49 1vgw n LEU 197 Ca -0.01 -0.74 0.00 0.00 -0.02 0.00 0.00 56.01 55.25 1vgw n LEU 197 Cb 0.16 -0.13 0.00 0.00 -1.62 0.00 0.00 43.42 41.83 1vgw n LEU 197 CO 0.19 0.37 0.00 0.61 -1.22 0.00 0.00 177.39 177.34 1vgw n GLY 198 N 1.11 0.44 3.81 -0.72 0.00 -0.59 -5.03 105.19 104.21 1vgw n GLY 198 Ca 0.15 -0.58 -0.37 0.00 0.00 0.00 0.00 46.02 45.23 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 5.36 -0.54 1.61 1.01 -1.21 -5.05 120.40 119.58 1vgw s VAL 199 Ca 0.00 0.39 -0.05 0.00 0.00 0.00 0.00 61.98 62.32 1vgw s VAL 199 Cb 0.00 -3.52 0.14 0.00 0.00 0.00 0.00 36.38 33.00 1vgw s VAL 199 CO 0.00 0.53 0.38 -0.13 0.00 0.00 0.00 175.10 175.87 1vgw s ARG 200 N -0.45 2.46 0.40 2.72 0.52 -1.26 -3.64 118.95 119.70 1vgw s ARG 200 Ca 0.15 -2.15 -0.27 0.00 -0.52 0.00 0.00 55.73 52.94 1vgw s ARG 200 Cb -0.13 -3.78 -0.10 0.00 0.52 0.00 0.00 34.95 31.46 1vgw s ARG 200 CO 0.04 -1.16 1.44 -2.14 0.02 0.00 0.00 175.30 173.50 1vgw s PRO 201 N 0.62 3.96 0.65 3.54 0.02 -1.26 -4.90 135.00 137.63 1vgw s PRO 201 Ca 0.12 2.46 -0.15 0.00 0.02 0.00 0.00 61.00 63.44 1vgw s PRO 201 Cb -0.22 -2.84 -0.01 0.00 0.02 0.00 0.00 34.50 31.45 1vgw s PRO 201 CO -0.03 -0.61 1.10 -0.51 -0.33 0.00 0.00 177.00 176.62 1vgw s LEU 202 N -2.33 3.41 -0.35 -5.54 1.43 -0.62 -4.87 118.68 109.81 1vgw s LEU 202 Ca 0.56 1.96 -0.10 0.00 -1.03 0.00 0.00 54.13 55.52 1vgw s LEU 202 Cb -0.44 -4.55 0.02 0.00 0.03 0.00 0.00 46.19 41.25 1vgw s LEU 202 CO 0.59 -1.54 0.18 -0.76 0.23 0.00 0.00 176.35 175.05 1vgw s LEU 203 N -4.79 4.52 -0.12 1.79 1.43 -1.26 -0.81 118.68 119.43 1vgw s LEU 203 Ca 0.66 -0.93 -0.04 0.00 -1.03 0.00 0.00 54.13 52.80 1vgw s LEU 203 Cb -0.20 -1.99 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 1vgw s LEU 203 CO 0.41 -0.34 0.02 -0.63 0.23 0.00 0.00 176.35 176.04 1vgw s ILE 204 N 1.54 4.49 -0.21 -0.59 1.09 0.15 -4.93 121.20 122.74 1vgw s ILE 204 Ca 0.02 -0.16 -0.34 0.00 -1.10 0.00 0.00 60.65 59.06 1vgw s ILE 204 Cb -0.19 -2.94 -0.11 0.00 -1.06 0.00 0.00 42.46 38.16 1vgw s ILE 204 CO 0.06 0.55 2.01 1.67 -0.10 0.00 0.00 174.94 179.13 1vgw n GLN 205 N 2.69 1.68 0.00 2.79 -0.06 -1.26 0.68 117.38 123.91 1vgw n GLN 205 Ca -0.18 0.56 0.00 0.00 -2.00 0.00 0.00 57.00 55.38 1vgw n GLN 205 Cb 0.53 -2.60 0.00 0.00 -4.06 0.00 0.00 30.24 24.11 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 5.23 1.26 3.61 1.69 0.00 0.37 -4.70 105.19 112.65 1vgw n GLY 206 Ca 0.30 -1.52 -0.14 0.00 0.00 0.00 0.00 46.02 44.66 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 -0.69 0.60 1.61 2.15 -1.26 -4.94 116.67 113.15 1vgw s ASP 207 Ca 0.00 1.21 0.34 0.00 0.43 0.00 0.00 52.55 54.52 1vgw s ASP 207 Cb 0.00 1.18 1.93 0.00 -0.30 0.00 0.00 42.92 45.73 1vgw s ASP 207 CO 0.00 -0.31 2.25 0.00 -0.17 0.00 0.00 175.17 176.94 1vgw h ALA 208 N 4.44 1.32 0.00 3.66 0.00 -2.00 -1.31 119.26 125.37 1vgw h ALA 208 Ca -0.28 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1vgw h ALA 208 Cb 1.16 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1vgw h ALA 208 CO 0.13 0.02 -0.13 0.00 0.00 0.00 0.00 179.25 179.27 1vgw h ARG 209 N 0.00 0.00 -2.01 0.00 3.08 -1.95 -3.35 114.38 110.15 1vgw h ARG 209 Ca -0.00 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.91 1vgw h ARG 209 Cb 0.07 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 1vgw h ARG 209 CO 0.00 0.13 -0.29 -1.71 -1.07 0.00 0.00 179.97 177.04 1vgw n ASN 210 N -3.30 5.22 -4.87 7.04 5.15 -0.49 -4.59 115.26 119.40 1vgw n ASN 210 Ca 0.00 -2.45 -0.31 0.00 -0.60 0.00 0.00 54.58 51.22 1vgw n ASN 210 Cb 0.37 -1.34 -0.04 0.00 -0.53 0.00 0.00 39.78 38.25 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 3.92 -0.36 1.20 0.05 -1.26 -4.89 118.68 117.35 1vgw s LEU 211 Ca 0.50 1.09 -0.20 0.00 0.05 0.00 0.00 54.13 55.57 1vgw s LEU 211 Cb 0.24 -3.94 0.00 0.00 -2.05 0.00 0.00 46.19 40.44 1vgw s LEU 211 CO 0.00 -0.32 0.62 -0.75 -0.55 0.00 0.00 176.35 175.36 1vgw s LYS 212 N -3.58 3.65 -0.66 1.48 2.20 -1.26 -4.45 119.74 117.11 1vgw s LYS 212 Ca 0.51 0.00 -0.26 0.00 -0.36 0.00 0.00 55.97 55.85 1vgw s LYS 212 Cb -0.10 -3.82 -0.01 0.00 -1.51 0.00 0.00 37.83 32.39 1vgw s LYS 212 CO 0.28 -0.74 1.71 -1.17 -0.36 0.00 0.00 175.35 175.07 1vgw s LEU 213 N 2.68 3.25 0.00 5.43 2.96 -0.53 -4.72 118.68 127.75 1vgw s LEU 213 Ca 0.24 0.06 0.00 0.00 -0.22 0.00 0.00 54.13 54.21 1vgw s LEU 213 Cb -0.15 -2.54 0.00 0.00 0.50 0.00 0.00 46.19 44.01 1vgw s LEU 213 CO 0.15 -2.25 0.00 0.35 -1.32 0.00 0.00 176.35 173.28 1vgw n THR 214 N 7.03 0.00 -4.28 3.68 -2.24 -1.26 -4.91 114.28 112.30 1vgw n THR 214 Ca 0.17 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.73 1vgw n THR 214 Cb 0.51 -0.15 -0.12 0.00 -2.10 0.00 0.00 70.33 68.47 1vgw n THR 214 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vgw s GLN 215 N -1.72 1.03 0.43 -0.78 -2.07 -1.26 -5.05 119.66 110.24 1vgw s GLN 215 Ca 0.00 -1.05 0.20 0.00 -1.82 0.00 0.00 55.36 52.69 1vgw s GLN 215 Cb 0.00 -1.19 1.14 0.00 -1.09 0.00 0.00 33.01 31.88 1vgw s GLN 215 CO 0.00 0.28 1.85 -1.35 -1.32 0.00 0.00 175.29 174.74 1vgw h PRO 216 N 4.27 0.34 -0.23 9.60 0.11 -2.02 -1.35 132.00 142.72 1vgw h PRO 216 Ca -0.44 -0.02 0.07 0.00 0.11 0.00 0.00 66.00 65.72 1vgw h PRO 216 Cb 1.18 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1vgw h PRO 216 CO 0.40 0.22 0.25 0.37 -0.21 0.00 0.00 178.00 179.04 1vgw h GLN 217 N 0.35 0.00 -0.00 1.05 4.15 -2.04 -1.53 115.11 117.08 1vgw h GLN 217 Ca 0.48 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.90 1vgw h GLN 217 Cb 1.31 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.00 1vgw h GLN 217 CO -0.17 0.00 -0.31 -0.25 -1.93 0.00 0.00 178.83 176.17 1vgw n ASP 218 N -3.78 0.66 -0.06 -0.69 10.43 -0.51 -4.07 116.55 118.54 1vgw n ASP 218 Ca 0.03 -0.50 -0.02 0.00 2.57 0.00 0.00 54.79 56.87 1vgw n ASP 218 Cb 0.39 0.10 0.22 0.00 1.84 0.00 0.00 41.12 43.67 1vgw n ASP 218 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1vgw h ALA 219 N 3.36 1.22 0.05 2.24 0.00 -1.41 -2.34 119.26 122.39 1vgw h ALA 219 Ca 0.00 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.68 1vgw h ALA 219 Cb 0.48 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1vgw h ALA 219 CO 0.00 0.51 -0.07 -0.92 0.00 0.00 0.00 179.25 178.77 1vgw h TYR 220 N 0.62 -0.19 -0.33 0.00 5.03 -1.76 -1.28 116.97 119.06 1vgw h TYR 220 Ca 0.12 0.00 -0.13 0.00 2.58 0.00 0.00 58.73 61.30 1vgw h TYR 220 Cb 0.41 0.08 -0.01 0.00 1.55 0.00 0.00 36.73 38.76 1vgw h TYR 220 CO 0.02 -0.12 -0.33 0.82 -1.32 0.00 0.00 178.16 177.23 1vgw h ILE 221 N -0.15 1.28 -0.09 1.81 2.04 -1.78 -2.98 117.51 117.64 1vgw h ILE 221 Ca 0.01 -1.48 -0.02 0.00 1.00 0.00 0.00 64.86 64.37 1vgw h ILE 221 Cb 0.16 1.38 -0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1vgw h ILE 221 CO -0.04 0.48 -0.01 0.58 0.00 0.00 0.00 178.15 179.16 1vgw h VAL 222 N 0.62 1.28 -0.96 1.67 2.07 -1.30 -2.25 116.25 117.37 1vgw h VAL 222 Ca 0.07 -0.89 0.12 0.00 0.82 0.00 0.00 66.70 66.82 1vgw h VAL 222 Cb 0.86 1.69 -0.08 0.00 -1.52 0.00 0.00 31.29 32.25 1vgw h VAL 222 CO 0.08 0.25 0.61 -0.09 0.02 0.00 0.00 177.57 178.44 1vgw h ARG 223 N -0.14 0.89 -0.47 1.57 9.65 -1.28 0.13 114.38 124.72 1vgw h ARG 223 Ca 0.02 -0.05 -0.07 0.00 -1.10 0.00 0.00 59.98 58.78 1vgw h ARG 223 Cb 0.40 -0.20 -0.02 0.00 -1.39 0.00 0.00 29.97 28.76 1vgw h ARG 223 CO 0.01 0.59 0.03 1.25 2.80 0.00 0.00 179.97 184.64 1vgw h LEU 224 N 0.92 0.79 -0.53 3.80 5.85 -1.44 -1.31 115.31 123.39 1vgw h LEU 224 Ca 0.47 -0.29 -0.15 0.00 0.84 0.00 0.00 57.88 58.74 1vgw h LEU 224 Cb 0.51 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 1vgw h LEU 224 CO -0.23 0.89 -0.48 -0.07 -0.34 0.00 0.00 178.44 178.21 1vgw h LEU 225 N 0.67 0.70 -0.23 2.25 3.38 -0.53 -3.12 115.31 118.43 1vgw h LEU 225 Ca 0.14 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 1vgw h LEU 225 Cb 0.47 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1vgw h LEU 225 CO 0.02 1.07 -0.03 -0.07 0.09 0.00 0.00 178.44 179.52 1vgw h LEU 226 N 0.51 0.42 0.00 1.67 3.38 -0.97 -3.52 115.31 116.80 1vgw h LEU 226 Ca 0.03 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1vgw h LEU 226 Cb 1.02 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1vgw h LEU 226 CO 0.10 0.66 0.00 0.47 0.09 0.00 0.00 178.44 179.75