#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vgw s ARG 3 N 0.00 4.20 0.28 1.64 0.52 -1.26 -5.05 118.95 119.28 1vgw s ARG 3 Ca 0.00 1.35 -0.03 0.00 -0.52 0.00 0.00 55.73 56.53 1vgw s ARG 3 Cb 0.00 -2.42 -0.05 0.00 0.52 0.00 0.00 34.95 33.00 1vgw s ARG 3 CO 0.00 -0.08 0.52 0.15 0.02 0.00 0.00 175.30 175.91 1vgw s LYS 4 N -2.71 3.58 -0.35 3.54 1.02 -1.26 -4.96 119.74 118.60 1vgw s LYS 4 Ca 0.59 -0.12 -0.02 0.00 0.02 0.00 0.00 55.97 56.44 1vgw s LYS 4 Cb -0.17 -2.69 0.08 0.00 -0.52 0.00 0.00 37.83 34.53 1vgw s LYS 4 CO 0.22 0.24 0.09 -0.80 -0.92 0.00 0.00 175.35 174.18 1vgw s ASN 5 N -3.30 5.05 -0.26 2.83 0.01 -1.26 -1.01 114.94 117.00 1vgw s ASN 5 Ca 0.42 -1.67 -0.06 0.00 -0.71 0.00 0.00 52.86 50.85 1vgw s ASN 5 Cb -0.11 -1.76 -0.01 0.00 0.41 0.00 0.00 41.25 39.79 1vgw s ASN 5 CO 0.31 -0.39 0.04 -0.63 -1.51 0.00 0.00 177.10 174.92 1vgw s ILE 6 N 1.18 3.92 0.12 0.60 1.01 -0.51 -0.34 121.20 127.18 1vgw s ILE 6 Ca 0.02 -0.44 -0.29 0.00 0.00 0.00 0.00 60.65 59.94 1vgw s ILE 6 Cb -0.21 -2.88 -0.06 0.00 0.01 0.00 0.00 42.46 39.31 1vgw s ILE 6 CO -0.03 0.28 0.91 0.00 0.00 0.00 0.00 174.94 176.10 1vgw s ALA 7 N 1.54 3.29 -0.10 9.38 0.00 0.08 -1.16 121.76 134.79 1vgw s ALA 7 Ca 0.05 0.52 0.01 0.00 0.00 0.00 0.00 51.96 52.54 1vgw s ALA 7 Cb -0.16 -3.20 0.02 0.00 0.00 0.00 0.00 23.12 19.78 1vgw s ALA 7 CO 0.01 0.04 -0.11 -1.17 0.00 0.00 0.00 175.76 174.54 1vgw s LEU 8 N -0.25 1.47 -0.31 0.00 2.96 -0.51 -0.52 118.68 121.52 1vgw s LEU 8 Ca 0.44 -0.33 0.03 0.00 -0.22 0.00 0.00 54.13 54.05 1vgw s LEU 8 Cb -0.23 -0.89 0.09 0.00 0.50 0.00 0.00 46.19 45.65 1vgw s LEU 8 CO 0.29 -0.04 0.00 -0.63 -1.32 0.00 0.00 176.35 174.65 1vgw s ILE 9 N 1.20 2.05 -0.24 6.68 1.01 -0.50 -1.25 121.20 130.15 1vgw s ILE 9 Ca -0.04 -1.97 -0.29 0.00 0.00 0.00 0.00 60.65 58.35 1vgw s ILE 9 Cb -0.14 -2.40 0.00 0.00 0.01 0.00 0.00 42.46 39.93 1vgw s ILE 9 CO -0.03 -0.41 1.13 -2.16 0.00 0.00 0.00 174.94 173.47 1vgw s PRO 10 N 1.07 4.18 -0.32 2.79 0.04 -1.26 -2.09 135.00 139.41 1vgw s PRO 10 Ca 0.04 1.37 0.18 0.00 0.04 0.00 0.00 61.00 62.63 1vgw s PRO 10 Cb -0.19 -3.72 0.46 0.00 0.04 0.00 0.00 34.50 31.09 1vgw s PRO 10 CO -0.09 -0.76 1.03 0.00 0.04 0.00 0.00 177.00 177.22 1vgw n ALA 11 N 6.65 3.07 -2.11 8.56 0.00 -0.60 -4.45 120.51 131.62 1vgw n ALA 11 Ca 0.13 -2.85 -0.37 0.00 0.00 0.00 0.00 53.44 50.34 1vgw n ALA 11 Cb 0.46 -0.93 0.03 0.00 0.00 0.00 0.00 19.45 19.01 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 -0.23 6.15 0.00 0.00 0.00 -1.17 -4.46 120.51 120.80 1vgw n ALA 12 Ca 0.07 -4.21 0.00 0.00 0.00 0.00 0.00 53.44 49.30 1vgw n ALA 12 Cb 0.82 -1.69 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1vgw n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vgw n GLN 25 N -0.48 0.00 -0.02 0.00 10.64 -1.26 -4.62 117.38 121.63 1vgw n GLN 25 Ca 0.50 0.00 0.10 0.00 -1.83 0.00 0.00 57.00 55.77 1vgw n GLN 25 Cb 0.32 0.00 0.09 0.00 -0.86 0.00 0.00 30.24 29.80 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 -0.53 0.05 -1.76 2.61 0.53 -1.26 -0.75 117.16 116.05 1vgw n TYR 26 Ca 0.00 -0.03 -0.40 0.00 -1.02 0.00 0.00 57.90 56.45 1vgw n TYR 26 Cb 0.00 -0.00 0.02 0.00 -1.03 0.00 0.00 39.34 38.33 1vgw n TYR 26 CO 0.00 0.00 0.00 0.28 -1.02 0.00 0.00 176.86 176.12 1vgw n VAL 27 N 1.10 2.83 -3.90 -0.72 0.31 -1.26 -4.72 118.33 111.97 1vgw n VAL 27 Ca 0.12 -0.50 -0.36 0.00 -0.01 0.00 0.00 64.34 63.59 1vgw n VAL 27 Cb 0.49 -1.85 -0.08 0.00 -0.91 0.00 0.00 33.84 31.49 1vgw n VAL 27 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1vgw s GLU 28 N -2.46 3.77 -0.09 5.55 2.02 -1.26 -1.84 118.70 124.38 1vgw s GLU 28 Ca 0.61 -0.23 -0.04 0.00 0.02 0.00 0.00 54.97 55.33 1vgw s GLU 28 Cb -0.45 -3.24 0.05 0.00 0.10 0.00 0.00 34.13 30.60 1vgw s GLU 28 CO 0.57 0.50 0.19 0.42 0.02 0.00 0.00 175.26 176.97 1vgw s ILE 29 N -0.25 -0.23 0.00 -1.63 1.01 -0.82 -4.97 121.20 114.32 1vgw s ILE 29 Ca 0.10 0.28 0.00 0.00 0.00 0.00 0.00 60.65 61.03 1vgw s ILE 29 Cb -0.12 -0.33 0.00 0.00 0.01 0.00 0.00 42.46 42.02 1vgw s ILE 29 CO 0.01 0.12 0.00 0.61 0.00 0.00 0.00 174.94 175.67 1vgw n GLY 30 N 4.97 0.71 0.92 6.18 0.00 -1.26 -3.20 105.19 113.51 1vgw n GLY 30 Ca -0.12 -0.75 0.12 0.00 0.00 0.00 0.00 46.02 45.28 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 5.10 2.85 -4.12 1.61 3.41 -1.26 -4.97 113.62 116.23 1vgw n SER 31 Ca 0.00 -1.94 -0.09 0.00 -0.26 0.00 0.00 58.87 56.58 1vgw n SER 31 Cb 0.00 -0.02 -0.10 0.00 -0.26 0.00 0.00 64.21 63.83 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 -1.96 0.77 0.92 4.33 3.01 -1.19 -5.16 119.74 120.45 1vgw s LYS 32 Ca 0.30 -1.33 -0.12 0.00 -1.01 0.00 0.00 55.97 53.81 1vgw s LYS 32 Cb 0.20 0.17 0.14 0.00 -1.01 0.00 0.00 37.83 37.34 1vgw s LYS 32 CO 0.30 -0.16 1.11 0.95 0.51 0.00 0.00 175.35 178.06 1vgw s THR 33 N -3.94 2.29 0.12 2.17 -4.23 -1.26 -1.94 115.64 108.84 1vgw s THR 33 Ca 0.15 0.09 -0.21 0.00 -1.18 0.00 0.00 61.69 60.54 1vgw s THR 33 Cb 0.08 -2.73 -0.07 0.00 1.34 0.00 0.00 72.50 71.11 1vgw s THR 33 CO -0.04 -0.12 1.72 0.58 -0.54 0.00 0.00 174.62 176.22 1vgw h VAL 34 N -1.55 0.89 -0.49 2.29 2.07 -1.10 -2.47 116.25 115.88 1vgw h VAL 34 Ca -0.51 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 67.07 1vgw h VAL 34 Cb 1.31 0.85 -0.06 0.00 -1.52 0.00 0.00 31.29 31.88 1vgw h VAL 34 CO 0.59 0.01 0.15 0.25 0.02 0.00 0.00 177.57 178.58 1vgw h LEU 35 N 0.03 0.11 -1.12 2.57 5.85 -1.17 -1.51 115.31 120.06 1vgw h LEU 35 Ca 0.07 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.89 1vgw h LEU 35 Cb 0.09 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.14 1vgw h LEU 35 CO -0.12 0.09 0.60 -0.33 -0.34 0.00 0.00 178.44 178.33 1vgw h GLU 36 N 0.30 1.12 -0.63 1.25 5.08 -1.75 -1.09 114.58 118.87 1vgw h GLU 36 Ca 0.24 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.47 1vgw h GLU 36 Cb 0.28 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 1vgw h GLU 36 CO -0.27 0.74 0.12 0.45 -1.00 0.00 0.00 179.01 179.05 1vgw h HIS 37 N 1.16 1.05 0.06 4.33 3.86 -0.89 -2.72 115.15 122.01 1vgw h HIS 37 Ca 0.35 -0.13 -0.00 0.00 -1.16 0.00 0.00 60.37 59.44 1vgw h HIS 37 Cb -0.02 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.15 1vgw h HIS 37 CO -0.00 0.88 -0.03 0.28 0.86 0.00 0.00 177.93 179.92 1vgw h VAL 38 N 0.95 1.07 -0.45 2.45 2.07 -0.34 -2.92 116.25 119.07 1vgw h VAL 38 Ca 0.20 -0.44 0.13 0.00 0.82 0.00 0.00 66.70 67.41 1vgw h VAL 38 Cb 0.38 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1vgw h VAL 38 CO 0.01 0.11 0.34 -0.07 0.02 0.00 0.00 177.57 177.97 1vgw h LEU 39 N -0.28 0.00 -0.56 2.57 3.38 -1.20 -0.75 115.31 118.46 1vgw h LEU 39 Ca -0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1vgw h LEU 39 Cb 0.25 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1vgw h LEU 39 CO 0.01 0.00 0.01 1.23 0.09 0.00 0.00 178.44 179.79 1vgw h GLY 40 N 0.00 1.07 0.67 0.83 0.00 -1.29 -1.77 103.07 102.58 1vgw h GLY 40 Ca 0.21 -0.78 0.07 0.00 0.00 0.00 0.00 47.33 46.84 1vgw h GLY 40 CO -0.00 0.71 0.53 -2.22 0.00 0.00 0.00 176.54 175.56 1vgw h ILE 41 N 0.87 1.01 0.03 2.60 2.04 -1.07 -2.77 117.51 120.22 1vgw h ILE 41 Ca 0.16 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 1vgw h ILE 41 Cb 0.53 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1vgw h ILE 41 CO 0.03 0.17 -0.01 -0.26 0.00 0.00 0.00 178.15 178.08 1vgw h PHE 42 N 0.94 -0.03 -0.76 1.37 0.04 -1.53 -3.24 116.94 113.74 1vgw h PHE 42 Ca 0.39 -0.00 0.18 0.00 2.80 0.00 0.00 57.97 61.33 1vgw h PHE 42 Cb 0.23 0.01 -0.05 0.00 2.20 0.00 0.00 35.95 38.34 1vgw h PHE 42 CO -0.04 0.69 0.52 0.93 -0.60 0.00 0.00 178.31 179.81 1vgw h GLU 43 N -0.89 0.26 -0.31 1.51 4.39 -1.38 0.56 114.58 118.73 1vgw h GLU 43 Ca -0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1vgw h GLU 43 Cb 0.73 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.32 1vgw h GLU 43 CO 0.01 0.17 0.00 2.89 -1.16 0.00 0.00 179.01 180.92 1vgw n ARG 44 N -4.44 1.89 -3.35 2.33 1.85 -1.04 -4.82 116.66 109.08 1vgw n ARG 44 Ca 0.15 -1.36 -0.39 0.00 -1.00 0.00 0.00 57.85 55.25 1vgw n ARG 44 Cb 0.64 -1.36 -0.08 0.00 -1.05 0.00 0.00 32.46 30.61 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 -1.59 3.27 0.26 2.89 2.46 0.20 -4.98 115.29 117.80 1vgw s HIS 45 Ca 0.30 0.50 -0.02 0.00 0.47 0.00 0.00 55.06 56.31 1vgw s HIS 45 Cb 0.16 -2.60 0.48 0.00 -0.13 0.00 0.00 32.58 30.49 1vgw s HIS 45 CO 0.22 -0.21 1.80 0.93 -2.47 0.00 0.00 174.74 175.02 1vgw h GLU 46 N 8.01 0.78 0.00 2.88 4.39 -1.88 -2.12 114.58 126.64 1vgw h GLU 46 Ca -0.32 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.34 1vgw h GLU 46 Cb 1.16 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 1vgw h GLU 46 CO 0.67 0.52 0.00 0.00 -1.16 0.00 0.00 179.01 179.04 1vgw n ALA 47 N -2.38 2.17 -2.71 3.43 0.00 -1.26 -4.72 120.51 115.04 1vgw n ALA 47 Ca 0.16 -0.05 -0.39 0.00 0.00 0.00 0.00 53.44 53.16 1vgw n ALA 47 Cb 0.35 -1.44 -0.05 0.00 0.00 0.00 0.00 19.45 18.31 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 -3.07 5.10 -0.14 0.00 1.01 -0.80 -4.44 120.40 118.07 1vgw s VAL 48 Ca 0.11 1.22 0.18 0.00 0.00 0.00 0.00 61.98 63.49 1vgw s VAL 48 Cb 0.15 -3.94 -0.12 0.00 0.00 0.00 0.00 36.38 32.47 1vgw s VAL 48 CO 0.51 0.26 0.85 0.47 0.00 0.00 0.00 175.10 177.20 1vgw n ASP 49 N 3.89 0.86 -3.56 3.32 8.00 0.53 -4.88 116.55 124.72 1vgw n ASP 49 Ca -0.04 0.37 -0.11 0.00 0.71 0.00 0.00 54.79 55.73 1vgw n ASP 49 Cb 0.51 0.20 -0.05 0.00 -0.02 0.00 0.00 41.12 41.77 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 -5.71 -0.39 -0.02 0.64 2.96 -1.21 -5.04 118.68 109.90 1vgw s LEU 50 Ca -0.03 0.34 0.05 0.00 -0.22 0.00 0.00 54.13 54.27 1vgw s LEU 50 Cb 0.09 1.93 -0.01 0.00 0.50 0.00 0.00 46.19 48.70 1vgw s LEU 50 CO 0.81 -0.41 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.37 1vgw s THR 51 N -1.52 1.34 0.02 3.68 2.01 -1.26 -0.74 115.64 119.17 1vgw s THR 51 Ca -0.01 -0.70 0.05 0.00 0.31 0.00 0.00 61.69 61.34 1vgw s THR 51 Cb -0.01 -1.13 -0.02 0.00 0.01 0.00 0.00 72.50 71.36 1vgw s THR 51 CO 0.00 0.38 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.47 1vgw s VAL 52 N -0.22 1.25 -0.13 3.82 1.01 0.32 -2.34 120.40 124.11 1vgw s VAL 52 Ca 0.03 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.12 1vgw s VAL 52 Cb -0.08 -1.08 0.02 0.00 0.00 0.00 0.00 36.38 35.23 1vgw s VAL 52 CO 0.00 0.17 -0.16 -0.69 0.00 0.00 0.00 175.10 174.43 1vgw s VAL 53 N -0.65 1.59 -0.29 2.92 1.01 0.04 -1.42 120.40 123.61 1vgw s VAL 53 Ca 0.04 -0.68 -0.10 0.00 0.00 0.00 0.00 61.98 61.24 1vgw s VAL 53 Cb -0.07 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 1vgw s VAL 53 CO 0.01 0.46 0.16 -0.69 0.00 0.00 0.00 175.10 175.04 1vgw s VAL 54 N 1.14 4.92 0.44 2.92 1.01 -0.89 -0.80 120.40 129.13 1vgw s VAL 54 Ca -0.03 -0.09 0.07 0.00 0.00 0.00 0.00 61.98 61.93 1vgw s VAL 54 Cb -0.14 -3.39 -0.03 0.00 0.00 0.00 0.00 36.38 32.81 1vgw s VAL 54 CO -0.05 0.20 0.22 0.68 0.00 0.00 0.00 175.10 176.15 1vgw s VAL 55 N 1.69 2.19 0.55 2.92 -7.23 0.01 -1.56 120.40 118.96 1vgw s VAL 55 Ca 0.06 -1.65 -0.17 0.00 -1.81 0.00 0.00 61.98 58.41 1vgw s VAL 55 Cb -0.16 -2.84 -0.06 0.00 0.56 0.00 0.00 36.38 33.88 1vgw s VAL 55 CO 0.08 0.00 1.04 -0.94 -0.31 0.00 0.00 175.10 174.97 1vgw s SER 56 N -3.98 6.12 0.00 4.85 1.04 -1.26 -0.54 113.70 119.94 1vgw s SER 56 Ca 0.39 1.79 0.10 0.00 0.48 0.00 0.00 55.95 58.71 1vgw s SER 56 Cb 0.02 -2.54 0.54 0.00 0.10 0.00 0.00 66.02 64.15 1vgw s SER 56 CO 0.22 -0.93 1.12 -2.65 0.98 0.00 0.00 173.24 171.97 1vgw n PRO 57 N -1.64 0.23 0.00 4.02 -0.02 -1.25 -1.63 135.00 134.71 1vgw n PRO 57 Ca 0.08 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 1vgw n PRO 57 Cb 0.53 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.51 1vgw n PRO 57 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1vgw n GLU 58 N -1.14 1.27 -1.91 -0.52 4.71 -1.26 -5.04 120.64 116.75 1vgw n GLU 58 Ca 0.06 -1.05 -0.42 0.00 -0.01 0.00 0.00 57.16 55.74 1vgw n GLU 58 Cb 0.06 -0.98 -0.03 0.00 -1.01 0.00 0.00 31.44 29.48 1vgw n GLU 58 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1vgw s ASP 59 N -0.56 6.59 -0.13 1.62 3.68 -0.64 -4.92 116.67 122.31 1vgw s ASP 59 Ca 0.00 2.47 -0.13 0.00 2.13 0.00 0.00 52.55 57.01 1vgw s ASP 59 Cb 0.00 -2.55 -0.25 0.00 -1.45 0.00 0.00 42.92 38.66 1vgw s ASP 59 CO 0.00 -0.92 0.42 0.74 0.13 0.00 0.00 175.17 175.54 1vgw h THR 60 N 5.04 0.85 0.00 1.71 2.02 -1.96 -3.37 112.91 117.20 1vgw h THR 60 Ca -0.43 -2.33 0.00 0.00 0.77 0.00 0.00 66.41 64.42 1vgw h THR 60 Cb 1.20 2.53 0.00 0.00 -1.74 0.00 0.00 68.15 70.14 1vgw h THR 60 CO 0.94 0.70 0.00 0.15 0.37 0.00 0.00 175.52 177.68 1vgw h PHE 61 N -0.30 0.00 -0.06 3.16 3.57 -2.02 -3.21 116.94 118.08 1vgw h PHE 61 Ca -0.36 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.18 1vgw h PHE 61 Cb 1.78 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 40.47 1vgw h PHE 61 CO 0.10 0.00 -0.21 0.00 -2.23 0.00 0.00 178.31 175.97 1vgw h ALA 62 N 2.02 -0.23 -0.23 2.41 0.00 -1.99 -1.93 119.26 119.32 1vgw h ALA 62 Ca 0.00 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.00 1vgw h ALA 62 Cb 0.28 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1vgw h ALA 62 CO 0.00 -0.69 0.46 -0.44 0.00 0.00 0.00 179.25 178.58 1vgw h ASP 63 N -0.31 0.00 0.21 0.00 3.32 -1.81 0.37 116.42 118.20 1vgw h ASP 63 Ca 0.08 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.82 1vgw h ASP 63 Cb 0.42 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.00 1vgw h ASP 63 CO -0.24 0.00 -1.40 0.11 -1.72 0.00 0.00 179.24 175.99 1vgw h LYS 64 N 0.00 0.45 -0.28 3.56 1.79 -1.56 -3.20 116.57 117.33 1vgw h LYS 64 Ca 0.11 -0.76 -0.11 0.00 -2.18 0.00 0.00 60.65 57.71 1vgw h LYS 64 Cb 1.03 0.28 -0.01 0.00 -1.58 0.00 0.00 32.23 31.95 1vgw h LYS 64 CO -0.00 1.36 -0.28 0.28 -1.08 0.00 0.00 179.45 179.73 1vgw h VAL 65 N -0.00 1.28 -0.74 0.50 2.07 -0.06 -1.94 116.25 117.36 1vgw h VAL 65 Ca -0.26 -1.36 0.12 0.00 0.82 0.00 0.00 66.70 66.02 1vgw h VAL 65 Cb 2.02 1.37 -0.08 0.00 -1.52 0.00 0.00 31.29 33.08 1vgw h VAL 65 CO 0.22 0.43 0.34 -0.61 0.02 0.00 0.00 177.57 177.97 1vgw h GLN 66 N 0.49 0.52 -0.77 1.57 5.75 -1.36 -0.55 115.11 120.76 1vgw h GLN 66 Ca 0.06 -0.03 0.13 0.00 -0.15 0.00 0.00 58.65 58.67 1vgw h GLN 66 Cb 0.74 -0.12 -0.05 0.00 1.07 0.00 0.00 27.48 29.12 1vgw h GLN 66 CO 0.06 0.34 0.51 1.15 -2.65 0.00 0.00 178.83 178.24 1vgw h THR 67 N 0.54 0.84 0.00 2.39 2.02 -1.34 -0.59 112.91 116.76 1vgw h THR 67 Ca 0.38 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.39 1vgw h THR 67 Cb 0.50 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1vgw h THR 67 CO -0.33 0.09 -0.74 0.00 0.37 0.00 0.00 175.52 174.91 1vgw h ALA 68 N 1.63 0.57 -2.63 6.16 0.00 -1.06 -3.41 119.26 120.52 1vgw h ALA 68 Ca 0.37 0.00 -0.60 0.00 0.00 0.00 0.00 54.91 54.68 1vgw h ALA 68 Cb 0.73 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 18.12 1vgw h ALA 68 CO -0.13 0.00 -0.78 1.19 0.00 0.00 0.00 179.25 179.52 1vgw n PHE 69 N -2.43 1.26 -0.30 0.00 3.01 -0.23 -4.99 117.46 113.78 1vgw n PHE 69 Ca 0.02 -3.82 -0.01 0.00 1.01 0.00 0.00 57.45 54.65 1vgw n PHE 69 Cb 0.49 -0.23 0.12 0.00 -0.01 0.00 0.00 39.48 39.85 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 5.29 0.96 0.00 -1.08 0.13 -1.80 -2.29 132.00 133.21 1vgw h PRO 70 Ca 0.20 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1vgw h PRO 70 Cb 0.82 -0.22 0.00 0.00 0.13 0.00 0.00 31.00 31.73 1vgw h PRO 70 CO 0.56 0.64 0.00 1.96 -0.23 0.00 0.00 178.00 180.93 1vgw h GLN 71 N 0.99 0.00 -6.69 0.86 1.08 -1.94 -3.44 115.11 105.97 1vgw h GLN 71 Ca 0.34 0.00 -0.50 0.00 -1.45 0.00 0.00 58.65 57.05 1vgw h GLN 71 Cb 0.08 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.48 1vgw h GLN 71 CO -0.14 0.00 0.34 0.08 -0.95 0.00 0.00 178.83 178.16 1vgw s VAL 72 N -3.48 4.18 -0.23 -0.54 1.01 -0.86 -4.72 120.40 115.75 1vgw s VAL 72 Ca 0.03 2.05 -0.14 0.00 0.00 0.00 0.00 61.98 63.92 1vgw s VAL 72 Cb 0.09 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 1vgw s VAL 72 CO 0.48 0.47 0.31 -0.13 0.00 0.00 0.00 175.10 176.23 1vgw s ARG 73 N -0.95 4.09 -0.69 2.72 0.52 -0.99 -4.98 118.95 118.66 1vgw s ARG 73 Ca 0.42 -0.00 -0.14 0.00 -0.52 0.00 0.00 55.73 55.48 1vgw s ARG 73 Cb -0.25 -3.58 0.18 0.00 0.52 0.00 0.00 34.95 31.82 1vgw s ARG 73 CO 0.31 -0.08 0.64 0.08 0.02 0.00 0.00 175.30 176.27 1vgw s VAL 74 N 1.46 5.36 0.04 3.52 1.01 -1.26 -0.78 120.40 129.76 1vgw s VAL 74 Ca 0.14 -2.06 -0.13 0.00 0.00 0.00 0.00 61.98 59.92 1vgw s VAL 74 Cb -0.15 -4.37 -0.06 0.00 0.00 0.00 0.00 36.38 31.80 1vgw s VAL 74 CO 0.08 -0.95 0.43 0.26 0.00 0.00 0.00 175.10 174.91 1vgw s TRP 75 N 0.78 3.68 -0.73 5.22 0.51 0.02 -4.96 118.94 123.45 1vgw s TRP 75 Ca 0.11 0.96 0.00 0.00 -2.12 0.00 0.00 56.10 55.05 1vgw s TRP 75 Cb -0.19 -2.27 0.37 0.00 -0.81 0.00 0.00 33.47 30.57 1vgw s TRP 75 CO -0.04 0.58 1.69 1.63 -0.51 0.00 0.00 176.95 180.31 1vgw n LYS 76 N 1.43 3.22 -0.78 4.98 5.02 -1.26 -0.81 118.16 129.95 1vgw n LYS 76 Ca -0.11 -3.98 -0.03 0.00 -2.02 0.00 0.00 58.31 52.17 1vgw n LYS 76 Cb 0.52 -2.28 0.20 0.00 -0.02 0.00 0.00 35.03 33.45 1vgw n LYS 76 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1vgw n ASN 77 N -0.47 2.40 -4.73 4.39 5.03 -1.18 -3.96 115.26 116.75 1vgw n ASN 77 Ca 0.48 -3.78 -0.35 0.00 0.87 0.00 0.00 54.58 51.80 1vgw n ASN 77 Cb 0.37 -0.62 0.08 0.00 -1.02 0.00 0.00 39.78 38.59 1vgw n ASN 77 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1vgw s GLY 78 N -2.61 2.54 0.00 7.41 0.00 0.30 -4.77 107.32 110.19 1vgw s GLY 78 Ca 0.44 1.00 0.00 0.00 0.00 0.00 0.00 44.72 46.16 1vgw s GLY 78 CO -0.01 1.41 0.00 0.61 0.00 0.00 0.00 173.10 175.11 1vgw n GLY 79 N 0.58 2.93 0.03 0.20 0.00 -1.26 -4.67 105.19 103.00 1vgw n GLY 79 Ca 0.14 -1.90 0.03 0.00 0.00 0.00 0.00 46.02 44.30 1vgw n GLY 79 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1vgw n GLN 80 N 0.00 0.79 -4.82 1.61 6.02 -1.26 -4.82 117.38 114.89 1vgw n GLN 80 Ca 0.00 -0.11 -0.30 0.00 -0.01 0.00 0.00 57.00 56.58 1vgw n GLN 80 Cb 0.00 -1.43 -0.14 0.00 1.02 0.00 0.00 30.24 29.68 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 -2.97 2.15 0.32 5.09 -4.23 -1.26 -5.02 115.64 109.71 1vgw s THR 81 Ca -0.07 -1.44 0.08 0.00 -1.18 0.00 0.00 61.69 59.07 1vgw s THR 81 Cb 0.09 -1.85 0.31 0.00 1.34 0.00 0.00 72.50 72.40 1vgw s THR 81 CO 0.73 0.32 1.76 -0.09 -0.54 0.00 0.00 174.62 176.80 1vgw h ARG 82 N 4.65 0.66 -0.57 3.99 2.43 -1.95 0.79 114.38 124.37 1vgw h ARG 82 Ca -0.47 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 58.63 1vgw h ARG 82 Cb 1.15 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.52 1vgw h ARG 82 CO 0.43 0.43 0.22 0.00 -1.51 0.00 0.00 179.97 179.54 1vgw h ALA 83 N 1.68 1.32 0.13 2.80 0.00 -1.95 -0.69 119.26 122.54 1vgw h ALA 83 Ca 0.60 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 1vgw h ALA 83 Cb 1.05 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1vgw h ALA 83 CO -0.41 0.50 -0.06 1.49 0.00 0.00 0.00 179.25 180.77 1vgw h GLU 84 N 0.81 -0.17 -0.53 0.00 4.81 0.10 0.64 114.58 120.26 1vgw h GLU 84 Ca 0.19 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.40 1vgw h GLU 84 Cb 0.17 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1vgw h GLU 84 CO -0.02 0.13 0.20 1.79 -0.73 0.00 0.00 179.01 180.37 1vgw h THR 85 N -0.46 1.20 -0.46 0.32 1.35 -0.86 -0.41 112.91 113.59 1vgw h THR 85 Ca -0.02 -0.64 -0.10 0.00 -0.55 0.00 0.00 66.41 65.11 1vgw h THR 85 Cb 0.37 0.59 -0.02 0.00 -1.73 0.00 0.00 68.15 67.36 1vgw h THR 85 CO 0.03 0.25 -0.11 0.58 -0.25 0.00 0.00 175.52 176.02 1vgw h VAL 86 N 0.75 1.26 0.01 6.82 2.07 -1.08 -1.78 116.25 124.30 1vgw h VAL 86 Ca 0.18 -1.19 -0.00 0.00 0.82 0.00 0.00 66.70 66.51 1vgw h VAL 86 Cb 0.17 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1vgw h VAL 86 CO -0.01 0.41 -0.00 -0.09 0.02 0.00 0.00 177.57 177.89 1vgw h ARG 87 N 0.75 -0.01 -0.95 1.57 2.43 0.18 -2.73 114.38 115.62 1vgw h ARG 87 Ca 0.12 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.31 1vgw h ARG 87 Cb 0.61 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.11 1vgw h ARG 87 CO 0.04 0.15 0.63 -0.91 -1.51 0.00 0.00 179.97 178.37 1vgw h ASN 88 N -0.16 1.09 -0.34 -3.80 2.35 -0.94 -1.78 115.58 112.00 1vgw h ASN 88 Ca -0.00 -0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.70 1vgw h ASN 88 Cb 0.16 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 1vgw h ASN 88 CO 0.00 0.78 0.10 1.23 -1.65 0.00 0.00 177.43 177.89 1vgw h GLY 89 N 1.28 0.56 1.14 2.83 0.00 -1.32 -2.46 103.07 105.10 1vgw h GLY 89 Ca 0.35 -0.34 -0.16 0.00 0.00 0.00 0.00 47.33 47.19 1vgw h GLY 89 CO -0.08 0.31 -0.38 -2.08 0.00 0.00 0.00 176.54 174.31 1vgw h VAL 90 N 0.39 1.27 -0.22 4.60 2.07 -1.28 -1.96 116.25 121.11 1vgw h VAL 90 Ca 0.11 -1.56 0.00 0.00 0.82 0.00 0.00 66.70 66.07 1vgw h VAL 90 Cb 0.26 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 1vgw h VAL 90 CO -0.00 0.52 0.15 0.00 0.02 0.00 0.00 177.57 178.26 1vgw h ALA 91 N 0.78 0.28 -0.70 1.67 0.00 -1.33 -2.68 119.26 117.29 1vgw h ALA 91 Ca 0.06 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1vgw h ALA 91 Cb 0.98 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 1vgw h ALA 91 CO 0.09 -0.24 0.23 -0.22 0.00 0.00 0.00 179.25 179.11 1vgw h LYS 92 N 0.30 1.08 -0.20 0.00 3.64 -1.42 -1.60 116.57 118.36 1vgw h LYS 92 Ca 0.08 -0.23 0.06 0.00 -1.27 0.00 0.00 60.65 59.29 1vgw h LYS 92 Cb -0.03 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 1vgw h LYS 92 CO -0.02 0.92 0.20 -0.07 -2.27 0.00 0.00 179.45 178.21 1vgw h LEU 93 N 1.02 0.00 0.00 5.20 3.38 -1.03 -2.08 115.31 121.81 1vgw h LEU 93 Ca 0.23 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.15 1vgw h LEU 93 Cb 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1vgw h LEU 93 CO -0.01 0.00 -0.36 -0.07 0.09 0.00 0.00 178.44 178.09 1vgw h LEU 94 N 0.00 0.00 -0.20 1.67 -0.00 -1.11 0.21 115.31 115.87 1vgw h LEU 94 Ca 0.10 -0.37 0.03 0.00 -0.00 0.00 0.00 57.88 57.64 1vgw h LEU 94 Cb 0.49 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.12 1vgw h LEU 94 CO -0.00 0.88 -0.00 -0.08 -0.00 0.00 0.00 178.44 179.24 1vgw h GLU 95 N -1.00 0.06 -1.01 1.13 4.22 -1.09 -0.42 114.58 116.47 1vgw h GLU 95 Ca -0.07 -0.00 0.25 0.00 0.08 0.00 0.00 59.36 59.62 1vgw h GLU 95 Cb 0.64 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.79 1vgw h GLU 95 CO -0.04 0.04 0.66 1.15 -2.18 0.00 0.00 179.01 178.64 1vgw h THR 96 N 0.06 0.56 0.00 0.32 2.02 -1.58 -3.46 112.91 110.85 1vgw h THR 96 Ca 0.10 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.14 1vgw h THR 96 Cb 0.12 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.68 1vgw h THR 96 CO -0.16 0.07 0.00 0.61 0.37 0.00 0.00 175.52 176.41 1vgw n GLY 97 N -1.50 0.75 0.19 2.16 0.00 -0.17 -4.90 105.19 101.72 1vgw n GLY 97 Ca 0.24 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.20 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 0.39 -8.90 0.99 3.38 -1.65 -3.41 115.31 106.11 1vgw h LEU 98 Ca 0.00 -0.21 -0.67 0.00 0.09 0.00 0.00 57.88 57.10 1vgw h LEU 98 Cb 0.00 -0.11 -0.22 0.00 0.09 0.00 0.00 40.66 40.42 1vgw h LEU 98 CO 0.00 0.86 -0.72 0.00 0.09 0.00 0.00 178.44 178.67 1vgw s ALA 99 N -3.92 2.85 0.43 1.53 0.00 0.67 -5.04 121.76 118.27 1vgw s ALA 99 Ca -0.05 -0.89 -0.01 0.00 0.00 0.00 0.00 51.96 51.01 1vgw s ALA 99 Cb 0.12 -1.26 -0.02 0.00 0.00 0.00 0.00 23.12 21.96 1vgw s ALA 99 CO 0.81 0.41 0.67 0.00 0.00 0.00 0.00 175.76 177.65 1vgw s ALA 100 N -0.25 3.61 0.24 0.00 0.00 -1.26 -4.49 121.76 119.61 1vgw s ALA 100 Ca 0.03 -0.84 -0.07 0.00 0.00 0.00 0.00 51.96 51.08 1vgw s ALA 100 Cb -0.13 -2.27 0.44 0.00 0.00 0.00 0.00 23.12 21.16 1vgw s ALA 100 CO 0.03 -0.27 1.64 0.93 0.00 0.00 0.00 175.76 178.09 1vgw h GLU 101 N 0.44 0.12 -0.13 0.00 4.39 -1.98 0.83 114.58 118.26 1vgw h GLU 101 Ca -0.48 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.22 1vgw h GLU 101 Cb 1.23 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 1vgw h GLU 101 CO 0.60 0.08 0.00 0.25 -1.16 0.00 0.00 179.01 178.78 1vgw n THR 102 N -5.32 0.17 -2.41 1.13 -2.24 -1.26 -1.57 114.28 102.78 1vgw n THR 102 Ca 0.14 -0.25 -0.35 0.00 -2.27 0.00 0.00 64.05 61.31 1vgw n THR 102 Cb 0.47 0.17 -0.02 0.00 -2.10 0.00 0.00 70.33 68.86 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 -1.51 6.11 -0.05 3.42 1.01 0.28 -4.83 116.67 121.11 1vgw s ASP 103 Ca 0.29 2.06 -0.21 0.00 0.71 0.00 0.00 52.55 55.40 1vgw s ASP 103 Cb 0.15 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.46 1vgw s ASP 103 CO 0.23 -0.94 0.61 0.20 0.21 0.00 0.00 175.17 175.48 1vgw s ASN 104 N -1.83 6.93 -0.22 0.27 0.01 -0.18 -0.93 114.94 119.00 1vgw s ASN 104 Ca 0.69 1.11 -0.03 0.00 -0.71 0.00 0.00 52.86 53.91 1vgw s ASN 104 Cb -0.20 -2.37 -0.00 0.00 0.41 0.00 0.00 41.25 39.08 1vgw s ASN 104 CO 0.24 -0.00 -0.06 -0.63 -1.51 0.00 0.00 177.10 175.13 1vgw s ILE 105 N 0.34 3.17 -0.69 0.60 1.01 0.10 -1.42 121.20 124.31 1vgw s ILE 105 Ca 0.33 -0.59 -0.14 0.00 0.00 0.00 0.00 60.65 60.25 1vgw s ILE 105 Cb -0.17 -2.44 0.18 0.00 0.01 0.00 0.00 42.46 40.03 1vgw s ILE 105 CO 0.16 0.42 0.63 -0.76 0.00 0.00 0.00 174.94 175.39 1vgw s LEU 106 N 1.44 6.42 -0.23 2.97 1.02 -0.31 -1.97 118.68 128.03 1vgw s LEU 106 Ca 0.05 -2.30 -0.29 0.00 0.02 0.00 0.00 54.13 51.62 1vgw s LEU 106 Cb -0.14 -2.19 0.00 0.00 0.02 0.00 0.00 46.19 43.88 1vgw s LEU 106 CO -0.05 -0.69 1.16 -0.69 0.02 0.00 0.00 176.35 176.11 1vgw s VAL 107 N 0.79 4.45 0.01 -1.59 1.01 -0.53 -1.42 120.40 123.12 1vgw s VAL 107 Ca 0.11 1.72 0.06 0.00 0.00 0.00 0.00 61.98 63.87 1vgw s VAL 107 Cb -0.19 -4.19 -0.02 0.00 0.00 0.00 0.00 36.38 31.98 1vgw s VAL 107 CO -0.03 -0.24 -0.18 -2.28 0.00 0.00 0.00 175.10 172.37 1vgw s HIS 108 N 3.51 1.57 0.25 5.22 5.04 -0.38 -1.09 115.29 129.42 1vgw s HIS 108 Ca 0.50 -0.33 -0.30 0.00 -1.54 0.00 0.00 55.06 53.39 1vgw s HIS 108 Cb -0.17 -0.97 -0.10 0.00 0.04 0.00 0.00 32.58 31.37 1vgw s HIS 108 CO 0.12 0.02 1.46 -0.51 -2.34 0.00 0.00 174.74 173.49 1vgw s ASP 109 N -0.77 6.63 0.53 9.88 -0.00 -1.26 -4.26 116.67 127.41 1vgw s ASP 109 Ca 0.06 2.68 0.32 0.00 -0.00 0.00 0.00 52.55 55.61 1vgw s ASP 109 Cb -0.08 -2.62 1.34 0.00 -0.00 0.00 0.00 42.92 41.56 1vgw s ASP 109 CO 0.00 -0.72 1.98 0.00 -0.00 0.00 0.00 175.17 176.43 1vgw h ALA 110 N 5.09 1.03 -0.02 5.23 0.00 -1.95 -2.65 119.26 125.99 1vgw h ALA 110 Ca -0.46 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.39 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 0.78 0.08 -0.10 0.00 0.00 0.00 0.00 179.25 180.02 1vgw n ALA 111 N -2.14 2.75 -3.01 0.00 0.00 -1.26 -4.53 120.51 112.32 1vgw n ALA 111 Ca 0.00 -0.49 -0.44 0.00 0.00 0.00 0.00 53.44 52.51 1vgw n ALA 111 Cb 0.31 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.69 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 0.14 3.68 -0.04 0.00 1.74 -1.00 -1.93 116.66 119.25 1vgw n ARG 112 Ca 0.16 -4.15 0.09 0.00 -0.77 0.00 0.00 57.85 53.18 1vgw n ARG 112 Cb 0.40 -2.75 0.43 0.00 -1.02 0.00 0.00 32.46 29.51 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 -0.84 2.65 -4.77 0.00 7.94 -1.25 -4.53 117.00 116.20 1vgw n LEU 115 Ca 0.11 0.87 -0.36 0.00 -1.11 0.00 0.00 56.01 55.51 1vgw n LEU 115 Cb 0.53 -1.24 -0.00 0.00 0.53 0.00 0.00 43.42 43.23 1vgw n LEU 115 CO 0.03 -0.39 0.82 -2.16 -1.11 0.00 0.00 177.39 174.58 1vgw s PRO 116 N 4.45 3.63 0.41 1.96 0.04 -1.26 -4.92 135.00 139.31 1vgw s PRO 116 Ca 1.00 1.74 0.17 0.00 0.04 0.00 0.00 61.00 63.94 1vgw s PRO 116 Cb -0.90 -2.29 0.89 0.00 0.04 0.00 0.00 34.50 32.25 1vgw s PRO 116 CO 0.57 -0.65 1.88 1.03 0.04 0.00 0.00 177.00 179.87 1vgw h SER 117 N 1.79 0.00 0.56 6.66 0.87 -1.95 -1.38 113.55 120.10 1vgw h SER 117 Ca -0.50 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 59.92 1vgw h SER 117 Cb 1.25 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.20 1vgw h SER 117 CO 0.59 0.30 -0.65 -0.08 -0.53 0.00 0.00 176.83 176.46 1vgw h GLU 118 N 0.00 0.08 -0.30 2.24 4.81 -2.00 -2.63 114.58 116.79 1vgw h GLU 118 Ca -0.00 -0.06 -0.18 0.00 -0.13 0.00 0.00 59.36 58.98 1vgw h GLU 118 Cb 0.59 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.98 1vgw h GLU 118 CO 0.04 0.70 -0.52 0.00 -0.73 0.00 0.00 179.01 178.50 1vgw h ALA 119 N 1.28 0.50 -0.64 2.92 0.00 -1.64 -1.93 119.26 119.76 1vgw h ALA 119 Ca -0.01 -0.51 -0.05 0.00 0.00 0.00 0.00 54.91 54.35 1vgw h ALA 119 Cb 1.16 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 1vgw h ALA 119 CO 0.09 0.68 0.20 1.25 0.00 0.00 0.00 179.25 181.47 1vgw h LEU 120 N 0.67 0.90 -0.70 0.00 5.85 -1.35 -2.43 115.31 118.25 1vgw h LEU 120 Ca 0.02 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 1vgw h LEU 120 Cb 1.13 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.89 1vgw h LEU 120 CO 0.12 0.84 0.35 0.00 -0.34 0.00 0.00 178.44 179.41 1vgw h ALA 121 N 1.28 0.90 -0.64 1.25 0.00 -1.26 -2.05 119.26 118.74 1vgw h ALA 121 Ca 0.21 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1vgw h ALA 121 Cb 0.27 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1vgw h ALA 121 CO -0.01 0.44 0.32 0.00 0.00 0.00 0.00 179.25 180.00 1vgw h ARG 122 N 0.97 0.92 0.01 0.00 3.08 -0.90 -0.70 114.38 117.77 1vgw h ARG 122 Ca 0.24 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 1vgw h ARG 122 Cb 0.09 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1vgw h ARG 122 CO -0.03 0.72 -0.01 1.25 -1.07 0.00 0.00 179.97 180.83 1vgw h LEU 123 N 0.88 -0.02 -0.96 3.04 5.85 -1.13 0.23 115.31 123.21 1vgw h LEU 123 Ca 0.22 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.80 1vgw h LEU 123 Cb 0.10 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.08 1vgw h LEU 123 CO -0.03 0.14 0.63 0.40 -0.34 0.00 0.00 178.44 179.25 1vgw h ILE 124 N -0.18 1.23 -0.14 4.05 2.04 -1.28 0.28 117.51 123.51 1vgw h ILE 124 Ca -0.00 -0.44 -0.09 0.00 1.00 0.00 0.00 64.86 65.33 1vgw h ILE 124 Cb 0.17 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1vgw h ILE 124 CO 0.00 0.23 -0.27 -0.08 0.00 0.00 0.00 178.15 178.04 1vgw h GLU 125 N 1.28 0.43 0.00 2.37 4.57 -1.03 0.34 114.58 122.54 1vgw h GLU 125 Ca 0.36 -0.28 -0.08 0.00 -1.18 0.00 0.00 59.36 58.19 1vgw h GLU 125 Cb -0.11 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.50 1vgw h GLU 125 CO -0.09 0.88 -0.95 1.96 -1.18 0.00 0.00 179.01 179.63 1vgw h GLN 126 N 0.04 0.00 0.00 1.92 4.20 -0.42 -3.38 115.11 117.46 1vgw h GLN 126 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1vgw h GLN 126 Cb 0.86 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.64 1vgw h GLN 126 CO 0.06 0.18 -0.36 0.00 -0.67 0.00 0.00 178.83 178.04 1vgw n ALA 127 N -2.25 2.46 0.23 3.87 0.00 0.98 -4.62 120.51 121.18 1vgw n ALA 127 Ca -0.03 -0.11 0.09 0.00 0.00 0.00 0.00 53.44 53.39 1vgw n ALA 127 Cb 0.68 -0.15 0.63 0.00 0.00 0.00 0.00 19.45 20.62 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 0.92 0.03 -1.28 0.00 0.00 -0.85 -2.89 103.07 99.01 1vgw h GLY 128 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1vgw h GLY 128 CO 0.00 0.01 0.00 0.70 0.00 0.00 0.00 176.54 177.25 1vgw n ASN 129 N -4.52 3.14 -4.54 0.19 3.02 -1.26 -4.96 115.26 106.33 1vgw n ASN 129 Ca -0.02 -2.31 -0.35 0.00 -0.03 0.00 0.00 54.58 51.87 1vgw n ASN 129 Cb 0.13 -0.31 -0.11 0.00 -0.61 0.00 0.00 39.78 38.87 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 -1.56 3.23 0.41 5.41 0.00 -1.09 -4.99 121.76 123.17 1vgw s ALA 130 Ca 0.28 -0.89 0.11 0.00 0.00 0.00 0.00 51.96 51.45 1vgw s ALA 130 Cb 0.18 -1.89 0.92 0.00 0.00 0.00 0.00 23.12 22.33 1vgw s ALA 130 CO 0.13 -0.03 1.97 0.00 0.00 0.00 0.00 175.76 177.82 1vgw h ALA 131 N 7.20 1.89 0.00 0.00 0.00 -1.93 -2.10 119.26 124.32 1vgw h ALA 131 Ca -0.36 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1vgw h ALA 131 Cb 1.18 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1vgw h ALA 131 CO 0.64 -0.02 0.00 1.05 0.00 0.00 0.00 179.25 180.92 1vgw h GLU 132 N 0.54 0.00 0.00 0.00 9.09 -1.92 -3.43 114.58 118.85 1vgw h GLU 132 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.70 1vgw h GLU 132 Cb 0.44 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.54 1vgw h GLU 132 CO -0.09 0.00 0.00 0.41 0.05 0.00 0.00 179.01 179.38 1vgw n GLY 133 N 0.83 -1.78 0.00 1.06 0.00 -0.79 -4.28 105.19 100.23 1vgw n GLY 133 Ca 0.04 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.52 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 0.41 3.05 -0.02 0.00 -1.01 -1.19 105.19 106.42 1vgw n GLY 134 Ca 0.00 -0.76 -0.09 0.00 0.00 0.00 0.00 46.02 45.17 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 0.15 0.25 -0.61 -4.36 -0.89 -1.57 121.20 112.17 1vgw s ILE 135 Ca 0.00 -1.21 -0.30 0.00 -0.26 0.00 0.00 60.65 58.88 1vgw s ILE 135 Cb 0.00 -0.79 -0.09 0.00 1.25 0.00 0.00 42.46 42.83 1vgw s ILE 135 CO 0.00 -0.67 1.03 -0.76 0.24 0.00 0.00 174.94 174.78 1vgw s LEU 136 N -2.05 4.59 -0.01 0.37 1.43 -1.12 -0.65 118.68 121.23 1vgw s LEU 136 Ca -0.07 2.12 -0.25 0.00 -1.03 0.00 0.00 54.13 54.90 1vgw s LEU 136 Cb -0.02 -3.62 0.06 0.00 0.03 0.00 0.00 46.19 42.63 1vgw s LEU 136 CO -0.04 -0.02 0.56 0.00 0.23 0.00 0.00 176.35 177.07 1vgw s ALA 137 N -1.09 -1.44 -0.07 4.21 0.00 -0.11 -1.24 121.76 122.03 1vgw s ALA 137 Ca 0.43 0.90 0.05 0.00 0.00 0.00 0.00 51.96 53.35 1vgw s ALA 137 Cb -0.29 0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.94 1vgw s ALA 137 CO 0.37 -0.39 -0.24 0.14 0.00 0.00 0.00 175.76 175.65 1vgw s VAL 138 N -1.57 2.17 0.33 0.00 -7.23 0.13 -1.86 120.40 112.37 1vgw s VAL 138 Ca -0.10 -1.02 -0.29 0.00 -1.81 0.00 0.00 61.98 58.76 1vgw s VAL 138 Cb -0.01 -1.80 -0.12 0.00 0.56 0.00 0.00 36.38 35.01 1vgw s VAL 138 CO 0.05 0.57 1.49 -2.65 -0.31 0.00 0.00 175.10 174.25 1vgw n PRO 139 N 3.02 2.54 -2.33 4.82 -0.02 -1.26 -0.20 135.00 141.56 1vgw n PRO 139 Ca -0.18 0.90 -0.41 0.00 -2.02 0.00 0.00 63.50 61.79 1vgw n PRO 139 Cb 0.52 -2.61 -0.03 0.00 -0.02 0.00 0.00 33.50 31.36 1vgw n PRO 139 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1vgw s VAL 140 N -0.66 3.74 -0.12 -1.45 1.01 -0.85 -4.82 120.40 117.25 1vgw s VAL 140 Ca 0.58 0.63 0.22 0.00 0.00 0.00 0.00 61.98 63.41 1vgw s VAL 140 Cb -0.51 -4.33 -0.19 0.00 0.00 0.00 0.00 36.38 31.34 1vgw s VAL 140 CO 0.57 -1.08 0.70 0.00 0.00 0.00 0.00 175.10 175.29 1vgw n ALA 141 N 9.84 2.56 -2.48 5.51 0.00 -1.26 -4.90 120.51 129.78 1vgw n ALA 141 Ca 0.14 -0.46 -0.31 0.00 0.00 0.00 0.00 53.44 52.81 1vgw n ALA 141 Cb 0.49 -0.87 -0.05 0.00 0.00 0.00 0.00 19.45 19.02 1vgw n ALA 141 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1vgw s ASP 142 N -4.99 6.58 0.27 0.00 -0.00 -1.26 -5.04 116.67 112.22 1vgw s ASP 142 Ca -0.05 0.83 -0.31 0.00 -0.00 0.00 0.00 52.55 53.02 1vgw s ASP 142 Cb 0.11 -2.19 -0.13 0.00 -0.00 0.00 0.00 42.92 40.72 1vgw s ASP 142 CO 0.85 -0.06 1.48 0.41 -0.00 0.00 0.00 175.17 177.85 1vgw n THR 143 N -0.19 1.03 -3.76 -1.27 -1.04 -1.26 -4.94 114.28 102.86 1vgw n THR 143 Ca -0.00 -0.26 -0.37 0.00 -2.04 0.00 0.00 64.05 61.38 1vgw n THR 143 Cb 0.52 -1.67 -0.06 0.00 -1.82 0.00 0.00 70.33 67.30 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 -0.19 4.41 -0.04 -4.42 1.43 -1.26 -5.05 118.68 113.57 1vgw s LEU 144 Ca 0.66 0.62 0.05 0.00 -1.03 0.00 0.00 54.13 54.42 1vgw s LEU 144 Cb -0.58 -2.23 -0.01 0.00 0.03 0.00 0.00 46.19 43.40 1vgw s LEU 144 CO 0.50 0.38 -0.18 -0.54 0.23 0.00 0.00 176.35 176.74 1vgw s LYS 145 N -1.02 1.79 -0.06 1.70 -0.14 -1.26 -1.57 119.74 119.18 1vgw s LYS 145 Ca 0.18 -0.64 -0.18 0.00 -1.36 0.00 0.00 55.97 53.96 1vgw s LYS 145 Cb -0.13 -1.59 -0.05 0.00 -1.68 0.00 0.00 37.83 34.38 1vgw s LYS 145 CO 0.07 0.29 0.48 0.50 -0.76 0.00 0.00 175.35 175.92 1vgw s ARG 146 N -0.07 4.23 0.09 1.68 3.52 0.28 -4.89 118.95 123.79 1vgw s ARG 146 Ca -0.02 0.49 0.02 0.00 -0.13 0.00 0.00 55.73 56.09 1vgw s ARG 146 Cb -0.11 -3.36 -0.04 0.00 -1.56 0.00 0.00 34.95 29.88 1vgw s ARG 146 CO 0.02 0.34 0.18 0.00 -0.81 0.00 0.00 175.30 175.03 1vgw s ALA 147 N 0.01 3.84 0.00 6.12 0.00 -1.26 -1.63 121.76 128.83 1vgw s ALA 147 Ca 0.26 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 51.26 1vgw s ALA 147 Cb -0.16 -1.67 0.00 0.00 0.00 0.00 0.00 23.12 21.29 1vgw s ALA 147 CO 0.12 0.72 0.00 -1.91 0.00 0.00 0.00 175.76 174.69 1vgw n GLU 148 N 0.11 0.00 -2.77 0.00 2.13 -0.18 -4.82 120.64 115.11 1vgw n GLU 148 Ca -0.07 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.55 1vgw n GLU 148 Cb 0.52 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.22 1vgw n GLU 148 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1vgw n SER 149 N -1.04 3.08 0.00 4.31 2.88 -1.26 -4.78 113.62 116.81 1vgw n SER 149 Ca 0.00 -3.32 0.00 0.00 -1.33 0.00 0.00 58.87 54.22 1vgw n SER 149 Cb 0.00 -0.53 0.00 0.00 -0.75 0.00 0.00 64.21 62.93 1vgw n SER 149 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vgw n GLY 150 N -0.17 0.72 3.19 0.46 0.00 -1.26 -5.07 105.19 103.05 1vgw n GLY 150 Ca 0.27 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.17 1vgw n GLY 150 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1vgw s GLN 151 N -1.00 0.88 -0.06 1.61 -2.07 -1.26 -5.12 119.66 112.64 1vgw s GLN 151 Ca 0.00 -1.36 -0.30 0.00 -1.82 0.00 0.00 55.36 51.88 1vgw s GLN 151 Cb 0.00 -0.30 -0.04 0.00 -1.09 0.00 0.00 33.01 31.59 1vgw s GLN 151 CO 0.00 0.00 1.26 0.42 -1.32 0.00 0.00 175.29 175.66 1vgw s ILE 152 N -3.55 4.12 -0.07 3.63 1.01 -1.26 -1.01 121.20 124.07 1vgw s ILE 152 Ca 0.13 1.45 0.18 0.00 0.00 0.00 0.00 60.65 62.41 1vgw s ILE 152 Cb 0.05 -3.93 -0.28 0.00 0.01 0.00 0.00 42.46 38.31 1vgw s ILE 152 CO -0.04 -0.02 0.32 -1.54 0.00 0.00 0.00 174.94 173.66 1vgw n SER 153 N 5.47 0.60 -3.57 3.58 3.41 -0.65 -4.89 113.62 117.57 1vgw n SER 153 Ca 0.12 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.67 1vgw n SER 153 Cb 0.45 1.60 -0.02 0.00 -0.26 0.00 0.00 64.21 65.99 1vgw n SER 153 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vgw s ALA 154 N -3.07 -1.89 -0.39 7.33 0.00 -1.17 -4.98 121.76 117.58 1vgw s ALA 154 Ca -0.08 0.99 -0.10 0.00 0.00 0.00 0.00 51.96 52.78 1vgw s ALA 154 Cb 0.10 0.32 0.05 0.00 0.00 0.00 0.00 23.12 23.59 1vgw s ALA 154 CO 0.78 -0.75 0.23 0.99 0.00 0.00 0.00 175.76 177.01 1vgw s THR 155 N -2.92 4.36 0.11 0.00 2.01 -1.26 0.99 115.64 118.93 1vgw s THR 155 Ca 0.08 -1.14 -0.20 0.00 0.31 0.00 0.00 61.69 60.74 1vgw s THR 155 Cb -0.01 -3.55 -0.07 0.00 0.01 0.00 0.00 72.50 68.88 1vgw s THR 155 CO -0.06 -0.36 0.62 0.54 -0.69 0.00 0.00 174.62 174.67 1vgw s VAL 156 N 1.48 4.66 0.17 3.82 0.11 -0.61 -4.94 120.40 125.10 1vgw s VAL 156 Ca 0.02 1.29 -0.32 0.00 -2.93 0.00 0.00 61.98 60.05 1vgw s VAL 156 Cb -0.21 -3.93 -0.10 0.00 -1.53 0.00 0.00 36.38 30.61 1vgw s VAL 156 CO 0.04 0.49 1.58 -0.62 -3.33 0.00 0.00 175.10 173.27 1vgw s ASP 157 N -1.22 6.56 -0.00 3.54 2.15 -1.26 -3.98 116.67 122.47 1vgw s ASP 157 Ca 0.32 2.65 0.18 0.00 0.43 0.00 0.00 52.55 56.13 1vgw s ASP 157 Cb -0.20 -2.60 0.51 0.00 -0.30 0.00 0.00 42.92 40.34 1vgw s ASP 157 CO 0.21 -0.84 1.42 -2.11 -0.17 0.00 0.00 175.17 173.68 1vgw n ARG 158 N 3.88 2.81 -1.68 4.34 0.00 -1.26 -4.98 116.66 119.77 1vgw n ARG 158 Ca 0.14 -2.42 -0.46 0.00 -0.00 0.00 0.00 57.85 55.11 1vgw n ARG 158 Cb 0.38 -1.45 -0.04 0.00 -0.00 0.00 0.00 32.46 31.35 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 1.16 3.39 -0.93 2.89 2.88 -1.26 -1.86 113.62 119.90 1vgw n SER 159 Ca 0.19 1.02 -0.12 0.00 -1.33 0.00 0.00 58.87 58.63 1vgw n SER 159 Cb 0.55 -1.42 -0.05 0.00 -0.75 0.00 0.00 64.21 62.53 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 3.94 1.30 3.92 0.46 0.00 -1.26 -5.01 105.19 108.54 1vgw n GLY 160 Ca 0.19 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.75 4.35 0.06 0.99 1.43 -0.78 -5.06 118.68 116.91 1vgw s LEU 161 Ca 0.00 0.32 0.01 0.00 -1.03 0.00 0.00 54.13 53.44 1vgw s LEU 161 Cb 0.00 -2.98 -0.03 0.00 0.03 0.00 0.00 46.19 43.21 1vgw s LEU 161 CO 0.00 0.16 -0.06 0.26 0.23 0.00 0.00 176.35 176.94 1vgw s TRP 162 N -1.51 0.64 -0.21 0.29 0.52 -1.26 -2.00 118.94 115.41 1vgw s TRP 162 Ca 0.35 -0.72 -0.07 0.00 0.02 0.00 0.00 56.10 55.69 1vgw s TRP 162 Cb -0.13 -0.40 -0.03 0.00 -1.15 0.00 0.00 33.47 31.76 1vgw s TRP 162 CO 0.27 -0.17 0.05 -0.65 0.02 0.00 0.00 176.95 176.47 1vgw s GLN 163 N -2.59 3.77 0.09 4.98 -0.21 0.72 -4.88 119.66 121.53 1vgw s GLN 163 Ca -0.02 -0.44 -0.30 0.00 0.02 0.00 0.00 55.36 54.62 1vgw s GLN 163 Cb -0.03 -3.22 -0.05 0.00 1.00 0.00 0.00 33.01 30.72 1vgw s GLN 163 CO -0.03 0.04 0.99 0.00 -2.12 0.00 0.00 175.29 174.17 1vgw s ALA 164 N 0.98 3.24 0.00 6.09 0.00 -1.26 0.19 121.76 130.99 1vgw s ALA 164 Ca 0.03 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.59 1vgw s ALA 164 Cb -0.14 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.67 1vgw s ALA 164 CO 0.03 -0.11 0.00 1.04 0.00 0.00 0.00 175.76 176.72 1vgw n GLN 165 N 3.09 2.60 -4.18 0.00 6.02 -0.38 -4.94 117.38 119.60 1vgw n GLN 165 Ca 0.04 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.91 1vgw n GLN 165 Cb 0.49 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.65 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 0.22 0.78 0.84 5.09 -4.23 -1.26 -4.49 115.64 112.59 1vgw s THR 166 Ca 0.00 -1.87 -0.11 0.00 -1.18 0.00 0.00 61.69 58.53 1vgw s THR 166 Cb 0.00 -1.61 0.10 0.00 1.34 0.00 0.00 72.50 72.33 1vgw s THR 166 CO 0.00 -0.79 1.10 -2.84 -0.54 0.00 0.00 174.62 171.55 1vgw s PRO 167 N -3.57 1.71 -0.29 3.99 0.02 -1.26 -4.79 135.00 130.80 1vgw s PRO 167 Ca 0.11 1.12 0.01 0.00 0.02 0.00 0.00 61.00 62.26 1vgw s PRO 167 Cb 0.03 -1.84 0.07 0.00 0.02 0.00 0.00 34.50 32.78 1vgw s PRO 167 CO -0.03 -2.01 -0.03 -0.65 -0.33 0.00 0.00 177.00 173.94 1vgw s GLN 168 N -4.86 2.15 -0.31 5.54 -0.21 -0.25 -2.80 119.66 118.93 1vgw s GLN 168 Ca 0.63 -1.44 -0.12 0.00 0.02 0.00 0.00 55.36 54.44 1vgw s GLN 168 Cb -0.18 -3.07 -0.03 0.00 1.00 0.00 0.00 33.01 30.73 1vgw s GLN 168 CO 0.57 -0.68 0.24 -1.17 -2.12 0.00 0.00 175.29 172.14 1vgw s LEU 169 N 1.11 4.26 0.05 2.90 2.96 -0.61 -1.46 118.68 127.90 1vgw s LEU 169 Ca -0.04 -0.16 -0.04 0.00 -0.22 0.00 0.00 54.13 53.67 1vgw s LEU 169 Cb -0.20 -2.18 -0.02 0.00 0.50 0.00 0.00 46.19 44.29 1vgw s LEU 169 CO -0.04 -0.16 0.06 -0.36 -1.32 0.00 0.00 176.35 174.53 1vgw s PHE 170 N 1.80 0.31 0.37 5.38 0.40 -0.83 -2.42 117.98 123.00 1vgw s PHE 170 Ca 0.08 -0.73 -0.27 0.00 -0.60 0.00 0.00 56.93 55.41 1vgw s PHE 170 Cb -0.17 -0.22 -0.10 0.00 0.51 0.00 0.00 43.02 43.05 1vgw s PHE 170 CO 0.11 -0.40 1.36 -0.65 0.70 0.00 0.00 175.22 176.34 1vgw s GLN 171 N -3.30 4.12 0.16 0.44 -0.21 -1.26 -0.72 119.66 118.89 1vgw s GLN 171 Ca 0.01 2.31 -0.18 0.00 0.02 0.00 0.00 55.36 57.52 1vgw s GLN 171 Cb 0.03 -2.92 0.09 0.00 1.00 0.00 0.00 33.01 31.21 1vgw s GLN 171 CO -0.08 -0.42 1.66 0.00 -2.12 0.00 0.00 175.29 174.34 1vgw h ALA 172 N 2.99 0.21 -0.69 6.09 0.00 -0.91 -1.33 119.26 125.62 1vgw h ALA 172 Ca -0.50 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 1vgw h ALA 172 Cb 1.24 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 19.33 1vgw h ALA 172 CO 0.64 -0.48 0.28 0.78 0.00 0.00 0.00 179.25 180.46 1vgw h GLY 173 N -0.04 1.09 0.89 0.00 0.00 -1.57 -1.31 103.07 102.13 1vgw h GLY 173 Ca 0.18 -0.57 -0.04 0.00 0.00 0.00 0.00 47.33 46.91 1vgw h GLY 173 CO -0.41 0.54 0.05 -2.00 0.00 0.00 0.00 176.54 174.72 1vgw h LEU 174 N 0.99 0.48 -0.32 3.11 5.85 -1.64 -2.38 115.31 121.40 1vgw h LEU 174 Ca 0.23 -0.26 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 1vgw h LEU 174 Cb 0.19 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1vgw h LEU 174 CO -0.02 0.61 -0.02 0.25 -0.34 0.00 0.00 178.44 178.92 1vgw h LEU 175 N 0.32 0.57 -0.69 2.25 5.85 -1.12 0.21 115.31 122.69 1vgw h LEU 175 Ca 0.09 -0.33 0.09 0.00 0.84 0.00 0.00 57.88 58.58 1vgw h LEU 175 Cb 0.34 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.15 1vgw h LEU 175 CO 0.01 0.76 0.33 -0.74 -0.34 0.00 0.00 178.44 178.45 1vgw h HIS 176 N 0.36 0.59 -0.33 1.25 2.76 -1.24 -1.41 115.15 117.13 1vgw h HIS 176 Ca 0.09 0.03 -0.18 0.00 -2.20 0.00 0.00 60.37 58.11 1vgw h HIS 176 Cb 0.48 -0.16 -0.00 0.00 1.55 0.00 0.00 27.41 29.28 1vgw h HIS 176 CO 0.04 0.20 -0.48 -0.09 -1.30 0.00 0.00 177.93 176.30 1vgw h ARG 177 N 0.56 0.91 0.00 5.26 1.12 -0.90 -2.94 114.38 118.39 1vgw h ARG 177 Ca 0.34 -0.53 -0.01 0.00 -1.11 0.00 0.00 59.98 58.67 1vgw h ARG 177 Cb 0.38 0.04 -0.00 0.00 -0.01 0.00 0.00 29.97 30.38 1vgw h ARG 177 CO -0.28 1.18 -0.04 0.00 -3.11 0.00 0.00 179.97 177.72 1vgw h ALA 178 N 0.73 1.09 -0.52 2.80 0.00 -0.51 -2.17 119.26 120.68 1vgw h ALA 178 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1vgw h ALA 178 Cb 1.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1vgw h ALA 178 CO 0.11 0.04 0.00 1.28 0.00 0.00 0.00 179.25 180.69 1vgw n LEU 179 N -3.27 3.53 -0.33 0.00 4.77 -0.57 -4.73 117.00 116.40 1vgw n LEU 179 Ca -0.02 -1.63 0.00 0.00 -0.03 0.00 0.00 56.01 54.33 1vgw n LEU 179 Cb 0.19 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1vgw n LEU 179 CO 0.25 0.82 0.28 0.00 -1.33 0.00 0.00 177.39 177.41 1vgw n ALA 180 N 1.48 2.28 -0.43 -1.18 0.00 -0.82 -5.01 120.51 116.83 1vgw n ALA 180 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1vgw n ALA 180 Cb 0.59 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.04 1vgw n ALA 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vgw n GLY 186 N 0.17 0.00 3.76 0.00 0.00 -1.26 -5.16 105.19 102.69 1vgw n GLY 186 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1vgw n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vgw s ILE 187 N 1.18 4.48 0.00 -0.61 1.01 -1.26 -5.06 121.20 120.94 1vgw s ILE 187 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 60.65 59.98 1vgw s ILE 187 Cb 0.00 -3.10 0.00 0.00 0.01 0.00 0.00 42.46 39.37 1vgw s ILE 187 CO 0.00 0.22 0.00 0.35 0.00 0.00 0.00 174.94 175.51 1vgw n THR 188 N 0.80 0.00 -2.26 2.92 -2.24 -1.26 -5.09 114.28 107.15 1vgw n THR 188 Ca -0.11 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.42 1vgw n THR 188 Cb 0.52 -0.10 0.07 0.00 -2.10 0.00 0.00 70.33 68.72 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 0.45 4.78 0.28 3.42 3.84 -1.26 -4.95 116.67 123.23 1vgw s ASP 189 Ca 0.00 0.35 -0.03 0.00 -0.00 0.00 0.00 52.55 52.87 1vgw s ASP 189 Cb 0.00 -0.99 0.39 0.00 -1.38 0.00 0.00 42.92 40.93 1vgw s ASP 189 CO 0.00 -1.60 1.93 -0.33 -0.00 0.00 0.00 175.17 175.17 1vgw h GLU 190 N -0.56 1.17 -0.80 2.11 3.07 -1.99 -1.67 114.58 115.92 1vgw h GLU 190 Ca -0.44 -0.07 0.14 0.00 -0.50 0.00 0.00 59.36 58.49 1vgw h GLU 190 Cb 1.31 -0.26 -0.06 0.00 -0.84 0.00 0.00 28.75 28.90 1vgw h GLU 190 CO 0.58 0.77 0.53 0.00 -1.40 0.00 0.00 179.01 179.48 1vgw h ALA 191 N 1.44 1.97 0.00 3.43 0.00 -1.96 -1.90 119.26 122.25 1vgw h ALA 191 Ca 0.36 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.18 1vgw h ALA 191 Cb -0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1vgw h ALA 191 CO -0.10 -0.18 -0.44 0.66 0.00 0.00 0.00 179.25 179.19 1vgw h SER 192 N 0.54 0.00 0.27 0.00 4.64 -1.67 -1.13 113.55 116.21 1vgw h SER 192 Ca 0.39 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.57 1vgw h SER 192 Cb 0.75 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.82 1vgw h SER 192 CO -0.15 0.44 -0.54 0.00 -0.87 0.00 0.00 176.83 175.71 1vgw h ALA 193 N 1.56 0.89 0.21 5.18 0.00 -1.35 -3.06 119.26 122.69 1vgw h ALA 193 Ca -0.00 -0.50 -0.32 0.00 0.00 0.00 0.00 54.91 54.08 1vgw h ALA 193 Cb 0.96 -0.09 0.04 0.00 0.00 0.00 0.00 17.79 18.70 1vgw h ALA 193 CO 0.06 0.69 -1.40 0.28 0.00 0.00 0.00 179.25 178.87 1vgw h VAL 194 N 0.23 1.29 -0.94 0.00 2.07 -1.26 -3.18 116.25 114.46 1vgw h VAL 194 Ca 0.00 -2.62 0.14 0.00 0.82 0.00 0.00 66.70 65.04 1vgw h VAL 194 Cb 1.03 2.92 -0.08 0.00 -1.52 0.00 0.00 31.29 33.64 1vgw h VAL 194 CO 0.09 0.79 0.60 -0.33 0.02 0.00 0.00 177.57 178.73 1vgw h GLU 195 N 0.20 0.77 0.00 1.57 5.08 -1.25 -0.25 114.58 120.70 1vgw h GLU 195 Ca -0.23 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1vgw h GLU 195 Cb 2.08 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 31.16 1vgw h GLU 195 CO 0.26 0.51 -0.01 0.87 -1.00 0.00 0.00 179.01 179.64 1vgw h LYS 196 N 0.80 0.00 0.00 2.33 1.57 -1.51 -1.55 116.57 118.20 1vgw h LYS 196 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1vgw h LYS 196 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1vgw h LYS 196 CO -0.24 0.01 0.00 1.28 -0.57 0.00 0.00 179.45 179.93 1vgw n LEU 197 N -3.19 0.00 0.00 2.94 4.32 -0.11 -4.87 117.00 116.09 1vgw n LEU 197 Ca -0.02 0.31 0.00 0.00 -0.02 0.00 0.00 56.01 56.28 1vgw n LEU 197 Cb 0.14 -0.31 0.00 0.00 -1.62 0.00 0.00 43.42 41.62 1vgw n LEU 197 CO 0.23 -0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.01 1vgw n GLY 198 N 1.30 0.66 3.73 -0.72 0.00 -0.58 -5.07 105.19 104.51 1vgw n GLY 198 Ca 0.13 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.29 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 4.79 -0.37 1.61 1.01 -1.22 -5.05 120.40 119.17 1vgw s VAL 199 Ca 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 61.98 61.87 1vgw s VAL 199 Cb 0.00 -3.07 0.07 0.00 0.00 0.00 0.00 36.38 33.38 1vgw s VAL 199 CO 0.00 0.58 0.16 -0.13 0.00 0.00 0.00 175.10 175.70 1vgw s ARG 200 N -0.62 2.42 0.57 2.72 0.52 -1.26 -3.63 118.95 119.66 1vgw s ARG 200 Ca 0.11 -1.45 -0.17 0.00 -0.52 0.00 0.00 55.73 53.70 1vgw s ARG 200 Cb -0.12 -3.53 -0.04 0.00 0.52 0.00 0.00 34.95 31.78 1vgw s ARG 200 CO 0.02 -0.85 1.08 -2.14 0.02 0.00 0.00 175.30 173.44 1vgw s PRO 201 N 1.31 3.30 0.62 3.54 0.02 -1.26 -4.86 135.00 137.67 1vgw s PRO 201 Ca 0.02 1.38 -0.12 0.00 0.02 0.00 0.00 61.00 62.30 1vgw s PRO 201 Cb -0.21 -2.02 -0.03 0.00 0.02 0.00 0.00 34.50 32.25 1vgw s PRO 201 CO 0.00 -0.85 1.03 -0.51 -0.33 0.00 0.00 177.00 176.34 1vgw s LEU 202 N -4.21 3.27 -0.29 -5.54 1.43 -0.34 -4.87 118.68 108.13 1vgw s LEU 202 Ca 0.67 1.50 -0.06 0.00 -1.03 0.00 0.00 54.13 55.22 1vgw s LEU 202 Cb -0.19 -4.48 0.02 0.00 0.03 0.00 0.00 46.19 41.56 1vgw s LEU 202 CO 0.32 -0.97 0.06 -0.76 0.23 0.00 0.00 176.35 175.23 1vgw s LEU 203 N -5.09 3.80 -0.06 1.79 1.43 -1.26 -2.08 118.68 117.21 1vgw s LEU 203 Ca 0.57 -0.82 -0.01 0.00 -1.03 0.00 0.00 54.13 52.83 1vgw s LEU 203 Cb -0.12 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 1vgw s LEU 203 CO 0.51 -0.20 0.01 -0.63 0.23 0.00 0.00 176.35 176.26 1vgw s ILE 204 N 1.44 4.32 0.15 -0.59 1.09 0.17 -4.95 121.20 122.83 1vgw s ILE 204 Ca 0.01 -0.32 -0.33 0.00 -1.10 0.00 0.00 60.65 58.91 1vgw s ILE 204 Cb -0.18 -2.85 -0.13 0.00 -1.06 0.00 0.00 42.46 38.25 1vgw s ILE 204 CO 0.01 0.55 1.70 1.67 -0.10 0.00 0.00 174.94 178.77 1vgw n GLN 205 N 1.94 2.47 0.00 2.79 -0.06 -1.26 -0.93 117.38 122.33 1vgw n GLN 205 Ca -0.17 0.89 0.00 0.00 -2.00 0.00 0.00 57.00 55.72 1vgw n GLN 205 Cb 0.53 -2.72 0.00 0.00 -4.06 0.00 0.00 30.24 23.99 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 3.83 1.69 3.59 1.69 0.00 -0.78 -4.70 105.19 110.51 1vgw n GLY 206 Ca 0.17 -1.50 -0.11 0.00 0.00 0.00 0.00 46.02 44.58 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 -0.46 0.59 1.61 3.68 -1.26 -4.96 116.67 114.88 1vgw s ASP 207 Ca 0.00 0.65 0.31 0.00 2.13 0.00 0.00 52.55 55.64 1vgw s ASP 207 Cb 0.00 0.58 1.84 0.00 -1.45 0.00 0.00 42.92 43.89 1vgw s ASP 207 CO 0.00 -0.32 2.25 0.00 0.13 0.00 0.00 175.17 177.23 1vgw h ALA 208 N 3.26 1.46 0.00 3.66 0.00 -2.01 0.22 119.26 125.85 1vgw h ALA 208 Ca -0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1vgw h ALA 208 Cb 1.16 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1vgw h ALA 208 CO 0.25 0.02 0.00 0.54 0.00 0.00 0.00 179.25 180.05 1vgw n ARG 209 N -3.77 0.11 -1.55 0.00 1.74 -1.26 -3.95 116.66 107.98 1vgw n ARG 209 Ca -0.03 0.19 -0.29 0.00 -0.77 0.00 0.00 57.85 56.96 1vgw n ARG 209 Cb 0.10 -1.65 -0.05 0.00 -1.02 0.00 0.00 32.46 29.83 1vgw n ARG 209 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1vgw n ASN 210 N -1.84 6.68 -4.90 0.55 5.15 0.78 -4.47 115.26 117.21 1vgw n ASN 210 Ca 0.05 -3.17 -0.29 0.00 -0.60 0.00 0.00 54.58 50.57 1vgw n ASN 210 Cb 0.31 -1.26 -0.03 0.00 -0.53 0.00 0.00 39.78 38.26 1vgw n ASN 210 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1vgw s LEU 211 N -2.10 4.09 -0.06 1.20 1.02 -1.25 -4.89 118.68 116.69 1vgw s LEU 211 Ca 0.58 0.72 -0.25 0.00 0.02 0.00 0.00 54.13 55.20 1vgw s LEU 211 Cb 0.35 -3.52 -0.03 0.00 0.02 0.00 0.00 46.19 43.01 1vgw s LEU 211 CO -0.20 -0.16 0.77 -0.75 0.02 0.00 0.00 176.35 176.03 1vgw s LYS 212 N -3.41 4.45 -0.56 1.70 2.20 -1.26 -4.35 119.74 118.51 1vgw s LYS 212 Ca 0.44 1.00 -0.21 0.00 -0.36 0.00 0.00 55.97 56.84 1vgw s LYS 212 Cb -0.11 -3.46 0.07 0.00 -1.51 0.00 0.00 37.83 32.82 1vgw s LYS 212 CO 0.29 0.01 0.77 -1.17 -0.36 0.00 0.00 175.35 174.89 1vgw s LEU 213 N 0.93 4.75 0.00 5.43 2.96 -0.81 -4.78 118.68 127.16 1vgw s LEU 213 Ca 0.40 -0.91 0.00 0.00 -0.22 0.00 0.00 54.13 53.41 1vgw s LEU 213 Cb -0.18 -2.50 0.00 0.00 0.50 0.00 0.00 46.19 44.01 1vgw s LEU 213 CO 0.20 -1.11 0.00 0.35 -1.32 0.00 0.00 176.35 174.46 1vgw n THR 214 N 5.79 0.00 -4.00 3.68 -2.24 -1.26 -4.88 114.28 111.36 1vgw n THR 214 Ca -0.05 -0.32 -0.12 0.00 -2.27 0.00 0.00 64.05 61.30 1vgw n THR 214 Cb 0.45 0.92 -0.12 0.00 -2.10 0.00 0.00 70.33 69.48 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 -0.82 0.32 0.31 -0.78 -2.07 -1.26 -5.04 119.66 110.32 1vgw s GLN 215 Ca 0.00 -0.45 0.07 0.00 -1.82 0.00 0.00 55.36 53.16 1vgw s GLN 215 Cb 0.00 -0.10 0.86 0.00 -1.09 0.00 0.00 33.01 32.68 1vgw s GLN 215 CO 0.00 0.01 1.64 -1.35 -1.32 0.00 0.00 175.29 174.27 1vgw h PRO 216 N 5.15 0.19 -0.69 9.60 0.11 -2.02 0.17 132.00 144.51 1vgw h PRO 216 Ca -0.31 -0.01 0.20 0.00 0.11 0.00 0.00 66.00 65.99 1vgw h PRO 216 Cb 1.21 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 1vgw h PRO 216 CO 0.45 0.12 0.50 0.37 -0.21 0.00 0.00 178.00 179.23 1vgw h GLN 217 N 0.19 0.00 -0.01 1.05 4.15 -2.04 -1.66 115.11 116.79 1vgw h GLN 217 Ca 0.63 0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.05 1vgw h GLN 217 Cb 1.36 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.05 1vgw h GLN 217 CO -0.69 0.00 -0.18 -0.25 -1.93 0.00 0.00 178.83 175.78 1vgw n ASP 218 N -4.29 1.31 0.25 -0.69 10.43 0.59 -4.17 116.55 120.00 1vgw n ASP 218 Ca 0.14 -1.16 0.11 0.00 2.57 0.00 0.00 54.79 56.44 1vgw n ASP 218 Cb 0.77 0.11 0.68 0.00 1.84 0.00 0.00 41.12 44.52 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 3.94 1.46 0.64 2.24 0.00 -1.38 -2.84 119.26 123.32 1vgw h ALA 219 Ca 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1vgw h ALA 219 Cb 0.54 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.32 1vgw h ALA 219 CO 0.00 0.15 -0.31 -0.92 0.00 0.00 0.00 179.25 178.18 1vgw h TYR 220 N 0.00 -0.80 -0.27 0.00 5.03 -1.78 -0.93 116.97 118.22 1vgw h TYR 220 Ca -0.00 -0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.26 1vgw h TYR 220 Cb 0.28 0.26 -0.01 0.00 1.55 0.00 0.00 36.73 38.81 1vgw h TYR 220 CO 0.00 -0.46 0.03 0.82 -1.32 0.00 0.00 178.16 177.23 1vgw h ILE 221 N -1.13 1.15 -0.18 1.81 2.04 -1.83 -1.95 117.51 117.41 1vgw h ILE 221 Ca -0.09 -0.56 -0.05 0.00 1.00 0.00 0.00 64.86 65.16 1vgw h ILE 221 Cb 0.70 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1vgw h ILE 221 CO 0.14 0.19 -0.09 0.58 0.00 0.00 0.00 178.15 178.98 1vgw h VAL 222 N 0.39 1.31 -0.69 1.67 2.07 -1.46 -1.41 116.25 118.12 1vgw h VAL 222 Ca 0.09 -1.15 0.03 0.00 0.82 0.00 0.00 66.70 66.49 1vgw h VAL 222 Cb 0.21 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 1vgw h VAL 222 CO 0.00 0.35 0.46 -0.09 0.02 0.00 0.00 177.57 178.30 1vgw h ARG 223 N 0.07 0.81 -0.04 1.57 9.65 -0.92 -1.38 114.38 124.14 1vgw h ARG 223 Ca 0.04 -0.05 -0.16 0.00 -1.10 0.00 0.00 59.98 58.71 1vgw h ARG 223 Cb 0.58 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.96 1vgw h ARG 223 CO 0.03 0.53 -0.70 1.25 2.80 0.00 0.00 179.97 183.88 1vgw h LEU 224 N 0.83 0.26 -0.12 3.80 5.85 -1.25 -3.25 115.31 121.42 1vgw h LEU 224 Ca 0.28 -0.17 -0.20 0.00 0.84 0.00 0.00 57.88 58.62 1vgw h LEU 224 Cb 0.07 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1vgw h LEU 224 CO -0.08 0.88 -0.96 -0.07 -0.34 0.00 0.00 178.44 177.88 1vgw h LEU 225 N 0.15 0.06 0.00 2.25 3.38 -0.19 -3.23 115.31 117.74 1vgw h LEU 225 Ca -0.02 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1vgw h LEU 225 Cb 1.25 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1vgw h LEU 225 CO 0.11 0.98 0.00 0.18 0.09 0.00 0.00 178.44 179.80 1vgw n LEU 226 N -3.46 0.00 -0.62 1.67 4.77 -0.77 -5.10 117.00 113.49 1vgw n LEU 226 Ca -0.01 0.28 0.08 0.00 -0.03 0.00 0.00 56.01 56.33 1vgw n LEU 226 Cb 0.89 -0.28 0.06 0.00 -2.33 0.00 0.00 43.42 41.76 1vgw n LEU 226 CO 0.47 -0.13 0.50 0.47 -1.33 0.00 0.00 177.39 177.37