#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vgw s LYS 2 N 0.00 3.77 0.28 1.96 2.20 -1.26 -5.05 119.74 121.64 1vgw s LYS 2 Ca 0.00 0.46 -0.30 0.00 -0.36 0.00 0.00 55.97 55.77 1vgw s LYS 2 Cb 0.00 -2.39 -0.11 0.00 -1.51 0.00 0.00 37.83 33.82 1vgw s LYS 2 CO 0.00 -0.04 1.53 1.03 -0.36 0.00 0.00 175.35 177.51 1vgw s ARG 3 N -3.88 4.18 0.36 4.03 0.52 -1.26 -5.00 118.95 117.90 1vgw s ARG 3 Ca 0.51 2.47 -0.07 0.00 -0.52 0.00 0.00 55.73 58.12 1vgw s ARG 3 Cb -0.10 -3.06 -0.05 0.00 0.52 0.00 0.00 34.95 32.26 1vgw s ARG 3 CO 0.32 -0.55 0.67 0.15 0.02 0.00 0.00 175.30 175.91 1vgw s LYS 4 N -0.48 3.68 -0.29 3.54 1.02 -1.26 -4.94 119.74 120.99 1vgw s LYS 4 Ca 0.62 0.21 -0.00 0.00 0.02 0.00 0.00 55.97 56.81 1vgw s LYS 4 Cb -0.45 -2.51 0.06 0.00 -0.52 0.00 0.00 37.83 34.41 1vgw s LYS 4 CO 0.46 0.05 -0.02 -0.80 -0.92 0.00 0.00 175.35 174.13 1vgw s ASN 5 N -3.32 4.77 -0.20 2.83 0.01 -1.26 -0.76 114.94 117.01 1vgw s ASN 5 Ca 0.47 -1.38 -0.02 0.00 -0.71 0.00 0.00 52.86 51.22 1vgw s ASN 5 Cb -0.10 -1.67 0.00 0.00 0.41 0.00 0.00 41.25 39.89 1vgw s ASN 5 CO 0.33 -0.26 -0.11 -0.63 -1.51 0.00 0.00 177.10 174.92 1vgw s ILE 6 N 1.19 2.83 0.05 0.60 1.01 -0.25 -0.66 121.20 125.96 1vgw s ILE 6 Ca -0.05 -0.68 -0.29 0.00 0.00 0.00 0.00 60.65 59.63 1vgw s ILE 6 Cb -0.20 -2.25 -0.05 0.00 0.01 0.00 0.00 42.46 39.97 1vgw s ILE 6 CO -0.03 0.47 0.91 0.00 0.00 0.00 0.00 174.94 176.30 1vgw s ALA 7 N 1.36 3.25 -0.11 9.38 0.00 -0.53 -0.48 121.76 134.64 1vgw s ALA 7 Ca 0.05 0.47 0.02 0.00 0.00 0.00 0.00 51.96 52.50 1vgw s ALA 7 Cb -0.14 -3.22 0.02 0.00 0.00 0.00 0.00 23.12 19.78 1vgw s ALA 7 CO -0.07 -0.08 -0.15 -1.17 0.00 0.00 0.00 175.76 174.29 1vgw s LEU 8 N 0.38 1.69 -0.32 0.00 2.96 0.61 -1.20 118.68 122.81 1vgw s LEU 8 Ca 0.46 -0.42 0.03 0.00 -0.22 0.00 0.00 54.13 53.98 1vgw s LEU 8 Cb -0.22 -1.07 0.10 0.00 0.50 0.00 0.00 46.19 45.50 1vgw s LEU 8 CO 0.27 0.01 0.05 -0.63 -1.32 0.00 0.00 176.35 174.72 1vgw s ILE 9 N 1.03 1.92 -0.42 6.68 1.01 -0.64 -1.07 121.20 129.71 1vgw s ILE 9 Ca -0.06 -2.04 -0.29 0.00 0.00 0.00 0.00 60.65 58.27 1vgw s ILE 9 Cb -0.15 -2.39 0.01 0.00 0.01 0.00 0.00 42.46 39.94 1vgw s ILE 9 CO -0.02 -0.56 1.41 -2.16 0.00 0.00 0.00 174.94 173.61 1vgw s PRO 10 N 1.10 3.56 -0.12 2.79 0.04 -1.26 -1.53 135.00 139.58 1vgw s PRO 10 Ca 0.09 0.91 0.15 0.00 0.04 0.00 0.00 61.00 62.19 1vgw s PRO 10 Cb -0.19 -4.03 0.34 0.00 0.04 0.00 0.00 34.50 30.66 1vgw s PRO 10 CO -0.12 -1.58 1.17 0.00 0.04 0.00 0.00 177.00 176.51 1vgw n ALA 11 N 8.85 2.84 -0.91 8.56 0.00 -0.23 -4.32 120.51 135.30 1vgw n ALA 11 Ca 0.16 -2.66 -0.10 0.00 0.00 0.00 0.00 53.44 50.84 1vgw n ALA 11 Cb 0.48 -0.45 -0.13 0.00 0.00 0.00 0.00 19.45 19.35 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 -0.75 5.90 -2.58 0.00 0.00 -1.06 -4.67 120.51 117.35 1vgw n ALA 12 Ca 0.13 -1.50 -0.27 0.00 0.00 0.00 0.00 53.44 51.80 1vgw n ALA 12 Cb 0.77 -2.05 -0.08 0.00 0.00 0.00 0.00 19.45 18.09 1vgw n ALA 12 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1vgw s LYS 24 N 0.70 1.98 0.00 0.00 1.02 -1.26 -4.60 119.74 117.57 1vgw s LYS 24 Ca 0.53 -2.21 0.21 0.00 0.02 0.00 0.00 55.97 54.52 1vgw s LYS 24 Cb 0.26 -0.94 0.27 0.00 -0.52 0.00 0.00 37.83 36.89 1vgw s LYS 24 CO -0.01 -0.40 1.24 0.00 -0.92 0.00 0.00 175.35 175.27 1vgw n GLN 25 N -0.99 2.11 -0.25 1.68 10.64 -1.26 -4.12 117.38 125.18 1vgw n GLN 25 Ca -0.09 -1.94 0.06 0.00 -1.83 0.00 0.00 57.00 53.20 1vgw n GLN 25 Cb 0.66 -1.42 0.19 0.00 -0.86 0.00 0.00 30.24 28.80 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 1.23 0.61 -1.99 2.61 0.53 -1.26 -0.67 117.16 118.22 1vgw n TYR 26 Ca 0.15 -0.58 -0.40 0.00 -1.02 0.00 0.00 57.90 56.04 1vgw n TYR 26 Cb 0.53 -0.09 -0.03 0.00 -1.03 0.00 0.00 39.34 38.73 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 -1.38 3.39 0.13 -0.72 1.01 -1.26 -4.68 120.40 116.89 1vgw s VAL 27 Ca 0.29 0.33 -0.35 0.00 0.00 0.00 0.00 61.98 62.25 1vgw s VAL 27 Cb 0.17 -3.73 -0.16 0.00 0.00 0.00 0.00 36.38 32.67 1vgw s VAL 27 CO 0.15 -0.59 1.38 -0.62 0.00 0.00 0.00 175.10 175.42 1vgw n GLU 28 N 8.79 1.46 -3.48 2.72 -0.58 -1.26 -3.77 120.64 124.51 1vgw n GLU 28 Ca 0.23 0.53 -0.19 0.00 -0.42 0.00 0.00 57.16 57.30 1vgw n GLU 28 Cb 0.50 -2.18 -0.13 0.00 -0.57 0.00 0.00 31.44 29.06 1vgw n GLU 28 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1vgw s ILE 29 N 0.46 -0.31 0.00 -3.67 1.09 -0.81 -5.01 121.20 112.95 1vgw s ILE 29 Ca 0.80 -0.23 0.00 0.00 -1.10 0.00 0.00 60.65 60.12 1vgw s ILE 29 Cb -0.85 -0.75 0.00 0.00 -1.06 0.00 0.00 42.46 39.80 1vgw s ILE 29 CO 0.45 -0.29 0.00 0.61 -0.10 0.00 0.00 174.94 175.61 1vgw n GLY 30 N 5.31 1.74 0.32 6.18 0.00 -1.26 -3.30 105.19 114.18 1vgw n GLY 30 Ca -0.05 -0.49 0.06 0.00 0.00 0.00 0.00 46.02 45.54 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 7.76 1.46 -3.85 1.61 3.41 -1.26 -5.06 113.62 117.69 1vgw n SER 31 Ca 0.00 -2.74 -0.11 0.00 -0.26 0.00 0.00 58.87 55.76 1vgw n SER 31 Cb 0.00 -0.36 -0.09 0.00 -0.26 0.00 0.00 64.21 63.51 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 -1.82 0.66 0.93 4.33 1.02 -1.21 -5.14 119.74 118.51 1vgw s LYS 32 Ca 0.22 -0.60 -0.12 0.00 0.02 0.00 0.00 55.97 55.49 1vgw s LYS 32 Cb 0.20 0.27 0.15 0.00 -0.52 0.00 0.00 37.83 37.93 1vgw s LYS 32 CO 0.00 -0.18 1.12 0.95 -0.92 0.00 0.00 175.35 176.32 1vgw s THR 33 N -2.40 2.14 0.14 2.17 -4.23 -1.26 -1.92 115.64 110.28 1vgw s THR 33 Ca -0.06 0.05 -0.16 0.00 -1.18 0.00 0.00 61.69 60.33 1vgw s THR 33 Cb -0.02 -2.70 -0.00 0.00 1.34 0.00 0.00 72.50 71.11 1vgw s THR 33 CO -0.03 -0.06 1.75 0.58 -0.54 0.00 0.00 174.62 176.32 1vgw h VAL 34 N -1.59 1.14 -0.17 2.29 2.07 -1.35 -1.86 116.25 116.79 1vgw h VAL 34 Ca -0.51 -0.35 0.04 0.00 0.82 0.00 0.00 66.70 66.69 1vgw h VAL 34 Cb 1.32 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.73 1vgw h VAL 34 CO 0.60 0.14 -0.07 0.25 0.02 0.00 0.00 177.57 178.51 1vgw h LEU 35 N 0.49 -0.25 -1.82 2.57 5.85 -1.10 -0.24 115.31 120.83 1vgw h LEU 35 Ca 0.14 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1vgw h LEU 35 Cb 0.04 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1vgw h LEU 35 CO -0.02 -0.10 0.13 -0.33 -0.34 0.00 0.00 178.44 177.78 1vgw h GLU 36 N -0.05 0.25 -0.48 1.25 5.08 -1.80 0.31 114.58 119.12 1vgw h GLU 36 Ca 0.09 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.34 1vgw h GLU 36 Cb 0.19 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1vgw h GLU 36 CO -0.20 0.16 -0.07 0.45 -1.00 0.00 0.00 179.01 178.35 1vgw h HIS 37 N 0.25 1.00 -0.54 4.33 3.86 -0.37 -2.76 115.15 120.93 1vgw h HIS 37 Ca 0.07 -0.20 -0.12 0.00 -1.16 0.00 0.00 60.37 58.96 1vgw h HIS 37 Cb -0.02 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.18 1vgw h HIS 37 CO -0.00 0.96 -0.12 0.28 0.86 0.00 0.00 177.93 179.92 1vgw h VAL 38 N 0.76 1.27 -0.27 2.45 2.07 0.12 -3.07 116.25 119.57 1vgw h VAL 38 Ca 0.13 -1.28 -0.04 0.00 0.82 0.00 0.00 66.70 66.33 1vgw h VAL 38 Cb 0.61 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1vgw h VAL 38 CO 0.04 0.45 -0.02 -0.07 0.02 0.00 0.00 177.57 177.99 1vgw h LEU 39 N 0.90 0.38 -1.30 2.57 3.38 -1.01 -2.49 115.31 117.75 1vgw h LEU 39 Ca 0.14 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.06 1vgw h LEU 39 Cb 0.69 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.30 1vgw h LEU 39 CO 0.05 0.46 0.48 1.23 0.09 0.00 0.00 178.44 180.75 1vgw h GLY 40 N 0.75 1.01 1.18 0.83 0.00 -1.39 -0.78 103.07 104.67 1vgw h GLY 40 Ca 0.09 -0.37 -0.14 0.00 0.00 0.00 0.00 47.33 46.91 1vgw h GLY 40 CO 0.01 0.35 -0.27 -2.22 0.00 0.00 0.00 176.54 174.41 1vgw h ILE 41 N 0.95 1.27 0.13 2.60 2.04 -1.42 -3.02 117.51 120.07 1vgw h ILE 41 Ca 0.27 -1.44 -0.19 0.00 1.00 0.00 0.00 64.86 64.51 1vgw h ILE 41 Cb -0.07 1.23 0.02 0.00 -0.74 0.00 0.00 36.82 37.26 1vgw h ILE 41 CO -0.06 0.49 -0.83 -0.26 0.00 0.00 0.00 178.15 177.48 1vgw h PHE 42 N 0.79 0.52 -0.08 1.37 0.04 -1.52 -3.26 116.94 114.79 1vgw h PHE 42 Ca 0.09 -0.38 0.02 0.00 2.80 0.00 0.00 57.97 60.51 1vgw h PHE 42 Cb 0.84 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.97 1vgw h PHE 42 CO 0.05 1.32 0.08 0.93 -0.60 0.00 0.00 178.31 180.09 1vgw h GLU 43 N -0.39 0.00 -0.02 1.51 4.39 -1.25 -1.00 114.58 117.82 1vgw h GLU 43 Ca -0.15 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.55 1vgw h GLU 43 Cb 1.63 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.28 1vgw h GLU 43 CO 0.14 0.00 -0.05 2.89 -1.16 0.00 0.00 179.01 180.83 1vgw n ARG 44 N -4.01 1.81 -3.26 2.33 1.85 -1.14 -4.87 116.66 109.37 1vgw n ARG 44 Ca -0.01 -1.27 -0.40 0.00 -1.00 0.00 0.00 57.85 55.17 1vgw n ARG 44 Cb 0.18 -1.47 -0.08 0.00 -1.05 0.00 0.00 32.46 30.04 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 -2.07 3.25 0.33 2.89 2.46 -0.38 -4.98 115.29 116.80 1vgw s HIS 45 Ca 0.32 0.54 0.07 0.00 0.47 0.00 0.00 55.06 56.46 1vgw s HIS 45 Cb 0.20 -2.74 0.75 0.00 -0.13 0.00 0.00 32.58 30.67 1vgw s HIS 45 CO 0.35 -0.32 1.85 0.93 -2.47 0.00 0.00 174.74 175.09 1vgw h GLU 46 N 8.11 0.75 0.00 2.88 5.08 -1.89 -2.43 114.58 127.08 1vgw h GLU 46 Ca -0.29 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 1vgw h GLU 46 Cb 1.14 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.22 1vgw h GLU 46 CO 0.71 0.49 0.00 0.00 -1.00 0.00 0.00 179.01 179.22 1vgw n ALA 47 N -2.40 2.45 -2.70 3.43 0.00 -1.26 -4.75 120.51 115.28 1vgw n ALA 47 Ca 0.18 -0.14 -0.37 0.00 0.00 0.00 0.00 53.44 53.11 1vgw n ALA 47 Cb 0.46 -1.48 -0.07 0.00 0.00 0.00 0.00 19.45 18.36 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 -2.55 5.25 -0.19 0.00 1.01 -0.92 -4.51 120.40 118.50 1vgw s VAL 48 Ca 0.28 0.66 0.20 0.00 0.00 0.00 0.00 61.98 63.12 1vgw s VAL 48 Cb 0.20 -3.67 -0.29 0.00 0.00 0.00 0.00 36.38 32.61 1vgw s VAL 48 CO 0.44 0.42 0.51 0.47 0.00 0.00 0.00 175.10 176.94 1vgw n ASP 49 N 3.25 0.49 -3.48 3.32 8.00 0.17 -4.93 116.55 123.36 1vgw n ASP 49 Ca -0.12 -0.18 -0.14 0.00 0.71 0.00 0.00 54.79 55.07 1vgw n ASP 49 Cb 0.52 1.75 -0.04 0.00 -0.02 0.00 0.00 41.12 43.33 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 -4.12 -0.56 -0.03 0.64 2.96 -1.22 -5.04 118.68 111.31 1vgw s LEU 50 Ca -0.05 0.30 0.00 0.00 -0.22 0.00 0.00 54.13 54.17 1vgw s LEU 50 Cb 0.13 2.43 0.03 0.00 0.50 0.00 0.00 46.19 49.28 1vgw s LEU 50 CO 0.83 -0.73 0.00 -0.89 -1.32 0.00 0.00 176.35 174.24 1vgw s THR 51 N -2.47 0.16 0.01 3.68 2.01 -1.26 -1.45 115.64 116.32 1vgw s THR 51 Ca -0.03 0.11 0.06 0.00 0.31 0.00 0.00 61.69 62.14 1vgw s THR 51 Cb -0.01 -0.27 -0.02 0.00 0.01 0.00 0.00 72.50 72.22 1vgw s THR 51 CO -0.03 0.15 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.18 1vgw s VAL 52 N 1.11 1.46 -0.10 3.82 1.01 -0.34 -1.64 120.40 125.72 1vgw s VAL 52 Ca -0.09 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 60.99 1vgw s VAL 52 Cb -0.13 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.01 1vgw s VAL 52 CO -0.02 0.29 -0.17 -0.69 0.00 0.00 0.00 175.10 174.51 1vgw s VAL 53 N -0.59 1.59 -0.26 2.92 1.01 -0.51 -1.61 120.40 122.95 1vgw s VAL 53 Ca 0.06 -0.72 -0.05 0.00 0.00 0.00 0.00 61.98 61.27 1vgw s VAL 53 Cb -0.08 -1.43 0.00 0.00 0.00 0.00 0.00 36.38 34.88 1vgw s VAL 53 CO 0.00 0.46 0.03 -0.69 0.00 0.00 0.00 175.10 174.90 1vgw s VAL 54 N 0.77 3.72 0.49 2.92 1.01 -0.58 -1.36 120.40 127.37 1vgw s VAL 54 Ca -0.11 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 61.30 1vgw s VAL 54 Cb -0.16 -2.84 -0.00 0.00 0.00 0.00 0.00 36.38 33.38 1vgw s VAL 54 CO 0.02 0.21 0.22 0.68 0.00 0.00 0.00 175.10 176.23 1vgw s VAL 55 N 1.49 1.71 0.53 2.92 -7.23 -0.29 -1.07 120.40 118.46 1vgw s VAL 55 Ca 0.03 -1.70 -0.17 0.00 -1.81 0.00 0.00 61.98 58.34 1vgw s VAL 55 Cb -0.16 -2.41 -0.07 0.00 0.56 0.00 0.00 36.38 34.30 1vgw s VAL 55 CO 0.00 0.00 1.01 -0.94 -0.31 0.00 0.00 175.10 174.86 1vgw s SER 56 N -4.05 6.40 0.54 4.85 1.04 -1.26 -1.70 113.70 119.52 1vgw s SER 56 Ca 0.28 1.66 0.34 0.00 0.48 0.00 0.00 55.95 58.71 1vgw s SER 56 Cb 0.01 -2.52 1.45 0.00 0.10 0.00 0.00 66.02 65.06 1vgw s SER 56 CO 0.16 -0.74 2.00 1.55 0.98 0.00 0.00 173.24 177.19 1vgw h PRO 57 N 0.86 0.00 0.00 4.02 0.13 -1.90 -2.18 132.00 132.93 1vgw h PRO 57 Ca -0.47 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.48 1vgw h PRO 57 Cb 1.20 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.30 1vgw h PRO 57 CO 0.60 0.00 -0.86 0.93 -0.23 0.00 0.00 178.00 178.44 1vgw h GLU 58 N 0.00 0.00 -6.43 0.86 3.07 -1.94 -3.46 114.58 106.68 1vgw h GLU 58 Ca 0.00 0.00 -0.62 0.00 -0.50 0.00 0.00 59.36 58.24 1vgw h GLU 58 Cb 0.45 0.00 0.07 0.00 -0.84 0.00 0.00 28.75 28.43 1vgw h GLU 58 CO 0.00 0.86 0.56 -3.47 -1.40 0.00 0.00 179.01 175.56 1vgw n ASP 59 N -3.38 2.29 -0.04 1.42 4.64 -0.82 -4.91 116.55 115.74 1vgw n ASP 59 Ca 0.00 1.12 -0.05 0.00 -1.38 0.00 0.00 54.79 54.48 1vgw n ASP 59 Cb 0.86 -1.32 -0.05 0.00 -1.04 0.00 0.00 41.12 39.57 1vgw n ASP 59 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 1vgw n THR 60 N 2.45 0.54 0.30 5.18 -2.24 -1.26 -4.58 114.28 114.67 1vgw n THR 60 Ca 0.16 -0.26 0.18 0.00 -2.27 0.00 0.00 64.05 61.86 1vgw n THR 60 Cb 0.26 -0.82 0.97 0.00 -2.10 0.00 0.00 70.33 68.63 1vgw n THR 60 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1vgw h PHE 61 N 0.00 0.00 -0.77 4.78 3.57 -2.00 -1.00 116.94 121.52 1vgw h PHE 61 Ca -0.21 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.38 1vgw h PHE 61 Cb 1.40 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 40.09 1vgw h PHE 61 CO 0.01 0.03 0.51 0.00 -2.23 0.00 0.00 178.31 176.62 1vgw h ALA 62 N 1.97 1.75 -0.87 2.41 0.00 -1.99 -1.01 119.26 121.52 1vgw h ALA 62 Ca -0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1vgw h ALA 62 Cb 0.17 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1vgw h ALA 62 CO 0.00 0.10 0.57 -0.44 0.00 0.00 0.00 179.25 179.48 1vgw h ASP 63 N 0.73 0.95 -0.54 0.00 5.19 -1.47 -1.01 116.42 120.27 1vgw h ASP 63 Ca 0.35 -0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.69 1vgw h ASP 63 Cb 0.40 -0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.66 1vgw h ASP 63 CO -0.13 0.66 0.11 0.11 -3.12 0.00 0.00 179.24 176.87 1vgw h LYS 64 N 1.11 0.92 -0.86 3.56 1.57 -1.34 -2.39 116.57 119.14 1vgw h LYS 64 Ca 0.34 -0.21 0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1vgw h LYS 64 Cb -0.02 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.12 1vgw h LYS 64 CO -0.11 0.84 0.57 0.28 -0.57 0.00 0.00 179.45 180.46 1vgw h VAL 65 N 0.88 1.23 -0.98 0.50 2.07 -0.90 -2.45 116.25 116.60 1vgw h VAL 65 Ca 0.18 -0.42 0.06 0.00 0.82 0.00 0.00 66.70 67.34 1vgw h VAL 65 Cb 0.36 -0.04 -0.06 0.00 -1.52 0.00 0.00 31.29 30.02 1vgw h VAL 65 CO 0.00 0.22 0.63 -0.61 0.02 0.00 0.00 177.57 177.84 1vgw h GLN 66 N 1.18 1.11 0.00 1.57 5.75 -0.78 -0.90 115.11 123.04 1vgw h GLN 66 Ca 0.32 -0.07 -0.07 0.00 -0.15 0.00 0.00 58.65 58.68 1vgw h GLN 66 Cb -0.12 -0.25 -0.01 0.00 1.07 0.00 0.00 27.48 28.17 1vgw h GLN 66 CO -0.07 0.73 -0.31 1.15 -2.65 0.00 0.00 178.83 177.69 1vgw h THR 67 N 1.14 0.76 0.00 2.39 2.02 -1.27 -2.98 112.91 114.97 1vgw h THR 67 Ca 0.42 -1.33 -0.06 0.00 0.77 0.00 0.00 66.41 66.20 1vgw h THR 67 Cb 0.16 1.84 -0.01 0.00 -1.74 0.00 0.00 68.15 68.41 1vgw h THR 67 CO -0.16 0.30 -0.61 0.00 0.37 0.00 0.00 175.52 175.43 1vgw h ALA 68 N 1.69 0.73 -2.73 6.16 0.00 -1.00 -3.40 119.26 120.71 1vgw h ALA 68 Ca -0.00 -0.28 -0.61 0.00 0.00 0.00 0.00 54.91 54.02 1vgw h ALA 68 Cb 0.82 0.02 -0.40 0.00 0.00 0.00 0.00 17.79 18.22 1vgw h ALA 68 CO 0.04 0.35 -0.74 1.19 0.00 0.00 0.00 179.25 180.09 1vgw n PHE 69 N -3.01 1.63 -0.02 0.00 3.01 -0.93 -4.99 117.46 113.16 1vgw n PHE 69 Ca 0.00 -3.91 0.08 0.00 1.01 0.00 0.00 57.45 54.63 1vgw n PHE 69 Cb 0.65 -0.29 0.47 0.00 -0.01 0.00 0.00 39.48 40.31 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 5.36 0.44 0.00 -1.08 0.13 -1.76 -1.96 132.00 133.12 1vgw h PRO 70 Ca 0.19 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1vgw h PRO 70 Cb 0.81 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1vgw h PRO 70 CO 0.59 0.29 -0.12 1.96 -0.23 0.00 0.00 178.00 180.49 1vgw h GLN 71 N 0.45 0.00 -6.92 0.86 4.20 -1.94 -3.45 115.11 108.31 1vgw h GLN 71 Ca 0.19 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.40 1vgw h GLN 71 Cb 0.20 0.00 0.04 0.00 0.30 0.00 0.00 27.48 28.02 1vgw h GLN 71 CO -0.05 0.00 0.49 0.08 -0.67 0.00 0.00 178.83 178.68 1vgw s VAL 72 N -3.18 3.30 -0.27 -0.54 1.01 -0.74 -4.77 120.40 115.22 1vgw s VAL 72 Ca 0.08 1.13 -0.10 0.00 0.00 0.00 0.00 61.98 63.08 1vgw s VAL 72 Cb 0.09 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.77 1vgw s VAL 72 CO 0.66 0.13 0.17 -0.13 0.00 0.00 0.00 175.10 175.92 1vgw s ARG 73 N -2.15 3.94 -0.48 2.72 0.52 -0.65 -5.00 118.95 117.85 1vgw s ARG 73 Ca 0.54 -0.33 -0.13 0.00 -0.52 0.00 0.00 55.73 55.30 1vgw s ARG 73 Cb -0.30 -3.59 0.10 0.00 0.52 0.00 0.00 34.95 31.68 1vgw s ARG 73 CO 0.38 -0.13 0.39 0.08 0.02 0.00 0.00 175.30 176.04 1vgw s VAL 74 N 1.58 4.78 0.02 3.52 1.01 -1.26 -1.42 120.40 128.63 1vgw s VAL 74 Ca 0.07 -1.42 -0.07 0.00 0.00 0.00 0.00 61.98 60.56 1vgw s VAL 74 Cb -0.15 -4.00 -0.05 0.00 0.00 0.00 0.00 36.38 32.18 1vgw s VAL 74 CO 0.09 -0.69 0.28 0.26 0.00 0.00 0.00 175.10 175.03 1vgw s TRP 75 N 1.52 3.57 -0.71 5.22 0.51 -0.47 -4.98 118.94 123.60 1vgw s TRP 75 Ca 0.04 0.58 0.02 0.00 -2.12 0.00 0.00 56.10 54.62 1vgw s TRP 75 Cb -0.26 -1.99 0.35 0.00 -0.81 0.00 0.00 33.47 30.76 1vgw s TRP 75 CO 0.03 0.60 1.38 1.63 -0.51 0.00 0.00 176.95 180.09 1vgw n LYS 76 N 1.07 3.81 -2.53 4.98 5.02 -1.26 -1.13 118.16 128.12 1vgw n LYS 76 Ca -0.11 -4.54 -0.16 0.00 -2.02 0.00 0.00 58.31 51.48 1vgw n LYS 76 Cb 0.53 -2.31 0.02 0.00 -0.02 0.00 0.00 35.03 33.25 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 -0.29 3.08 -4.71 4.39 6.94 -1.16 -4.21 115.26 119.30 1vgw n ASN 77 Ca 0.40 -3.10 -0.31 0.00 -0.02 0.00 0.00 54.58 51.55 1vgw n ASN 77 Cb 0.39 -0.47 0.13 0.00 -2.36 0.00 0.00 39.78 37.47 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 -3.44 1.72 0.00 4.83 0.00 -0.69 -4.81 107.32 104.94 1vgw s GLY 78 Ca 0.38 0.49 0.00 0.00 0.00 0.00 0.00 44.72 45.59 1vgw s GLY 78 CO -0.05 0.88 0.00 0.61 0.00 0.00 0.00 173.10 174.54 1vgw n GLY 79 N -0.31 2.74 0.04 0.20 0.00 -1.26 -4.88 105.19 101.72 1vgw n GLY 79 Ca 0.11 -2.10 0.12 0.00 0.00 0.00 0.00 46.02 44.15 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 -0.43 0.18 -4.05 1.61 6.02 -1.26 -4.82 117.38 114.63 1vgw n GLN 80 Ca 0.00 0.05 -0.09 0.00 -0.01 0.00 0.00 57.00 56.95 1vgw n GLN 80 Cb 0.00 -1.61 -0.09 0.00 1.02 0.00 0.00 30.24 29.56 1vgw n GLN 80 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1vgw s THR 81 N -3.10 0.12 0.24 5.09 -4.23 -1.26 -5.05 115.64 107.46 1vgw s THR 81 Ca 0.08 -1.65 -0.05 0.00 -1.18 0.00 0.00 61.69 58.90 1vgw s THR 81 Cb 0.15 -1.79 0.21 0.00 1.34 0.00 0.00 72.50 72.41 1vgw s THR 81 CO 0.71 -0.55 1.83 -0.09 -0.54 0.00 0.00 174.62 175.97 1vgw h ARG 82 N 2.82 0.84 -0.68 3.99 2.43 -1.96 -1.44 114.38 120.37 1vgw h ARG 82 Ca -0.34 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 58.78 1vgw h ARG 82 Cb 1.20 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.52 1vgw h ARG 82 CO 0.57 0.55 0.43 0.00 -1.51 0.00 0.00 179.97 180.01 1vgw h ALA 83 N 1.44 0.87 -0.24 2.80 0.00 -1.97 -0.34 119.26 121.82 1vgw h ALA 83 Ca 0.39 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.12 1vgw h ALA 83 Cb 0.30 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1vgw h ALA 83 CO -0.22 0.33 -0.32 1.49 0.00 0.00 0.00 179.25 180.53 1vgw h GLU 84 N 0.93 0.51 -0.12 0.00 4.81 -1.78 -2.12 114.58 116.81 1vgw h GLU 84 Ca 0.25 -0.22 -0.22 0.00 -0.13 0.00 0.00 59.36 59.04 1vgw h GLU 84 Cb -0.06 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.31 1vgw h GLU 84 CO -0.05 0.77 -0.79 0.00 -0.73 0.00 0.00 179.01 178.20 1vgw h THR 85 N 0.43 1.31 -0.66 0.32 1.03 -0.45 -2.08 112.91 112.81 1vgw h THR 85 Ca 0.05 -2.05 -0.01 0.00 -0.01 0.00 0.00 66.41 64.39 1vgw h THR 85 Cb 0.77 2.06 -0.03 0.00 -1.07 0.00 0.00 68.15 69.88 1vgw h THR 85 CO 0.06 0.64 0.39 0.58 -0.01 0.00 0.00 175.52 177.18 1vgw h VAL 86 N 0.45 1.20 -0.48 0.00 2.07 -1.02 -1.01 116.25 117.46 1vgw h VAL 86 Ca -0.05 -0.45 0.02 0.00 0.82 0.00 0.00 66.70 67.04 1vgw h VAL 86 Cb 1.41 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 1vgw h VAL 86 CO 0.16 0.21 0.28 -0.09 0.02 0.00 0.00 177.57 178.14 1vgw h ARG 87 N 0.90 0.55 -0.46 1.57 2.43 -1.32 -1.47 114.38 116.57 1vgw h ARG 87 Ca 0.24 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.26 1vgw h ARG 87 Cb -0.01 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 1vgw h ARG 87 CO -0.04 0.36 -0.16 -0.91 -1.51 0.00 0.00 179.97 177.72 1vgw h ASN 88 N 0.57 0.89 0.20 -3.80 2.35 -0.98 -1.44 115.58 113.37 1vgw h ASN 88 Ca 0.19 -0.30 -0.01 0.00 -0.55 0.00 0.00 56.30 55.63 1vgw h ASN 88 Cb 0.02 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.15 1vgw h ASN 88 CO -0.09 1.04 -0.10 1.23 -1.65 0.00 0.00 177.43 177.86 1vgw h GLY 89 N 0.95 -0.29 0.54 2.83 0.00 -0.65 -0.91 103.07 105.54 1vgw h GLY 89 Ca 0.12 0.11 0.07 0.00 0.00 0.00 0.00 47.33 47.62 1vgw h GLY 89 CO 0.05 -0.10 0.22 -2.08 0.00 0.00 0.00 176.54 174.63 1vgw h VAL 90 N -0.51 0.85 -0.27 4.60 2.07 -1.27 0.49 116.25 122.20 1vgw h VAL 90 Ca -0.03 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1vgw h VAL 90 Cb 0.38 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1vgw h VAL 90 CO 0.05 0.08 0.18 0.00 0.02 0.00 0.00 177.57 177.89 1vgw h ALA 91 N 1.35 0.35 -0.38 1.67 0.00 -1.20 -2.44 119.26 118.60 1vgw h ALA 91 Ca 0.26 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1vgw h ALA 91 Cb 0.26 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1vgw h ALA 91 CO -0.24 -0.18 -0.01 -0.22 0.00 0.00 0.00 179.25 178.60 1vgw h LYS 92 N 0.37 0.62 -0.67 0.00 3.64 -0.84 0.41 116.57 120.10 1vgw h LYS 92 Ca 0.10 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1vgw h LYS 92 Cb -0.04 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.67 1vgw h LYS 92 CO -0.02 0.65 0.39 -0.07 -2.27 0.00 0.00 179.45 178.12 1vgw h LEU 93 N 0.58 0.80 0.04 5.20 3.38 -0.43 0.27 115.31 125.15 1vgw h LEU 93 Ca 0.12 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1vgw h LEU 93 Cb 0.39 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1vgw h LEU 93 CO 0.01 0.63 -0.02 -0.07 0.09 0.00 0.00 178.44 179.09 1vgw h LEU 94 N 0.92 -0.04 -1.15 1.67 -0.00 -1.28 -1.32 115.31 114.11 1vgw h LEU 94 Ca 0.24 -0.63 0.12 0.00 -0.00 0.00 0.00 57.88 57.61 1vgw h LEU 94 Cb -0.01 0.01 -0.07 0.00 -0.00 0.00 0.00 40.66 40.58 1vgw h LEU 94 CO -0.04 0.72 0.60 -0.08 -0.00 0.00 0.00 178.44 179.63 1vgw h GLU 95 N -0.92 0.85 -0.07 1.13 4.22 -0.77 -0.19 114.58 118.84 1vgw h GLU 95 Ca -0.01 -0.05 -0.12 0.00 0.08 0.00 0.00 59.36 59.26 1vgw h GLU 95 Cb 0.67 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1vgw h GLU 95 CO 0.01 0.56 -0.51 1.15 -2.18 0.00 0.00 179.01 178.04 1vgw h THR 96 N 0.88 1.36 0.00 0.32 2.02 -1.06 -3.47 112.91 112.95 1vgw h THR 96 Ca 0.46 -1.76 0.00 0.00 0.77 0.00 0.00 66.41 65.87 1vgw h THR 96 Cb 0.53 1.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 1vgw h THR 96 CO -0.22 0.52 0.00 0.61 0.37 0.00 0.00 175.52 176.80 1vgw n GLY 97 N 0.02 0.60 0.16 2.16 0.00 -0.08 -4.95 105.19 103.10 1vgw n GLY 97 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.99 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 0.06 -8.82 0.99 3.38 -1.67 -3.43 115.31 105.81 1vgw h LEU 98 Ca 0.00 -0.03 -0.69 0.00 0.09 0.00 0.00 57.88 57.25 1vgw h LEU 98 Cb 0.00 -0.02 -0.25 0.00 0.09 0.00 0.00 40.66 40.48 1vgw h LEU 98 CO 0.00 0.58 -0.82 0.00 0.09 0.00 0.00 178.44 178.28 1vgw s ALA 99 N -3.85 2.47 0.45 1.53 0.00 -0.55 -5.03 121.76 116.78 1vgw s ALA 99 Ca -0.02 -1.10 0.01 0.00 0.00 0.00 0.00 51.96 50.84 1vgw s ALA 99 Cb 0.13 -0.75 -0.00 0.00 0.00 0.00 0.00 23.12 22.50 1vgw s ALA 99 CO 0.76 0.55 0.66 0.00 0.00 0.00 0.00 175.76 177.73 1vgw s ALA 100 N -0.75 3.78 0.38 0.00 0.00 -1.26 -4.48 121.76 119.43 1vgw s ALA 100 Ca 0.12 -1.08 0.16 0.00 0.00 0.00 0.00 51.96 51.17 1vgw s ALA 100 Cb -0.10 -2.12 1.05 0.00 0.00 0.00 0.00 23.12 21.95 1vgw s ALA 100 CO 0.01 -0.36 1.78 0.93 0.00 0.00 0.00 175.76 178.12 1vgw h GLU 101 N 0.42 0.43 -0.02 0.00 4.39 -1.99 -1.02 114.58 116.80 1vgw h GLU 101 Ca -0.46 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.21 1vgw h GLU 101 Cb 1.25 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 1vgw h GLU 101 CO 0.57 0.29 -0.14 0.25 -1.16 0.00 0.00 179.01 178.82 1vgw n THR 102 N -4.65 0.00 -1.80 1.13 -2.24 -1.26 -1.66 114.28 103.80 1vgw n THR 102 Ca 0.25 -0.27 -0.32 0.00 -2.27 0.00 0.00 64.05 61.43 1vgw n THR 102 Cb 0.82 0.81 0.04 0.00 -2.10 0.00 0.00 70.33 69.90 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 -2.20 5.35 0.02 3.42 1.01 -0.39 -4.81 116.67 119.07 1vgw s ASP 103 Ca 0.29 1.86 -0.21 0.00 0.71 0.00 0.00 52.55 55.20 1vgw s ASP 103 Cb 0.20 -2.53 -0.06 0.00 1.01 0.00 0.00 42.92 41.54 1vgw s ASP 103 CO 0.41 -1.46 0.62 0.20 0.21 0.00 0.00 175.17 175.15 1vgw s ASN 104 N -2.90 7.04 -0.28 0.27 0.01 0.06 -1.26 114.94 117.88 1vgw s ASN 104 Ca 0.64 1.23 -0.04 0.00 -0.71 0.00 0.00 52.86 53.98 1vgw s ASN 104 Cb -0.18 -2.38 0.03 0.00 0.41 0.00 0.00 41.25 39.13 1vgw s ASN 104 CO 0.43 0.13 0.02 -0.63 -1.51 0.00 0.00 177.10 175.53 1vgw s ILE 105 N -0.37 3.37 -0.54 0.60 -1.09 0.91 -1.09 121.20 122.99 1vgw s ILE 105 Ca 0.32 -0.99 -0.19 0.00 -2.23 0.00 0.00 60.65 57.56 1vgw s ILE 105 Cb -0.19 -2.78 0.08 0.00 -1.58 0.00 0.00 42.46 37.99 1vgw s ILE 105 CO 0.19 0.06 0.63 -0.76 -1.23 0.00 0.00 174.94 173.82 1vgw s LEU 106 N 1.38 5.25 -0.44 2.97 1.02 0.37 -2.14 118.68 127.09 1vgw s LEU 106 Ca -0.00 -1.19 -0.26 0.00 0.02 0.00 0.00 54.13 52.69 1vgw s LEU 106 Cb -0.18 -2.35 0.02 0.00 0.02 0.00 0.00 46.19 43.70 1vgw s LEU 106 CO -0.01 -0.95 0.97 -0.69 0.02 0.00 0.00 176.35 175.69 1vgw s VAL 107 N 2.51 4.45 -0.03 -1.59 1.01 -0.65 -0.28 120.40 125.83 1vgw s VAL 107 Ca 0.12 0.95 0.07 0.00 0.00 0.00 0.00 61.98 63.12 1vgw s VAL 107 Cb -0.22 -4.44 -0.02 0.00 0.00 0.00 0.00 36.38 31.70 1vgw s VAL 107 CO 0.09 -0.79 -0.24 -2.28 0.00 0.00 0.00 175.10 171.87 1vgw s HIS 108 N 3.82 2.19 0.21 5.22 5.04 -0.23 -2.12 115.29 129.41 1vgw s HIS 108 Ca 0.39 -0.47 -0.31 0.00 -1.54 0.00 0.00 55.06 53.13 1vgw s HIS 108 Cb -0.10 -1.42 -0.10 0.00 0.04 0.00 0.00 32.58 31.00 1vgw s HIS 108 CO 0.25 -0.08 1.49 -0.51 -2.34 0.00 0.00 174.74 173.56 1vgw s ASP 109 N -0.46 6.63 0.60 9.88 -0.00 -1.26 -4.09 116.67 127.98 1vgw s ASP 109 Ca 0.06 2.63 0.31 0.00 -0.00 0.00 0.00 52.55 55.55 1vgw s ASP 109 Cb -0.10 -2.61 1.79 0.00 -0.00 0.00 0.00 42.92 42.00 1vgw s ASP 109 CO 0.00 -0.75 2.16 0.00 -0.00 0.00 0.00 175.17 176.58 1vgw h ALA 110 N 5.87 1.61 -0.33 5.23 0.00 -1.93 -2.71 119.26 127.00 1vgw h ALA 110 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1vgw h ALA 110 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1vgw h ALA 110 CO 0.84 -0.19 0.00 0.00 0.00 0.00 0.00 179.25 179.90 1vgw n ALA 111 N -2.27 2.45 -3.33 0.00 0.00 -1.26 -4.38 120.51 111.72 1vgw n ALA 111 Ca -0.00 -0.86 -0.46 0.00 0.00 0.00 0.00 53.44 52.12 1vgw n ALA 111 Cb 0.24 -0.94 -0.01 0.00 0.00 0.00 0.00 19.45 18.75 1vgw n ALA 111 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1vgw s ARG 112 N -1.57 4.03 0.00 0.00 0.52 -1.02 -2.38 118.95 118.53 1vgw s ARG 112 Ca 0.37 -3.00 0.17 0.00 -0.52 0.00 0.00 55.73 52.75 1vgw s ARG 112 Cb 0.21 -4.53 0.48 0.00 0.52 0.00 0.00 34.95 31.64 1vgw s ARG 112 CO 0.30 -1.26 1.40 0.00 0.02 0.00 0.00 175.30 175.76 1vgw s LEU 115 N -2.76 3.65 0.23 0.00 2.96 -1.26 -4.22 118.68 117.27 1vgw s LEU 115 Ca 0.33 1.90 -0.32 0.00 -0.22 0.00 0.00 54.13 55.82 1vgw s LEU 115 Cb 0.31 -3.52 -0.12 0.00 0.50 0.00 0.00 46.19 43.36 1vgw s LEU 115 CO -0.02 -1.72 1.68 -0.81 -1.32 0.00 0.00 176.35 174.16 1vgw n PRO 116 N 8.42 2.72 -0.34 0.98 -0.04 -1.26 -4.89 135.00 140.60 1vgw n PRO 116 Ca 0.26 0.98 0.17 0.00 -0.04 0.00 0.00 63.50 64.87 1vgw n PRO 116 Cb 0.45 -2.80 0.40 0.00 -0.04 0.00 0.00 33.50 31.50 1vgw n PRO 116 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1vgw h SER 117 N 6.14 0.65 -0.28 3.54 0.87 -1.95 0.69 113.55 123.21 1vgw h SER 117 Ca -0.44 0.11 -0.03 0.00 -1.23 0.00 0.00 61.79 60.20 1vgw h SER 117 Cb 1.21 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.15 1vgw h SER 117 CO 0.91 0.16 0.09 -0.08 -0.53 0.00 0.00 176.83 177.37 1vgw h GLU 118 N 0.59 0.52 -0.26 2.24 4.81 -2.00 -2.39 114.58 118.09 1vgw h GLU 118 Ca 0.61 -0.08 -0.13 0.00 -0.13 0.00 0.00 59.36 59.62 1vgw h GLU 118 Cb 1.18 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 1vgw h GLU 118 CO -0.40 0.48 -0.39 0.00 -0.73 0.00 0.00 179.01 177.98 1vgw h ALA 119 N 1.59 0.85 -0.33 2.92 0.00 0.02 -2.42 119.26 121.90 1vgw h ALA 119 Ca 0.12 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 1vgw h ALA 119 Cb 0.20 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1vgw h ALA 119 CO -0.00 0.64 0.01 1.25 0.00 0.00 0.00 179.25 181.15 1vgw h LEU 120 N 0.49 0.55 -0.13 0.00 5.85 -1.09 -2.54 115.31 118.45 1vgw h LEU 120 Ca 0.05 -0.30 0.03 0.00 0.84 0.00 0.00 57.88 58.49 1vgw h LEU 120 Cb 0.89 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 1vgw h LEU 120 CO 0.08 0.71 -0.03 0.00 -0.34 0.00 0.00 178.44 178.86 1vgw h ALA 121 N 0.86 0.08 -0.62 1.25 0.00 -1.31 -1.56 119.26 117.96 1vgw h ALA 121 Ca 0.09 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.12 1vgw h ALA 121 Cb 0.42 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1vgw h ALA 121 CO 0.01 -0.49 0.32 0.00 0.00 0.00 0.00 179.25 179.10 1vgw h ARG 122 N -0.00 0.58 -0.46 0.00 3.08 -1.40 -0.19 114.38 115.98 1vgw h ARG 122 Ca 0.06 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1vgw h ARG 122 Cb 0.10 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1vgw h ARG 122 CO -0.13 0.38 0.27 1.25 -1.07 0.00 0.00 179.97 180.67 1vgw h LEU 123 N 0.59 0.55 -0.44 3.04 5.85 -1.00 -0.14 115.31 123.75 1vgw h LEU 123 Ca 0.28 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.90 1vgw h LEU 123 Cb 0.21 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1vgw h LEU 123 CO -0.20 0.45 0.13 0.40 -0.34 0.00 0.00 178.44 178.88 1vgw h ILE 124 N 0.60 1.23 -0.37 4.05 2.04 -0.92 -0.37 117.51 123.78 1vgw h ILE 124 Ca 0.16 -0.76 -0.04 0.00 1.00 0.00 0.00 64.86 65.23 1vgw h ILE 124 Cb 0.00 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1vgw h ILE 124 CO -0.03 0.27 0.09 -0.08 0.00 0.00 0.00 178.15 178.40 1vgw h GLU 125 N 0.58 0.59 0.01 2.37 4.57 -0.83 0.38 114.58 122.24 1vgw h GLU 125 Ca 0.14 -0.14 -0.18 0.00 -1.18 0.00 0.00 59.36 58.00 1vgw h GLU 125 Cb 0.28 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 1vgw h GLU 125 CO -0.00 0.63 -0.97 1.96 -1.18 0.00 0.00 179.01 179.45 1vgw h GLN 126 N 0.44 0.02 0.00 1.92 4.20 -1.05 -3.38 115.11 117.26 1vgw h GLN 126 Ca 0.12 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.74 1vgw h GLN 126 Cb 0.30 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1vgw h GLN 126 CO 0.00 1.02 -0.80 0.00 -0.67 0.00 0.00 178.83 178.38 1vgw h ALA 127 N -0.32 0.66 0.00 3.87 0.00 -1.22 -3.32 119.26 118.93 1vgw h ALA 127 Ca -0.26 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1vgw h ALA 127 Cb 1.28 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 1vgw h ALA 127 CO -0.13 0.24 -0.02 0.78 0.00 0.00 0.00 179.25 180.11 1vgw h GLY 128 N 3.89 0.00 -0.57 0.00 0.00 -0.68 -2.91 103.07 102.80 1vgw h GLY 128 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 1vgw h GLY 128 CO 0.02 0.00 -0.17 0.70 0.00 0.00 0.00 176.54 177.09 1vgw n ASN 129 N -3.40 2.26 -4.15 0.19 3.02 -1.25 -4.97 115.26 106.96 1vgw n ASN 129 Ca -0.02 -3.40 -0.30 0.00 -0.03 0.00 0.00 54.58 50.83 1vgw n ASN 129 Cb 0.12 -0.48 -0.17 0.00 -0.61 0.00 0.00 39.78 38.64 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 -3.02 1.90 0.53 5.41 0.00 -1.10 -5.03 121.76 120.45 1vgw s ALA 130 Ca 0.36 -0.81 0.18 0.00 0.00 0.00 0.00 51.96 51.68 1vgw s ALA 130 Cb 0.32 -0.76 1.33 0.00 0.00 0.00 0.00 23.12 24.01 1vgw s ALA 130 CO -0.00 0.20 2.16 0.00 0.00 0.00 0.00 175.76 178.11 1vgw h ALA 131 N 6.87 1.97 0.00 0.00 0.00 -1.94 -1.85 119.26 124.31 1vgw h ALA 131 Ca -0.24 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1vgw h ALA 131 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1vgw h ALA 131 CO 0.48 -0.02 0.00 -0.85 0.00 0.00 0.00 179.25 178.86 1vgw n GLU 132 N -4.47 0.61 0.00 0.00 0.00 -1.26 -4.78 120.64 110.75 1vgw n GLU 132 Ca -0.03 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.15 1vgw n GLU 132 Cb 0.10 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.04 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 0.94 -1.17 0.00 -1.84 0.00 -0.70 -4.20 105.19 98.23 1vgw n GLY 133 Ca 0.17 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 45.01 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 0.90 3.14 -0.02 0.00 -0.90 -1.08 105.19 107.23 1vgw n GLY 134 Ca 0.00 -0.86 -0.09 0.00 0.00 0.00 0.00 46.02 45.07 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 0.33 0.32 -0.61 -4.36 -0.76 -1.54 121.20 112.58 1vgw s ILE 135 Ca 0.00 -1.88 -0.21 0.00 -0.26 0.00 0.00 60.65 58.30 1vgw s ILE 135 Cb 0.00 -1.74 -0.10 0.00 1.25 0.00 0.00 42.46 41.88 1vgw s ILE 135 CO 0.00 -0.79 0.84 -0.76 0.24 0.00 0.00 174.94 174.47 1vgw s LEU 136 N -3.00 4.19 0.00 0.37 1.43 -1.16 -0.99 118.68 119.53 1vgw s LEU 136 Ca 0.14 1.58 -0.29 0.00 -1.03 0.00 0.00 54.13 54.53 1vgw s LEU 136 Cb 0.07 -4.04 0.10 0.00 0.03 0.00 0.00 46.19 42.36 1vgw s LEU 136 CO -0.05 -0.14 0.89 0.00 0.23 0.00 0.00 176.35 177.29 1vgw s ALA 137 N -1.80 -1.82 0.02 4.21 0.00 0.28 -1.76 121.76 120.90 1vgw s ALA 137 Ca 0.52 0.97 0.05 0.00 0.00 0.00 0.00 51.96 53.50 1vgw s ALA 137 Cb -0.14 0.43 -0.02 0.00 0.00 0.00 0.00 23.12 23.39 1vgw s ALA 137 CO 0.19 -0.71 -0.16 0.14 0.00 0.00 0.00 175.76 175.23 1vgw s VAL 138 N -3.13 1.25 0.47 0.00 -7.23 -0.68 -0.36 120.40 110.72 1vgw s VAL 138 Ca 0.05 -0.89 -0.24 0.00 -1.81 0.00 0.00 61.98 59.09 1vgw s VAL 138 Cb -0.01 -1.09 -0.07 0.00 0.56 0.00 0.00 36.38 35.77 1vgw s VAL 138 CO -0.08 0.18 1.31 -2.84 -0.31 0.00 0.00 175.10 173.36 1vgw s PRO 139 N -0.82 3.61 -0.42 4.82 0.02 -1.26 0.24 135.00 141.19 1vgw s PRO 139 Ca 0.04 2.14 -0.28 0.00 0.02 0.00 0.00 61.00 62.92 1vgw s PRO 139 Cb -0.07 -2.51 0.00 0.00 0.02 0.00 0.00 34.50 31.94 1vgw s PRO 139 CO 0.01 -0.78 1.53 0.08 -0.33 0.00 0.00 177.00 177.51 1vgw s VAL 140 N -1.32 3.75 -0.09 3.83 1.01 -0.56 -4.72 120.40 122.29 1vgw s VAL 140 Ca 0.64 0.74 0.15 0.00 0.00 0.00 0.00 61.98 63.51 1vgw s VAL 140 Cb -0.38 -4.08 -0.13 0.00 0.00 0.00 0.00 36.38 31.79 1vgw s VAL 140 CO 0.47 -0.73 0.92 0.00 0.00 0.00 0.00 175.10 175.75 1vgw h ALA 141 N 11.50 0.66 -2.45 5.51 0.00 -1.91 -3.47 119.26 129.11 1vgw h ALA 141 Ca -0.29 -0.91 -0.52 0.00 0.00 0.00 0.00 54.91 53.19 1vgw h ALA 141 Cb 1.12 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1vgw h ALA 141 CO 1.09 1.03 -0.23 -0.51 0.00 0.00 0.00 179.25 180.63 1vgw s ASP 142 N -6.01 6.40 0.26 0.00 -0.00 -1.26 -5.06 116.67 111.00 1vgw s ASP 142 Ca -0.02 0.55 -0.31 0.00 -0.00 0.00 0.00 52.55 52.77 1vgw s ASP 142 Cb 0.08 -2.07 -0.12 0.00 -0.00 0.00 0.00 42.92 40.81 1vgw s ASP 142 CO 0.80 -0.14 1.59 0.41 -0.00 0.00 0.00 175.17 177.84 1vgw n THR 143 N -0.91 0.73 -3.73 -1.27 -1.04 -1.26 -4.98 114.28 101.82 1vgw n THR 143 Ca -0.03 -0.18 -0.37 0.00 -2.04 0.00 0.00 64.05 61.43 1vgw n THR 143 Cb 0.54 -1.87 -0.06 0.00 -1.82 0.00 0.00 70.33 67.12 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 0.05 4.41 0.07 -4.42 1.43 -1.26 -5.04 118.68 113.92 1vgw s LEU 144 Ca 0.68 0.65 0.06 0.00 -1.03 0.00 0.00 54.13 54.49 1vgw s LEU 144 Cb -0.53 -2.37 -0.03 0.00 0.03 0.00 0.00 46.19 43.29 1vgw s LEU 144 CO 0.45 0.35 -0.17 -0.54 0.23 0.00 0.00 176.35 176.66 1vgw s LYS 145 N -1.22 1.02 -0.12 1.70 -0.14 -1.26 -0.96 119.74 118.76 1vgw s LYS 145 Ca 0.21 -0.96 -0.07 0.00 -1.36 0.00 0.00 55.97 53.79 1vgw s LYS 145 Cb -0.14 -1.11 -0.04 0.00 -1.68 0.00 0.00 37.83 34.86 1vgw s LYS 145 CO 0.10 0.26 0.13 0.50 -0.76 0.00 0.00 175.35 175.59 1vgw s ARG 146 N -1.54 3.44 -0.06 1.68 3.52 0.17 -4.87 118.95 121.29 1vgw s ARG 146 Ca 0.03 -0.15 0.01 0.00 -0.13 0.00 0.00 55.73 55.49 1vgw s ARG 146 Cb -0.09 -3.18 -0.03 0.00 -1.56 0.00 0.00 34.95 30.09 1vgw s ARG 146 CO 0.02 0.76 -0.05 0.00 -0.81 0.00 0.00 175.30 175.23 1vgw s ALA 147 N -0.98 3.07 -0.12 6.12 0.00 -1.26 -0.33 121.76 128.27 1vgw s ALA 147 Ca 0.15 -0.90 -0.13 0.00 0.00 0.00 0.00 51.96 51.08 1vgw s ALA 147 Cb -0.12 -1.28 -0.04 0.00 0.00 0.00 0.00 23.12 21.68 1vgw s ALA 147 CO 0.04 0.59 -0.25 0.39 0.00 0.00 0.00 175.76 176.52 1vgw n GLU 148 N 2.04 0.38 -3.09 0.00 1.02 -0.30 -4.87 120.64 115.82 1vgw n GLU 148 Ca -0.17 0.15 -0.16 0.00 -0.02 0.00 0.00 57.16 56.96 1vgw n GLU 148 Cb 0.53 -1.16 -0.00 0.00 -0.02 0.00 0.00 31.44 30.79 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 -3.97 0.16 0.00 1.62 7.64 -1.26 -4.83 113.62 112.98 1vgw n SER 149 Ca -0.10 -3.16 0.00 0.00 1.01 0.00 0.00 58.87 56.62 1vgw n SER 149 Cb 0.37 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 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 0.30 0.75 3.28 0.23 0.00 -1.26 -5.06 105.19 103.43 1vgw n GLY 150 Ca 0.21 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.52 1.14 -0.02 1.61 -0.21 -1.26 -5.12 119.66 115.28 1vgw s GLN 151 Ca 0.00 -1.34 -0.30 0.00 0.02 0.00 0.00 55.36 53.74 1vgw s GLN 151 Cb 0.00 -1.07 -0.05 0.00 1.00 0.00 0.00 33.01 32.90 1vgw s GLN 151 CO 0.00 0.20 1.35 0.42 -2.12 0.00 0.00 175.29 175.15 1vgw s ILE 152 N -2.23 3.85 -0.60 1.08 1.01 -1.26 -1.15 121.20 121.90 1vgw s ILE 152 Ca 0.13 1.22 0.09 0.00 0.00 0.00 0.00 60.65 62.08 1vgw s ILE 152 Cb -0.04 -3.78 -0.05 0.00 0.01 0.00 0.00 42.46 38.60 1vgw s ILE 152 CO 0.04 -0.01 0.47 -1.54 0.00 0.00 0.00 174.94 173.91 1vgw n SER 153 N 5.37 0.76 -3.63 3.58 3.41 0.56 -4.90 113.62 118.77 1vgw n SER 153 Ca 0.13 -0.88 -0.03 0.00 -0.26 0.00 0.00 58.87 57.82 1vgw n SER 153 Cb 0.44 0.74 -0.04 0.00 -0.26 0.00 0.00 64.21 65.09 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 -1.53 -2.09 -0.24 7.33 0.00 -1.21 -4.98 121.76 119.04 1vgw s ALA 154 Ca 0.05 1.83 -0.11 0.00 0.00 0.00 0.00 51.96 53.74 1vgw s ALA 154 Cb 0.07 -1.30 -0.05 0.00 0.00 0.00 0.00 23.12 21.84 1vgw s ALA 154 CO 0.29 -0.27 0.17 0.99 0.00 0.00 0.00 175.76 176.93 1vgw s THR 155 N -1.12 5.35 -0.16 0.00 2.01 -1.26 -0.66 115.64 119.81 1vgw s THR 155 Ca 0.07 0.20 -0.07 0.00 0.31 0.00 0.00 61.69 62.21 1vgw s THR 155 Cb -0.01 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 1vgw s THR 155 CO -0.06 0.34 0.08 0.54 -0.69 0.00 0.00 174.62 174.82 1vgw s VAL 156 N 1.10 4.93 0.11 3.82 0.11 -0.14 -4.95 120.40 125.38 1vgw s VAL 156 Ca 0.08 0.01 -0.32 0.00 -2.93 0.00 0.00 61.98 58.81 1vgw s VAL 156 Cb -0.14 -3.19 -0.12 0.00 -1.53 0.00 0.00 36.38 31.41 1vgw s VAL 156 CO 0.05 0.51 1.78 -0.67 -3.33 0.00 0.00 175.10 173.44 1vgw n ASP 157 N 3.00 3.78 -0.26 3.54 2.03 -1.26 -4.05 116.55 123.32 1vgw n ASP 157 Ca -0.18 1.01 0.11 0.00 0.52 0.00 0.00 54.79 56.26 1vgw n ASP 157 Cb 0.53 -1.50 -0.00 0.00 -0.72 0.00 0.00 41.12 39.42 1vgw n ASP 157 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1vgw n ARG 158 N 5.15 0.66 -1.69 -0.67 0.00 -1.26 -4.93 116.66 113.91 1vgw n ARG 158 Ca 0.18 -0.53 -0.57 0.00 -0.00 0.00 0.00 57.85 56.94 1vgw n ARG 158 Cb 0.34 -1.49 -0.07 0.00 -0.00 0.00 0.00 32.46 31.24 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 -0.71 2.24 -0.33 2.89 2.88 -1.26 -0.85 113.62 118.47 1vgw n SER 159 Ca 0.07 1.08 -0.04 0.00 -1.33 0.00 0.00 58.87 58.65 1vgw n SER 159 Cb 0.40 -1.15 -0.02 0.00 -0.75 0.00 0.00 64.21 62.70 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 3.89 0.62 3.88 0.46 0.00 -1.26 -5.01 105.19 107.77 1vgw n GLY 160 Ca 0.25 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.99 4.35 0.08 0.99 1.43 -0.03 -5.04 118.68 119.47 1vgw s LEU 161 Ca 0.00 0.62 0.04 0.00 -1.03 0.00 0.00 54.13 53.76 1vgw s LEU 161 Cb 0.00 -2.88 -0.03 0.00 0.03 0.00 0.00 46.19 43.31 1vgw s LEU 161 CO 0.00 0.19 -0.11 0.26 0.23 0.00 0.00 176.35 176.92 1vgw s TRP 162 N -1.39 1.05 -0.21 0.29 0.52 -1.26 -1.49 118.94 116.44 1vgw s TRP 162 Ca 0.32 -0.55 -0.07 0.00 0.02 0.00 0.00 56.10 55.81 1vgw s TRP 162 Cb -0.13 -0.59 -0.04 0.00 -1.15 0.00 0.00 33.47 31.57 1vgw s TRP 162 CO 0.19 0.01 0.06 -0.65 0.02 0.00 0.00 176.95 176.58 1vgw s GLN 163 N -2.16 3.84 0.33 4.98 -0.21 0.14 -4.83 119.66 121.74 1vgw s GLN 163 Ca -0.00 -0.40 -0.27 0.00 0.02 0.00 0.00 55.36 54.70 1vgw s GLN 163 Cb -0.07 -3.26 -0.09 0.00 1.00 0.00 0.00 33.01 30.59 1vgw s GLN 163 CO 0.01 0.08 1.07 0.00 -2.12 0.00 0.00 175.29 174.33 1vgw s ALA 164 N 0.89 3.28 0.00 6.09 0.00 -1.26 -1.69 121.76 129.07 1vgw s ALA 164 Ca 0.04 0.81 0.00 0.00 0.00 0.00 0.00 51.96 52.80 1vgw s ALA 164 Cb -0.14 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.68 1vgw s ALA 164 CO 0.03 -0.16 0.00 1.04 0.00 0.00 0.00 175.76 176.66 1vgw n GLN 165 N 0.71 2.88 -4.22 0.00 6.02 -0.72 -4.95 117.38 117.10 1vgw n GLN 165 Ca 0.01 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.88 1vgw n GLN 165 Cb 0.47 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.63 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 0.11 0.79 0.66 5.09 -4.23 -1.26 -4.61 115.64 112.19 1vgw s THR 166 Ca 0.00 -1.98 -0.12 0.00 -1.18 0.00 0.00 61.69 58.41 1vgw s THR 166 Cb 0.00 -1.90 -0.01 0.00 1.34 0.00 0.00 72.50 71.94 1vgw s THR 166 CO 0.00 -0.69 1.06 -2.84 -0.54 0.00 0.00 174.62 171.61 1vgw s PRO 167 N -3.85 3.06 -0.24 3.99 0.02 -1.26 -4.77 135.00 131.95 1vgw s PRO 167 Ca 0.18 1.04 -0.03 0.00 0.02 0.00 0.00 61.00 62.21 1vgw s PRO 167 Cb 0.05 -2.00 0.01 0.00 0.02 0.00 0.00 34.50 32.58 1vgw s PRO 167 CO -0.00 -1.00 -0.05 -0.65 -0.33 0.00 0.00 177.00 174.96 1vgw s GLN 168 N -4.71 3.02 -0.31 5.54 -0.21 -0.90 -2.96 119.66 119.12 1vgw s GLN 168 Ca 0.60 -0.86 -0.10 0.00 0.02 0.00 0.00 55.36 55.02 1vgw s GLN 168 Cb -0.15 -3.00 -0.01 0.00 1.00 0.00 0.00 33.01 30.85 1vgw s GLN 168 CO 0.49 -0.34 0.15 -1.17 -2.12 0.00 0.00 175.29 172.30 1vgw s LEU 169 N 1.38 4.13 0.07 2.90 2.96 -0.59 -1.63 118.68 127.89 1vgw s LEU 169 Ca 0.02 -0.54 0.02 0.00 -0.22 0.00 0.00 54.13 53.41 1vgw s LEU 169 Cb -0.16 -2.00 -0.03 0.00 0.50 0.00 0.00 46.19 44.50 1vgw s LEU 169 CO -0.04 -0.20 -0.07 -0.36 -1.32 0.00 0.00 176.35 174.35 1vgw s PHE 170 N 1.61 0.78 0.41 5.38 0.40 -0.91 -2.11 117.98 123.54 1vgw s PHE 170 Ca 0.04 -0.67 -0.27 0.00 -0.60 0.00 0.00 56.93 55.44 1vgw s PHE 170 Cb -0.17 -0.46 -0.10 0.00 0.51 0.00 0.00 43.02 42.80 1vgw s PHE 170 CO 0.06 -0.11 1.44 1.04 0.70 0.00 0.00 175.22 178.35 1vgw n GLN 171 N 0.82 2.40 -0.19 0.44 6.02 -1.26 -0.06 117.38 125.54 1vgw n GLN 171 Ca -0.18 0.85 -0.03 0.00 -0.01 0.00 0.00 57.00 57.63 1vgw n GLN 171 Cb 0.57 -2.61 0.07 0.00 1.02 0.00 0.00 30.24 29.29 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 2.56 0.74 -0.37 -1.58 0.00 -1.18 -0.24 119.26 119.19 1vgw h ALA 172 Ca -0.50 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.29 1vgw h ALA 172 Cb 1.26 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1vgw h ALA 172 CO 0.62 -0.05 -0.33 0.78 0.00 0.00 0.00 179.25 180.27 1vgw h GLY 173 N 0.56 0.95 1.02 0.00 0.00 -1.58 0.61 103.07 104.62 1vgw h GLY 173 Ca 0.26 -0.95 -0.03 0.00 0.00 0.00 0.00 47.33 46.60 1vgw h GLY 173 CO -0.18 0.86 0.34 -2.00 0.00 0.00 0.00 176.54 175.56 1vgw h LEU 174 N 0.67 0.96 -0.07 3.11 5.85 -1.72 -1.33 115.31 122.78 1vgw h LEU 174 Ca 0.06 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 1vgw h LEU 174 Cb 0.92 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.70 1vgw h LEU 174 CO 0.08 0.83 -0.04 0.25 -0.34 0.00 0.00 178.44 179.23 1vgw h LEU 175 N 1.02 0.16 -0.83 2.25 5.85 -0.97 -1.03 115.31 121.75 1vgw h LEU 175 Ca 0.25 -0.42 0.11 0.00 0.84 0.00 0.00 57.88 58.66 1vgw h LEU 175 Cb 0.14 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.04 1vgw h LEU 175 CO -0.03 0.54 0.46 -0.74 -0.34 0.00 0.00 178.44 178.33 1vgw h HIS 176 N -0.22 0.83 0.30 1.25 2.76 -0.84 -2.38 115.15 116.85 1vgw h HIS 176 Ca 0.02 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.20 1vgw h HIS 176 Cb 0.48 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 29.20 1vgw h HIS 176 CO 0.07 0.30 -0.14 -0.09 -1.30 0.00 0.00 177.93 176.76 1vgw h ARG 177 N 0.74 -0.38 -0.42 5.26 9.65 -1.06 -2.94 114.38 125.24 1vgw h ARG 177 Ca 0.42 0.03 -0.03 0.00 -1.10 0.00 0.00 59.98 59.29 1vgw h ARG 177 Cb 0.45 0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 29.10 1vgw h ARG 177 CO -0.28 -0.20 0.12 0.00 2.80 0.00 0.00 179.97 182.41 1vgw h ALA 178 N 0.21 1.44 -0.01 2.80 0.00 -0.86 -2.78 119.26 120.05 1vgw h ALA 178 Ca -0.04 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1vgw h ALA 178 Cb 0.36 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1vgw h ALA 178 CO 0.07 0.42 -0.04 1.28 0.00 0.00 0.00 179.25 180.98 1vgw n LEU 179 N -4.34 1.18 0.17 0.00 4.77 -0.92 -4.23 117.00 113.63 1vgw n LEU 179 Ca 0.03 -0.37 0.08 0.00 -0.03 0.00 0.00 56.01 55.72 1vgw n LEU 179 Cb 0.18 -0.03 0.09 0.00 -2.33 0.00 0.00 43.42 41.33 1vgw n LEU 179 CO 0.38 0.20 0.56 0.00 -1.33 0.00 0.00 177.39 177.20 1vgw h ALA 180 N 4.18 0.82 0.00 -1.18 0.00 -1.30 -3.50 119.26 118.28 1vgw h ALA 180 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1vgw h ALA 180 Cb 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1vgw h ALA 180 CO 0.00 0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.50 1vgw n ALA 181 N -2.17 0.00 -0.48 0.00 0.00 -1.26 -5.14 120.51 111.47 1vgw n ALA 181 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1vgw n ALA 181 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1vgw n ALA 181 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1vgw n LEU 184 N 0.00 0.00 0.00 0.00 7.94 -1.26 -4.93 117.00 118.75 1vgw n LEU 184 Ca 0.00 0.76 0.00 0.00 -1.11 0.00 0.00 56.01 55.66 1vgw n LEU 184 Cb 0.00 -0.26 0.00 0.00 0.53 0.00 0.00 43.42 43.69 1vgw n LEU 184 CO 0.00 -0.26 0.00 0.61 -1.11 0.00 0.00 177.39 176.63 1vgw n GLY 185 N -0.77 0.00 2.59 -3.96 0.00 -1.26 -5.04 105.19 96.74 1vgw n GLY 185 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1vgw n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vgw n GLY 186 N 0.00 3.62 3.67 -0.02 0.00 -1.26 -4.87 105.19 106.33 1vgw n GLY 186 Ca 0.00 -1.23 -0.25 0.00 0.00 0.00 0.00 46.02 44.53 1vgw n GLY 186 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vgw s ILE 187 N 3.16 2.35 0.00 -0.61 -4.36 -1.26 -5.09 121.20 115.38 1vgw s ILE 187 Ca 0.53 -1.88 0.00 0.00 -0.26 0.00 0.00 60.65 59.04 1vgw s ILE 187 Cb 0.14 -2.92 0.00 0.00 1.25 0.00 0.00 42.46 40.93 1vgw s ILE 187 CO -0.03 -0.08 0.00 0.35 0.24 0.00 0.00 174.94 175.42 1vgw n THR 188 N -1.06 0.00 -2.14 8.37 -2.24 -1.26 -5.06 114.28 110.88 1vgw n THR 188 Ca -0.03 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.47 1vgw n THR 188 Cb 0.64 -0.24 0.15 0.00 -2.10 0.00 0.00 70.33 68.79 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 1.00 3.61 0.18 3.42 3.84 -1.26 -4.98 116.67 122.48 1vgw s ASP 189 Ca 0.00 0.10 -0.11 0.00 -0.00 0.00 0.00 52.55 52.54 1vgw s ASP 189 Cb 0.00 -0.28 0.08 0.00 -1.38 0.00 0.00 42.92 41.34 1vgw s ASP 189 CO 0.00 -2.39 1.71 -0.33 -0.00 0.00 0.00 175.17 174.16 1vgw h GLU 190 N -1.24 0.96 -0.71 2.11 3.07 -1.99 -2.99 114.58 113.79 1vgw h GLU 190 Ca -0.42 -0.21 0.13 0.00 -0.50 0.00 0.00 59.36 58.36 1vgw h GLU 190 Cb 1.25 -0.14 -0.09 0.00 -0.84 0.00 0.00 28.75 28.93 1vgw h GLU 190 CO 0.41 0.85 0.26 0.00 -1.40 0.00 0.00 179.01 179.13 1vgw h ALA 191 N 1.07 0.96 0.00 3.43 0.00 -1.96 -1.65 119.26 121.10 1vgw h ALA 191 Ca 0.20 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 1vgw h ALA 191 Cb 0.29 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1vgw h ALA 191 CO -0.01 -0.22 -0.18 0.66 0.00 0.00 0.00 179.25 179.51 1vgw h SER 192 N 0.41 0.00 0.65 0.00 4.64 -1.90 0.87 113.55 118.22 1vgw h SER 192 Ca 0.38 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.51 1vgw h SER 192 Cb 0.56 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.63 1vgw h SER 192 CO -0.39 0.18 -0.89 0.00 -0.87 0.00 0.00 176.83 174.86 1vgw h ALA 193 N 1.82 0.52 -0.27 5.18 0.00 -1.33 -3.20 119.26 121.98 1vgw h ALA 193 Ca -0.00 -0.74 -0.07 0.00 0.00 0.00 0.00 54.91 54.09 1vgw h ALA 193 Cb 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1vgw h ALA 193 CO 0.02 0.96 -0.12 0.28 0.00 0.00 0.00 179.25 180.39 1vgw h VAL 194 N 0.08 1.30 -0.49 0.00 2.07 -0.57 -3.15 116.25 115.49 1vgw h VAL 194 Ca -0.04 -1.19 0.10 0.00 0.82 0.00 0.00 66.70 66.39 1vgw h VAL 194 Cb 1.53 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 32.78 1vgw h VAL 194 CO 0.13 0.38 0.34 -0.33 0.02 0.00 0.00 177.57 178.10 1vgw h GLU 195 N 0.29 0.20 0.00 1.57 5.08 -0.93 -0.55 114.58 120.24 1vgw h GLU 195 Ca 0.06 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1vgw h GLU 195 Cb 0.62 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1vgw h GLU 195 CO 0.04 0.13 0.00 1.63 -1.00 0.00 0.00 179.01 179.81 1vgw n LYS 196 N -4.45 0.05 0.00 2.33 5.02 -1.19 -1.65 118.16 118.27 1vgw n LYS 196 Ca 0.08 0.23 0.13 0.00 -2.02 0.00 0.00 58.31 56.72 1vgw n LYS 196 Cb 0.42 -1.50 0.28 0.00 -0.02 0.00 0.00 35.03 34.21 1vgw n LYS 196 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1vgw n LEU 197 N -1.45 1.52 0.00 -0.35 4.32 -0.22 -4.92 117.00 115.91 1vgw n LEU 197 Ca 0.04 -0.49 0.00 0.00 -0.02 0.00 0.00 56.01 55.54 1vgw n LEU 197 Cb 0.15 -0.06 0.00 0.00 -1.62 0.00 0.00 43.42 41.89 1vgw n LEU 197 CO 0.13 0.28 0.00 0.61 -1.22 0.00 0.00 177.39 177.18 1vgw n GLY 198 N 1.33 0.79 3.79 -0.72 0.00 -0.66 -5.07 105.19 104.65 1vgw n GLY 198 Ca 0.13 -0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 5.02 -0.40 1.61 1.01 -1.24 -5.04 120.40 119.35 1vgw s VAL 199 Ca 0.00 0.03 -0.07 0.00 0.00 0.00 0.00 61.98 61.94 1vgw s VAL 199 Cb 0.00 -3.17 0.09 0.00 0.00 0.00 0.00 36.38 33.30 1vgw s VAL 199 CO 0.00 0.60 0.22 -0.13 0.00 0.00 0.00 175.10 175.79 1vgw s ARG 200 N -0.85 2.42 0.58 2.72 0.52 -1.26 -3.43 118.95 119.65 1vgw s ARG 200 Ca 0.13 -1.55 -0.17 0.00 -0.52 0.00 0.00 55.73 53.62 1vgw s ARG 200 Cb -0.12 -3.66 -0.04 0.00 0.52 0.00 0.00 34.95 31.65 1vgw s ARG 200 CO 0.03 -0.96 1.10 -2.14 0.02 0.00 0.00 175.30 173.35 1vgw s PRO 201 N 1.33 3.22 0.70 3.54 0.02 -1.26 -4.91 135.00 137.62 1vgw s PRO 201 Ca 0.03 1.45 -0.12 0.00 0.02 0.00 0.00 61.00 62.38 1vgw s PRO 201 Cb -0.23 -2.00 0.02 0.00 0.02 0.00 0.00 34.50 32.31 1vgw s PRO 201 CO -0.00 -0.93 1.08 -0.51 -0.33 0.00 0.00 177.00 176.31 1vgw s LEU 202 N -4.23 3.21 -0.26 -5.54 1.43 -0.24 -4.88 118.68 108.17 1vgw s LEU 202 Ca 0.69 1.81 -0.05 0.00 -1.03 0.00 0.00 54.13 55.54 1vgw s LEU 202 Cb -0.21 -4.52 0.00 0.00 0.03 0.00 0.00 46.19 41.49 1vgw s LEU 202 CO 0.32 -1.65 0.02 -0.76 0.23 0.00 0.00 176.35 174.52 1vgw s LEU 203 N -5.36 3.45 -0.09 1.79 1.43 -1.26 -1.82 118.68 116.80 1vgw s LEU 203 Ca 0.62 -0.60 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 1vgw s LEU 203 Cb -0.17 -1.81 -0.03 0.00 0.03 0.00 0.00 46.19 44.21 1vgw s LEU 203 CO 0.49 -0.12 -0.08 -0.63 0.23 0.00 0.00 176.35 176.24 1vgw s ILE 204 N 1.48 3.55 0.03 -0.59 1.09 -0.16 -4.96 121.20 121.64 1vgw s ILE 204 Ca 0.03 -0.51 -0.33 0.00 -1.10 0.00 0.00 60.65 58.74 1vgw s ILE 204 Cb -0.16 -2.48 -0.11 0.00 -1.06 0.00 0.00 42.46 38.65 1vgw s ILE 204 CO -0.00 0.56 1.84 1.67 -0.10 0.00 0.00 174.94 178.91 1vgw n GLN 205 N 2.73 2.46 0.00 2.79 -0.06 -1.26 -0.55 117.38 123.49 1vgw n GLN 205 Ca -0.18 0.90 0.00 0.00 -2.00 0.00 0.00 57.00 55.72 1vgw n GLN 205 Cb 0.53 -2.77 0.00 0.00 -4.06 0.00 0.00 30.24 23.94 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 4.23 0.62 3.60 1.69 0.00 0.51 -4.69 105.19 111.15 1vgw n GLY 206 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.30 0.52 1.61 2.15 -1.26 -4.96 116.67 113.43 1vgw s ASP 207 Ca 0.00 0.38 0.27 0.00 0.43 0.00 0.00 52.55 53.64 1vgw s ASP 207 Cb 0.00 0.32 1.45 0.00 -0.30 0.00 0.00 42.92 44.39 1vgw s ASP 207 CO 0.00 -0.24 2.07 0.00 -0.17 0.00 0.00 175.17 176.83 1vgw h ALA 208 N 2.72 1.29 0.00 3.66 0.00 -1.99 -1.44 119.26 123.50 1vgw h ALA 208 Ca -0.18 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1vgw h ALA 208 Cb 1.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1vgw h ALA 208 CO 0.26 0.14 -0.18 0.00 0.00 0.00 0.00 179.25 179.47 1vgw h ARG 209 N 0.00 0.00 -2.01 0.00 3.08 -1.96 -3.36 114.38 110.13 1vgw h ARG 209 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1vgw h ARG 209 Cb 0.33 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.38 1vgw h ARG 209 CO 0.01 0.00 -0.01 -1.71 -1.07 0.00 0.00 179.97 177.19 1vgw n ASN 210 N -2.56 4.24 -4.88 7.04 5.15 -0.54 -4.59 115.26 119.11 1vgw n ASN 210 Ca 0.04 -2.13 -0.30 0.00 -0.60 0.00 0.00 54.58 51.60 1vgw n ASN 210 Cb 0.48 -0.91 0.04 0.00 -0.53 0.00 0.00 39.78 38.85 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 3.01 -0.01 1.20 0.05 -1.26 -4.91 118.68 116.77 1vgw s LEU 211 Ca 0.03 1.14 -0.03 0.00 0.05 0.00 0.00 54.13 55.33 1vgw s LEU 211 Cb 0.01 -4.00 -0.04 0.00 -2.05 0.00 0.00 46.19 40.12 1vgw s LEU 211 CO 0.00 -1.20 0.17 -0.75 -0.55 0.00 0.00 176.35 174.02 1vgw s LYS 212 N -5.28 3.40 -0.72 1.48 2.20 -1.26 -4.43 119.74 115.14 1vgw s LYS 212 Ca 0.57 -0.33 -0.21 0.00 -0.36 0.00 0.00 55.97 55.63 1vgw s LYS 212 Cb -0.11 -3.07 0.09 0.00 -1.51 0.00 0.00 37.83 33.23 1vgw s LYS 212 CO 0.51 0.67 0.97 -1.17 -0.36 0.00 0.00 175.35 175.97 1vgw s LEU 213 N -1.90 4.72 0.00 5.43 2.96 -1.00 -4.79 118.68 124.10 1vgw s LEU 213 Ca 0.27 -1.34 0.00 0.00 -0.22 0.00 0.00 54.13 52.84 1vgw s LEU 213 Cb -0.13 -2.39 0.00 0.00 0.50 0.00 0.00 46.19 44.17 1vgw s LEU 213 CO 0.18 -1.29 0.00 0.35 -1.32 0.00 0.00 176.35 174.27 1vgw n THR 214 N 5.75 0.00 -4.02 3.68 -2.24 -1.26 -4.69 114.28 111.50 1vgw n THR 214 Ca 0.02 -0.22 -0.11 0.00 -2.27 0.00 0.00 64.05 61.48 1vgw n THR 214 Cb 0.46 0.74 -0.05 0.00 -2.10 0.00 0.00 70.33 69.38 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 -1.04 1.67 0.34 -0.78 -2.07 -1.26 -5.01 119.66 111.50 1vgw s GLN 215 Ca 0.00 -1.42 0.02 0.00 -1.82 0.00 0.00 55.36 52.14 1vgw s GLN 215 Cb 0.00 0.46 0.60 0.00 -1.09 0.00 0.00 33.01 32.98 1vgw s GLN 215 CO 0.00 -0.70 1.97 -1.35 -1.32 0.00 0.00 175.29 173.89 1vgw h PRO 216 N 2.22 0.80 -0.57 9.60 0.11 -1.99 -2.35 132.00 139.81 1vgw h PRO 216 Ca -0.28 -0.08 0.08 0.00 0.11 0.00 0.00 66.00 65.84 1vgw h PRO 216 Cb 1.25 -0.17 -0.06 0.00 0.11 0.00 0.00 31.00 32.13 1vgw h PRO 216 CO 0.38 0.58 0.22 1.96 -0.21 0.00 0.00 178.00 180.93 1vgw h GLN 217 N 0.81 0.40 -0.60 1.05 4.20 -2.01 -1.69 115.11 117.28 1vgw h GLN 217 Ca 0.21 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 1vgw h GLN 217 Cb 0.01 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.67 1vgw h GLN 217 CO -0.04 0.27 0.29 -0.44 -0.67 0.00 0.00 178.83 178.24 1vgw h ASP 218 N 0.41 0.78 -0.80 1.46 3.45 -1.78 -2.82 116.42 117.13 1vgw h ASP 218 Ca 0.28 -0.13 -0.01 0.00 0.43 0.00 0.00 57.03 57.60 1vgw h ASP 218 Cb 0.31 -0.20 -0.04 0.00 -0.56 0.00 0.00 39.33 38.84 1vgw h ASP 218 CO -0.27 0.70 0.46 0.00 -1.57 0.00 0.00 179.24 178.56 1vgw h ALA 219 N 1.12 1.03 -0.43 3.45 0.00 -0.97 0.37 119.26 123.83 1vgw h ALA 219 Ca 0.21 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1vgw h ALA 219 Cb 0.12 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1vgw h ALA 219 CO -0.03 0.51 0.22 -0.92 0.00 0.00 0.00 179.25 179.04 1vgw h TYR 220 N 1.11 0.60 -0.26 0.00 -0.00 -1.28 0.20 116.97 117.33 1vgw h TYR 220 Ca 0.29 -0.02 -0.11 0.00 -0.00 0.00 0.00 58.73 58.88 1vgw h TYR 220 Cb -0.01 -0.19 -0.01 0.00 -0.00 0.00 0.00 36.73 36.52 1vgw h TYR 220 CO -0.00 0.47 -0.31 0.82 -0.00 0.00 0.00 178.16 179.15 1vgw h ILE 221 N 0.55 1.28 0.03 1.81 2.04 -1.18 -1.51 117.51 120.53 1vgw h ILE 221 Ca 0.15 -1.39 -0.00 0.00 1.00 0.00 0.00 64.86 64.62 1vgw h ILE 221 Cb 0.09 1.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1vgw h ILE 221 CO -0.02 0.44 -0.02 0.58 0.00 0.00 0.00 178.15 179.13 1vgw h VAL 222 N 0.46 1.23 -0.83 1.67 2.07 0.23 -0.92 116.25 120.17 1vgw h VAL 222 Ca 0.06 -0.87 0.06 0.00 0.82 0.00 0.00 66.70 66.77 1vgw h VAL 222 Cb 0.76 1.81 -0.06 0.00 -1.52 0.00 0.00 31.29 32.28 1vgw h VAL 222 CO 0.06 0.22 0.51 -0.09 0.02 0.00 0.00 177.57 178.29 1vgw h ARG 223 N -0.43 0.91 -0.43 1.57 9.65 -0.58 -2.07 114.38 123.00 1vgw h ARG 223 Ca -0.00 -0.05 -0.09 0.00 -1.10 0.00 0.00 59.98 58.73 1vgw h ARG 223 Cb 0.40 -0.21 -0.02 0.00 -1.39 0.00 0.00 29.97 28.75 1vgw h ARG 223 CO 0.01 0.60 -0.10 -0.07 2.80 0.00 0.00 179.97 183.21 1vgw h LEU 224 N 0.94 0.74 -0.74 3.80 -0.00 -1.21 -3.12 115.31 115.71 1vgw h LEU 224 Ca 0.36 -0.21 -0.09 0.00 -0.00 0.00 0.00 57.88 57.94 1vgw h LEU 224 Cb 0.15 -0.20 -0.01 0.00 -0.00 0.00 0.00 40.66 40.60 1vgw h LEU 224 CO -0.16 0.87 -0.41 -0.07 -0.00 0.00 0.00 178.44 178.67 1vgw h LEU 225 N 0.69 0.00 0.00 1.67 3.38 -0.48 -3.24 115.31 117.33 1vgw h LEU 225 Ca 0.12 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 1vgw h LEU 225 Cb 0.56 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1vgw h LEU 225 CO 0.03 0.41 -0.66 -0.07 0.09 0.00 0.00 178.44 178.25 1vgw h LEU 226 N 0.00 0.00 -0.39 1.67 3.38 -1.40 -3.51 115.31 115.06 1vgw h LEU 226 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1vgw h LEU 226 Cb 1.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1vgw h LEU 226 CO 0.05 0.55 0.00 0.47 0.09 0.00 0.00 178.44 179.60