#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vi8 n ILE 2 N 0.00 0.58 -1.76 1.96 -5.35 0.21 -4.94 119.36 110.06 1vi8 n ILE 2 Ca 0.00 -0.57 -0.41 0.00 -0.27 0.00 0.00 62.75 61.49 1vi8 n ILE 2 Cb 0.00 -0.32 -0.01 0.00 -1.74 0.00 0.00 39.64 37.57 1vi8 n ILE 2 CO 0.00 0.00 0.00 0.79 -1.76 0.00 0.00 176.55 175.58 1vi8 n TRP 3 N -2.60 2.92 -0.01 4.28 5.03 -1.26 -4.74 117.44 121.06 1vi8 n TRP 3 Ca -0.04 0.29 0.06 0.00 3.03 0.00 0.00 57.50 60.84 1vi8 n TRP 3 Cb 0.63 -2.59 -0.10 0.00 -1.03 0.00 0.00 31.31 28.22 1vi8 n TRP 3 CO 0.00 0.00 0.00 1.63 -0.03 0.00 0.00 177.69 179.29 1vi8 n LYS 4 N 1.76 0.44 -4.16 -0.99 5.02 -0.21 -4.96 118.16 115.06 1vi8 n LYS 4 Ca 0.07 -0.12 -0.23 0.00 -2.02 0.00 0.00 58.31 56.01 1vi8 n LYS 4 Cb 0.37 -1.31 -0.06 0.00 -0.02 0.00 0.00 35.03 34.02 1vi8 n LYS 4 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1vi8 s ARG 5 N -2.88 2.72 -0.04 1.97 0.52 -0.64 -4.92 118.95 115.68 1vi8 s ARG 5 Ca -0.05 -1.11 0.06 0.00 -0.52 0.00 0.00 55.73 54.11 1vi8 s ARG 5 Cb 0.08 -2.46 -0.01 0.00 0.52 0.00 0.00 34.95 33.08 1vi8 s ARG 5 CO 0.54 0.41 -0.23 0.15 0.02 0.00 0.00 175.30 176.20 1vi8 s LYS 6 N -3.59 2.10 0.06 3.54 3.01 -1.26 -4.95 119.74 118.65 1vi8 s LYS 6 Ca 0.32 -0.81 -0.23 0.00 -1.01 0.00 0.00 55.97 54.24 1vi8 s LYS 6 Cb -0.08 -1.88 0.06 0.00 -1.01 0.00 0.00 37.83 34.91 1vi8 s LYS 6 CO 0.23 0.40 0.54 -1.50 0.51 0.00 0.00 175.35 175.53 1vi8 s ILE 7 N -0.27 0.02 0.10 2.17 2.07 -1.26 -5.14 121.20 118.89 1vi8 s ILE 7 Ca 0.01 -0.19 0.02 0.00 -1.41 0.00 0.00 60.65 59.08 1vi8 s ILE 7 Cb -0.11 -0.99 -0.04 0.00 0.13 0.00 0.00 42.46 41.45 1vi8 s ILE 7 CO 0.01 -0.11 0.17 0.42 -1.91 0.00 0.00 174.94 173.53 1vi8 s THR 8 N -2.57 4.99 0.23 4.00 -4.23 -1.26 -4.96 115.64 111.83 1vi8 s THR 8 Ca -0.05 -0.66 -0.09 0.00 -1.18 0.00 0.00 61.69 59.71 1vi8 s THR 8 Cb -0.01 -3.47 0.23 0.00 1.34 0.00 0.00 72.50 70.60 1vi8 s THR 8 CO -0.03 0.05 1.65 -0.07 -0.54 0.00 0.00 174.62 175.69 1vi8 h LEU 9 N 2.87 -0.29 0.07 4.79 3.38 -1.98 0.27 115.31 124.42 1vi8 h LEU 9 Ca -0.47 0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.69 1vi8 h LEU 9 Cb 1.17 0.30 -0.05 0.00 0.09 0.00 0.00 40.66 42.17 1vi8 h LEU 9 CO 0.70 -0.13 -0.44 -0.08 0.09 0.00 0.00 178.44 178.57 1vi8 h GLU 10 N 0.12 -0.62 -0.15 1.13 4.81 -1.94 0.46 114.58 118.38 1vi8 h GLU 10 Ca 0.36 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.66 1vi8 h GLU 10 Cb 0.60 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 1vi8 h GLU 10 CO -0.58 -0.42 0.11 0.00 -0.73 0.00 0.00 179.01 177.39 1vi8 h ALA 11 N -0.20 2.08 0.34 2.92 0.00 -1.56 -1.81 119.26 121.02 1vi8 h ALA 11 Ca 0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1vi8 h ALA 11 Cb 0.69 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1vi8 h ALA 11 CO -0.28 -0.11 -0.16 1.25 0.00 0.00 0.00 179.25 179.94 1vi8 h LEU 12 N 0.05 -0.39 -2.31 0.00 5.85 0.87 -3.22 115.31 116.17 1vi8 h LEU 12 Ca 0.07 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.71 1vi8 h LEU 12 Cb 0.21 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.34 1vi8 h LEU 12 CO -0.01 0.07 0.23 0.78 -0.34 0.00 0.00 178.44 179.17 1vi8 h ASN 13 N -1.06 0.00 -0.37 1.25 2.35 0.12 0.58 115.58 118.46 1vi8 h ASN 13 Ca -0.05 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.60 1vi8 h ASN 13 Cb 0.45 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.80 1vi8 h ASN 13 CO 0.08 0.00 -0.15 0.00 -1.65 0.00 0.00 177.43 175.71 1vi8 h ALA 14 N 1.58 0.91 -0.70 -0.83 0.00 -1.34 -3.19 119.26 115.70 1vi8 h ALA 14 Ca 0.02 -0.34 0.15 0.00 0.00 0.00 0.00 54.91 54.73 1vi8 h ALA 14 Cb 0.47 -0.17 -0.11 0.00 0.00 0.00 0.00 17.79 17.98 1vi8 h ALA 14 CO -0.00 0.63 0.09 0.52 0.00 0.00 0.00 179.25 180.49 1vi8 h MET 15 N 0.74 0.18 0.00 0.00 2.86 -0.95 0.12 114.93 117.89 1vi8 h MET 15 Ca 0.12 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1vi8 h MET 15 Cb 0.65 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.27 1vi8 h MET 15 CO 0.05 0.12 0.00 0.41 1.06 0.00 0.00 176.91 178.55 1vi8 n GLY 16 N -1.37 -0.76 3.52 8.32 0.00 -1.20 -4.72 105.19 108.98 1vi8 n GLY 16 Ca 0.12 -0.03 -0.49 0.00 0.00 0.00 0.00 46.02 45.62 1vi8 n GLY 16 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vi8 n GLU 17 N -1.46 1.45 0.00 1.61 -0.58 0.43 -1.30 120.64 120.79 1vi8 n GLU 17 Ca 0.03 0.42 0.00 0.00 -0.42 0.00 0.00 57.16 57.19 1vi8 n GLU 17 Cb 0.10 -2.68 0.00 0.00 -0.57 0.00 0.00 31.44 28.29 1vi8 n GLU 17 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1vi8 n GLY 18 N 6.01 2.03 3.10 0.62 0.00 -1.26 -4.98 105.19 110.71 1vi8 n GLY 18 Ca 0.36 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.16 1vi8 n GLY 18 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1vi8 n ASN 19 N 0.00 2.50 -0.32 1.61 0.23 -0.42 -4.90 115.26 113.96 1vi8 n ASN 19 Ca 0.00 -2.57 0.18 0.00 -0.53 0.00 0.00 54.58 51.66 1vi8 n ASN 19 Cb 0.00 -0.01 0.37 0.00 -2.08 0.00 0.00 39.78 38.06 1vi8 n ASN 19 CO 0.00 0.00 0.00 -0.03 -0.93 0.00 0.00 177.26 176.30 1vi8 h MET 20 N 0.00 0.20 -0.81 -3.83 1.85 -1.96 0.33 114.93 110.71 1vi8 h MET 20 Ca -0.29 -0.01 0.03 0.00 -0.61 0.00 0.00 59.70 58.82 1vi8 h MET 20 Cb 1.04 -0.05 -0.05 0.00 0.43 0.00 0.00 31.60 32.98 1vi8 h MET 20 CO 0.46 0.14 0.52 0.28 -0.40 0.00 0.00 176.91 177.90 1vi8 h VAL 21 N 0.21 1.13 -0.10 -5.77 2.07 -1.94 -2.18 116.25 109.67 1vi8 h VAL 21 Ca 0.64 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.80 1vi8 h VAL 21 Cb 1.38 0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1vi8 h VAL 21 CO -0.67 0.18 0.02 1.23 0.02 0.00 0.00 177.57 178.35 1vi8 h GLY 22 N 1.01 0.18 2.00 2.17 0.00 0.51 -1.17 103.07 107.77 1vi8 h GLY 22 Ca 0.32 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.52 1vi8 h GLY 22 CO -0.11 0.11 -0.04 0.74 0.00 0.00 0.00 176.54 177.24 1vi8 h PHE 23 N -0.05 0.00 -0.02 5.60 -1.00 -1.14 -1.92 116.94 118.42 1vi8 h PHE 23 Ca 0.03 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.81 1vi8 h PHE 23 Cb 0.27 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.83 1vi8 h PHE 23 CO 0.01 0.04 -0.15 1.28 -1.61 0.00 0.00 178.31 177.87 1vi8 n LEU 24 N -4.19 1.79 -2.65 1.54 4.77 -0.84 -4.95 117.00 112.46 1vi8 n LEU 24 Ca -0.03 -0.59 -0.14 0.00 -0.03 0.00 0.00 56.01 55.22 1vi8 n LEU 24 Cb 0.12 -0.03 0.06 0.00 -2.33 0.00 0.00 43.42 41.24 1vi8 n LEU 24 CO 0.32 0.31 0.12 -0.67 -1.33 0.00 0.00 177.39 176.14 1vi8 n ASP 25 N 0.17 -3.53 -4.63 -1.43 4.64 -0.72 -4.24 116.55 106.80 1vi8 n ASP 25 Ca 0.14 -0.40 -0.40 0.00 -1.38 0.00 0.00 54.79 52.75 1vi8 n ASP 25 Cb 0.43 -3.65 -0.07 0.00 -1.04 0.00 0.00 41.12 36.79 1vi8 n ASP 25 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1vi8 s ILE 26 N -3.23 5.02 -0.07 5.18 1.01 -0.47 -4.20 121.20 124.44 1vi8 s ILE 26 Ca 0.20 1.07 0.01 0.00 0.00 0.00 0.00 60.65 61.94 1vi8 s ILE 26 Cb -0.09 -3.90 0.02 0.00 0.01 0.00 0.00 42.46 38.49 1vi8 s ILE 26 CO 0.50 0.07 -0.09 0.00 0.00 0.00 0.00 174.94 175.42 1vi8 s ARG 27 N 2.27 1.40 0.25 2.79 1.70 -0.50 -4.74 118.95 122.12 1vi8 s ARG 27 Ca 0.25 -0.29 -0.30 0.00 -0.47 0.00 0.00 55.73 54.93 1vi8 s ARG 27 Cb -0.16 -1.27 -0.09 0.00 -0.57 0.00 0.00 34.95 32.87 1vi8 s ARG 27 CO 0.09 -0.06 1.01 -0.06 -1.08 0.00 0.00 175.30 175.20 1vi8 s PHE 28 N 0.94 3.81 0.00 5.89 0.40 -1.26 -0.94 117.98 126.82 1vi8 s PHE 28 Ca -0.10 1.82 0.00 0.00 -0.60 0.00 0.00 56.93 58.05 1vi8 s PHE 28 Cb -0.15 -3.11 0.00 0.00 0.51 0.00 0.00 43.02 40.27 1vi8 s PHE 28 CO 0.00 0.02 0.00 0.39 0.70 0.00 0.00 175.22 176.33 1vi8 n GLU 29 N 1.42 2.54 -3.72 0.44 1.02 -0.84 -4.94 120.64 116.55 1vi8 n GLU 29 Ca -0.01 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.99 1vi8 n GLU 29 Cb 0.46 -0.76 -0.10 0.00 -0.02 0.00 0.00 31.44 31.03 1vi8 n GLU 29 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1vi8 s HIS 30 N -1.40 -0.46 -0.34 -0.32 5.04 -1.22 -5.02 115.29 111.57 1vi8 s HIS 30 Ca 0.00 1.10 0.02 0.00 -1.54 0.00 0.00 55.06 54.64 1vi8 s HIS 30 Cb 0.00 0.16 0.10 0.00 0.04 0.00 0.00 32.58 32.89 1vi8 s HIS 30 CO 0.00 -0.25 0.09 0.42 -2.34 0.00 0.00 174.74 172.66 1vi8 s ILE 31 N 0.09 1.59 0.65 0.89 1.01 -1.26 -1.52 121.20 122.64 1vi8 s ILE 31 Ca -0.01 -1.97 -0.11 0.00 0.00 0.00 0.00 60.65 58.56 1vi8 s ILE 31 Cb -0.03 -2.18 0.15 0.00 0.01 0.00 0.00 42.46 40.42 1vi8 s ILE 31 CO 0.01 -0.66 0.77 0.61 0.00 0.00 0.00 174.94 175.66 1vi8 n GLY 32 N 4.43 -1.77 0.02 6.18 0.00 0.21 -4.92 105.19 109.34 1vi8 n GLY 32 Ca 0.02 -1.63 0.14 0.00 0.00 0.00 0.00 46.02 44.55 1vi8 n GLY 32 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1vi8 n ASP 33 N -3.72 0.20 -0.47 1.61 3.85 -1.26 -3.79 116.55 112.96 1vi8 n ASP 33 Ca 0.10 0.45 0.00 0.00 -0.71 0.00 0.00 54.79 54.63 1vi8 n ASP 33 Cb 0.35 -0.48 0.00 0.00 -1.35 0.00 0.00 41.12 39.64 1vi8 n ASP 33 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 1vi8 n ASP 34 N -1.65 0.00 -4.08 -1.12 3.85 -1.26 0.67 116.55 112.95 1vi8 n ASP 34 Ca 0.07 -1.38 -0.13 0.00 -0.71 0.00 0.00 54.79 52.64 1vi8 n ASP 34 Cb 0.36 -0.08 -0.11 0.00 -1.35 0.00 0.00 41.12 39.94 1vi8 n ASP 34 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 1vi8 s THR 35 N 0.00 0.58 -0.12 2.12 2.01 -1.25 -4.32 115.64 114.67 1vi8 s THR 35 Ca 0.00 -1.24 -0.07 0.00 0.31 0.00 0.00 61.69 60.69 1vi8 s THR 35 Cb 0.00 -0.81 0.05 0.00 0.01 0.00 0.00 72.50 71.74 1vi8 s THR 35 CO 0.00 -0.47 0.30 -0.22 -0.69 0.00 0.00 174.62 173.54 1vi8 s LEU 36 N -1.85 0.31 0.10 4.42 2.96 -0.97 0.64 118.68 124.30 1vi8 s LEU 36 Ca -0.06 0.64 0.06 0.00 -0.22 0.00 0.00 54.13 54.55 1vi8 s LEU 36 Cb -0.07 0.94 -0.03 0.00 0.50 0.00 0.00 46.19 47.52 1vi8 s LEU 36 CO -0.00 -0.17 -0.15 -1.61 -1.32 0.00 0.00 176.35 173.10 1vi8 s GLU 37 N 1.19 0.97 0.12 1.98 2.02 -0.58 -0.64 118.70 123.76 1vi8 s GLU 37 Ca -0.08 -1.13 -0.18 0.00 0.02 0.00 0.00 54.97 53.59 1vi8 s GLU 37 Cb -0.09 -0.97 0.04 0.00 0.10 0.00 0.00 34.13 33.22 1vi8 s GLU 37 CO -0.09 0.20 0.45 0.00 0.02 0.00 0.00 175.26 175.84 1vi8 s ALA 38 N -1.68 -1.09 0.15 5.21 0.00 -0.65 -1.99 121.76 121.71 1vi8 s ALA 38 Ca 0.05 0.13 0.08 0.00 0.00 0.00 0.00 51.96 52.21 1vi8 s ALA 38 Cb -0.07 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 23.68 1vi8 s ALA 38 CO 0.03 -0.64 -0.17 0.95 0.00 0.00 0.00 175.76 175.93 1vi8 s THR 39 N -3.59 1.64 -0.04 0.00 -4.23 -0.12 0.25 115.64 109.57 1vi8 s THR 39 Ca 0.01 -1.86 -0.03 0.00 -1.18 0.00 0.00 61.69 58.64 1vi8 s THR 39 Cb 0.01 -1.74 0.01 0.00 1.34 0.00 0.00 72.50 72.12 1vi8 s THR 39 CO -0.11 -0.36 0.09 -0.32 -0.54 0.00 0.00 174.62 173.38 1vi8 s MET 40 N -2.78 0.09 0.60 3.99 0.00 -0.23 -1.41 119.30 119.57 1vi8 s MET 40 Ca 0.14 0.15 -0.15 0.00 0.00 0.00 0.00 55.69 55.82 1vi8 s MET 40 Cb -0.05 0.01 -0.03 0.00 0.00 0.00 0.00 34.83 34.76 1vi8 s MET 40 CO 0.05 -0.03 1.05 -1.25 0.00 0.00 0.00 175.02 174.84 1vi8 s PRO 41 N 0.20 3.35 -0.85 4.11 0.04 -1.26 -0.91 135.00 139.68 1vi8 s PRO 41 Ca -0.01 1.12 0.01 0.00 0.04 0.00 0.00 61.00 62.15 1vi8 s PRO 41 Cb -0.02 -2.04 0.25 0.00 0.04 0.00 0.00 34.50 32.73 1vi8 s PRO 41 CO -0.01 -0.78 0.95 0.28 0.04 0.00 0.00 177.00 177.48 1vi8 n VAL 42 N -2.18 3.37 -2.84 -0.36 0.31 -0.23 -4.76 118.33 111.64 1vi8 n VAL 42 Ca 0.08 -5.37 0.00 0.00 -0.01 0.00 0.00 64.34 59.04 1vi8 n VAL 42 Cb 0.53 -2.19 0.00 0.00 -0.91 0.00 0.00 33.84 31.27 1vi8 n VAL 42 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1vi8 n ASP 43 N 1.51 1.54 0.32 4.52 5.68 -1.26 -4.42 116.55 124.44 1vi8 n ASP 43 Ca 0.26 0.00 0.22 0.00 -0.50 0.00 0.00 54.79 54.76 1vi8 n ASP 43 Cb 0.37 0.00 1.11 0.00 -1.14 0.00 0.00 41.12 41.46 1vi8 n ASP 43 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1vi8 h SER 44 N 0.00 0.00 0.40 -1.12 4.64 -1.95 -1.80 113.55 113.72 1vi8 h SER 44 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1vi8 h SER 44 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1vi8 h SER 44 CO 0.00 0.00 -0.28 0.54 -0.87 0.00 0.00 176.83 176.22 1vi8 n ARG 45 N -3.06 0.50 -0.21 4.77 1.74 -1.26 -4.20 116.66 114.94 1vi8 n ARG 45 Ca -0.02 -0.26 0.01 0.00 -0.77 0.00 0.00 57.85 56.81 1vi8 n ARG 45 Cb 0.11 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.07 1vi8 n ARG 45 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1vi8 n THR 46 N -1.03 0.17 -3.57 0.55 -2.24 -0.75 -5.00 114.28 102.42 1vi8 n THR 46 Ca 0.10 -0.19 -0.20 0.00 -2.27 0.00 0.00 64.05 61.49 1vi8 n THR 46 Cb 0.33 0.69 -0.01 0.00 -2.10 0.00 0.00 70.33 69.24 1vi8 n THR 46 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1vi8 s LYS 47 N -0.22 3.22 0.40 -0.78 1.02 -0.79 -0.72 119.74 121.87 1vi8 s LYS 47 Ca 0.02 -0.87 0.08 0.00 0.02 0.00 0.00 55.97 55.21 1vi8 s LYS 47 Cb 0.02 -2.81 -0.01 0.00 -0.52 0.00 0.00 37.83 34.50 1vi8 s LYS 47 CO 0.00 0.14 0.45 1.14 -0.92 0.00 0.00 175.35 176.17 1vi8 s GLN 48 N -4.16 2.72 0.38 1.68 1.03 0.10 -4.54 119.66 116.88 1vi8 s GLN 48 Ca 0.42 -1.35 0.28 0.00 0.04 0.00 0.00 55.36 54.75 1vi8 s GLN 48 Cb -0.09 -2.58 1.28 0.00 0.03 0.00 0.00 33.01 31.64 1vi8 s GLN 48 CO 0.31 -0.17 1.33 -2.30 -2.54 0.00 0.00 175.29 171.93 1vi8 n PRO 49 N -1.65 -0.03 -0.22 9.60 -0.02 -1.26 -0.95 135.00 140.46 1vi8 n PRO 49 Ca 0.04 1.07 0.04 0.00 -2.02 0.00 0.00 63.50 62.63 1vi8 n PRO 49 Cb 0.60 -2.11 0.14 0.00 -0.02 0.00 0.00 33.50 32.11 1vi8 n PRO 49 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1vi8 n PHE 50 N -4.40 0.55 -1.04 6.00 3.72 -1.26 -4.88 117.46 116.14 1vi8 n PHE 50 Ca 0.34 -0.23 -0.01 0.00 -0.05 0.00 0.00 57.45 57.50 1vi8 n PHE 50 Cb 1.34 -0.10 -0.01 0.00 -0.94 0.00 0.00 39.48 39.78 1vi8 n PHE 50 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1vi8 n GLY 51 N 0.69 0.51 3.69 1.37 0.00 -0.13 -5.04 105.19 106.28 1vi8 n GLY 51 Ca 0.10 -0.68 -0.24 0.00 0.00 0.00 0.00 46.02 45.20 1vi8 n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vi8 s LEU 52 N -0.32 3.37 0.07 0.99 1.43 -1.25 -4.65 118.68 118.31 1vi8 s LEU 52 Ca 0.00 -0.46 -0.32 0.00 -1.03 0.00 0.00 54.13 52.32 1vi8 s LEU 52 Cb 0.00 -1.95 -0.11 0.00 0.03 0.00 0.00 46.19 44.16 1vi8 s LEU 52 CO 0.00 0.03 1.83 -0.11 0.23 0.00 0.00 176.35 178.33 1vi8 n LEU 53 N -0.60 3.78 -4.68 1.79 7.94 0.15 0.01 117.00 125.39 1vi8 n LEU 53 Ca -0.08 0.99 -0.42 0.00 -1.11 0.00 0.00 56.01 55.38 1vi8 n LEU 53 Cb 0.57 -1.48 -0.03 0.00 0.53 0.00 0.00 43.42 43.01 1vi8 n LEU 53 CO 0.40 0.05 1.14 -2.28 -1.11 0.00 0.00 177.39 175.59 1vi8 s HIS 54 N 2.99 2.74 0.39 1.96 5.65 0.10 -4.69 115.29 124.43 1vi8 s HIS 54 Ca 0.85 0.80 0.18 0.00 0.25 0.00 0.00 55.06 57.13 1vi8 s HIS 54 Cb -0.56 -3.65 1.09 0.00 -1.18 0.00 0.00 32.58 28.29 1vi8 s HIS 54 CO 0.41 -2.40 1.75 0.78 -0.65 0.00 0.00 174.74 174.63 1vi8 h GLY 55 N 8.94 1.35 1.40 1.59 0.00 -1.90 0.61 103.07 115.07 1vi8 h GLY 55 Ca -0.35 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 46.73 1vi8 h GLY 55 CO 0.92 -0.18 0.22 -1.33 0.00 0.00 0.00 176.54 176.17 1vi8 h GLY 56 N 0.40 0.83 0.78 4.60 0.00 -1.95 -2.08 103.07 105.64 1vi8 h GLY 56 Ca 0.62 -0.41 0.04 0.00 0.00 0.00 0.00 47.33 47.58 1vi8 h GLY 56 CO -0.34 0.39 0.26 0.00 0.00 0.00 0.00 176.54 176.84 1vi8 h ALA 57 N 1.48 0.62 -0.61 3.60 0.00 -0.08 0.36 119.26 124.63 1vi8 h ALA 57 Ca 0.18 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.15 1vi8 h ALA 57 Cb 0.14 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1vi8 h ALA 57 CO -0.02 -0.08 0.34 0.77 0.00 0.00 0.00 179.25 180.26 1vi8 h SER 58 N 0.51 0.52 -0.21 0.00 0.02 -1.15 -1.16 113.55 112.08 1vi8 h SER 58 Ca 0.21 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.13 1vi8 h SER 58 Cb 0.09 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 1vi8 h SER 58 CO -0.13 0.35 -0.02 0.58 -1.14 0.00 0.00 176.83 176.47 1vi8 h VAL 59 N 0.65 1.20 -0.11 2.27 2.07 -0.93 0.10 116.25 121.51 1vi8 h VAL 59 Ca 0.26 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.97 1vi8 h VAL 59 Cb 0.12 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1vi8 h VAL 59 CO -0.15 0.28 0.06 0.58 0.02 0.00 0.00 177.57 178.35 1vi8 h VAL 60 N 0.49 1.10 -0.20 2.57 2.07 0.21 0.17 116.25 122.66 1vi8 h VAL 60 Ca 0.10 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 1vi8 h VAL 60 Cb 0.35 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1vi8 h VAL 60 CO 0.01 0.09 0.10 0.25 0.02 0.00 0.00 177.57 178.04 1vi8 h LEU 61 N 0.07 0.26 0.05 2.57 5.85 -1.00 0.34 115.31 123.46 1vi8 h LEU 61 Ca 0.04 -0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.66 1vi8 h LEU 61 Cb 0.09 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1vi8 h LEU 61 CO -0.01 0.31 -0.20 0.00 -0.34 0.00 0.00 178.44 178.20 1vi8 h ALA 62 N 0.96 -0.30 -0.07 1.25 0.00 -0.58 -0.96 119.26 119.56 1vi8 h ALA 62 Ca 0.07 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1vi8 h ALA 62 Cb 0.12 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1vi8 h ALA 62 CO -0.01 -0.71 -0.44 1.49 0.00 0.00 0.00 179.25 179.58 1vi8 h GLU 63 N -0.35 0.17 -0.33 0.00 4.81 -0.56 -0.57 114.58 117.75 1vi8 h GLU 63 Ca 0.04 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1vi8 h GLU 63 Cb 0.40 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1vi8 h GLU 63 CO -0.15 0.58 0.20 0.77 -0.73 0.00 0.00 179.01 179.68 1vi8 h SER 64 N 0.14 0.40 -0.04 1.04 0.02 0.26 0.21 113.55 115.59 1vi8 h SER 64 Ca 0.01 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 1vi8 h SER 64 Cb 0.84 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.28 1vi8 h SER 64 CO 0.06 0.35 -0.03 0.40 -1.14 0.00 0.00 176.83 176.47 1vi8 h ILE 65 N 0.43 1.36 -0.79 3.27 2.04 -1.05 -2.93 117.51 119.85 1vi8 h ILE 65 Ca 0.12 -1.14 0.05 0.00 1.00 0.00 0.00 64.86 64.89 1vi8 h ILE 65 Cb 0.02 2.04 -0.05 0.00 -0.74 0.00 0.00 36.82 38.10 1vi8 h ILE 65 CO -0.02 0.31 0.52 1.23 0.00 0.00 0.00 178.15 180.18 1vi8 h GLY 66 N -0.35 1.09 1.04 5.37 0.00 -1.03 -0.30 103.07 108.90 1vi8 h GLY 66 Ca 0.01 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1vi8 h GLY 66 CO 0.01 0.28 0.17 1.76 0.00 0.00 0.00 176.54 178.76 1vi8 h SER 67 N 0.90 1.00 0.17 0.19 0.02 -0.94 -1.31 113.55 113.58 1vi8 h SER 67 Ca 0.33 -0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1vi8 h SER 67 Cb 0.16 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.43 1vi8 h SER 67 CO -0.11 0.97 -0.08 0.58 -1.14 0.00 0.00 176.83 177.05 1vi8 h VAL 68 N 0.99 0.93 -0.65 2.27 2.07 -1.21 -1.14 116.25 119.51 1vi8 h VAL 68 Ca 0.21 -0.96 0.13 0.00 0.82 0.00 0.00 66.70 66.90 1vi8 h VAL 68 Cb 0.36 1.46 -0.10 0.00 -1.52 0.00 0.00 31.29 31.49 1vi8 h VAL 68 CO 0.00 0.20 0.13 0.00 0.02 0.00 0.00 177.57 177.92 1vi8 h ALA 69 N -0.07 0.77 -0.92 1.67 0.00 -1.07 0.52 119.26 120.16 1vi8 h ALA 69 Ca -0.02 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1vi8 h ALA 69 Cb 0.51 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 1vi8 h ALA 69 CO 0.04 -0.33 0.61 0.78 0.00 0.00 0.00 179.25 180.35 1vi8 h GLY 70 N 0.25 1.30 0.99 0.00 0.00 -1.23 -2.00 103.07 102.38 1vi8 h GLY 70 Ca 0.35 -0.48 -0.04 0.00 0.00 0.00 0.00 47.33 47.15 1vi8 h GLY 70 CO -0.45 0.46 0.18 -1.82 0.00 0.00 0.00 176.54 174.91 1vi8 h TYR 71 N 1.24 0.90 0.00 5.60 3.20 0.85 -2.26 116.97 126.50 1vi8 h TYR 71 Ca 0.34 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 62.12 1vi8 h TYR 71 Cb -0.13 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 37.88 1vi8 h TYR 71 CO -0.01 0.75 0.00 -0.07 -1.64 0.00 0.00 178.16 177.20 1vi8 h LEU 72 N 0.78 0.00 -2.25 2.82 3.38 0.54 -2.48 115.31 118.10 1vi8 h LEU 72 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1vi8 h LEU 72 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1vi8 h LEU 72 CO -0.01 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.52 1vi8 s THR 74 N -1.28 1.44 0.04 0.00 -4.23 -0.94 -4.62 115.64 106.06 1vi8 s THR 74 Ca 0.41 -1.62 -0.08 0.00 -1.18 0.00 0.00 61.69 59.22 1vi8 s THR 74 Cb 0.22 -2.06 -0.00 0.00 1.34 0.00 0.00 72.50 72.00 1vi8 s THR 74 CO 0.30 0.00 0.16 -1.83 -0.54 0.00 0.00 174.62 172.71 1vi8 s GLU 75 N -4.21 0.67 4.21 3.99 -1.05 -1.26 -4.03 118.70 117.02 1vi8 s GLU 75 Ca 0.25 -0.70 0.00 0.00 -0.15 0.00 0.00 54.97 54.37 1vi8 s GLU 75 Cb -0.02 0.27 0.00 0.00 -0.44 0.00 0.00 34.13 33.95 1vi8 s GLU 75 CO 0.16 -0.19 0.00 0.41 0.95 0.00 0.00 175.26 176.59 1vi8 n GLY 76 N 0.65 1.02 0.16 -3.83 0.00 -1.26 -2.84 105.19 99.10 1vi8 n GLY 76 Ca -0.19 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.11 1vi8 n GLY 76 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vi8 n GLU 77 N 4.93 0.77 -1.97 1.61 -0.58 -1.26 -4.85 120.64 119.29 1vi8 n GLU 77 Ca 0.00 0.00 -0.33 0.00 -0.42 0.00 0.00 57.16 56.41 1vi8 n GLU 77 Cb 0.00 -1.12 0.02 0.00 -0.57 0.00 0.00 31.44 29.77 1vi8 n GLU 77 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1vi8 s GLN 78 N -1.68 3.13 0.16 3.49 -0.21 -1.13 -4.88 119.66 118.54 1vi8 s GLN 78 Ca 0.00 1.32 -0.05 0.00 0.02 0.00 0.00 55.36 56.66 1vi8 s GLN 78 Cb 0.00 -2.00 -0.03 0.00 1.00 0.00 0.00 33.01 31.99 1vi8 s GLN 78 CO 0.00 -0.98 0.18 0.15 -2.12 0.00 0.00 175.29 172.52 1vi8 s LYS 79 N -3.97 1.07 -0.05 2.91 1.02 -0.96 -4.80 119.74 114.96 1vi8 s LYS 79 Ca 0.66 -1.34 0.03 0.00 0.02 0.00 0.00 55.97 55.34 1vi8 s LYS 79 Cb -0.19 0.31 0.00 0.00 -0.52 0.00 0.00 37.83 37.44 1vi8 s LYS 79 CO 0.37 -0.36 -0.14 0.14 -0.92 0.00 0.00 175.35 174.44 1vi8 s VAL 80 N -4.02 1.24 -0.16 3.17 -7.23 -1.26 -1.45 120.40 110.68 1vi8 s VAL 80 Ca 0.23 -0.59 0.02 0.00 -1.81 0.00 0.00 61.98 59.82 1vi8 s VAL 80 Cb 0.05 -1.09 0.01 0.00 0.56 0.00 0.00 36.38 35.92 1vi8 s VAL 80 CO 0.02 0.37 -0.20 0.68 -0.31 0.00 0.00 175.10 175.66 1vi8 s VAL 81 N 0.25 2.19 0.42 1.32 -7.23 -0.40 -4.93 120.40 112.02 1vi8 s VAL 81 Ca -0.07 -0.92 -0.26 0.00 -1.81 0.00 0.00 61.98 58.92 1vi8 s VAL 81 Cb -0.12 -1.90 -0.09 0.00 0.56 0.00 0.00 36.38 34.83 1vi8 s VAL 81 CO 0.02 0.54 1.35 -0.83 -0.31 0.00 0.00 175.10 175.88 1vi8 s GLY 82 N 0.96 2.92 -0.14 2.32 0.00 -1.26 0.16 107.32 112.29 1vi8 s GLY 82 Ca -0.03 1.33 -0.03 0.00 0.00 0.00 0.00 44.72 45.99 1vi8 s GLY 82 CO -0.05 1.92 -0.15 1.04 0.00 0.00 0.00 173.10 175.87 1vi8 n LEU 83 N 0.01 2.02 -3.76 0.66 4.77 0.27 -4.81 117.00 116.15 1vi8 n LEU 83 Ca 0.04 0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 55.94 1vi8 n LEU 83 Cb 0.43 -0.44 -0.11 0.00 -2.33 0.00 0.00 43.42 40.97 1vi8 n LEU 83 CO 0.57 0.51 -0.04 -0.70 -1.33 0.00 0.00 177.39 176.40 1vi8 s GLU 84 N -2.26 0.33 0.00 3.23 -6.30 -1.05 -5.01 118.70 107.65 1vi8 s GLU 84 Ca -0.19 0.44 0.02 0.00 -2.50 0.00 0.00 54.97 52.75 1vi8 s GLU 84 Cb 0.06 0.13 -0.01 0.00 0.00 0.00 0.00 34.13 34.31 1vi8 s GLU 84 CO 0.28 -0.06 -0.07 -1.50 0.02 0.00 0.00 175.26 173.92 1vi8 s ILE 85 N 0.33 0.56 0.01 -3.70 2.07 -1.26 -0.58 121.20 118.63 1vi8 s ILE 85 Ca -0.01 -0.42 -0.03 0.00 -1.41 0.00 0.00 60.65 58.77 1vi8 s ILE 85 Cb -0.03 -0.50 -0.01 0.00 0.13 0.00 0.00 42.46 42.05 1vi8 s ILE 85 CO -0.01 0.08 0.05 0.54 -1.91 0.00 0.00 174.94 173.68 1vi8 s ASN 86 N -0.39 0.11 -0.07 4.50 2.20 -0.64 -4.99 114.94 115.66 1vi8 s ASN 86 Ca 0.01 -0.29 -0.22 0.00 -0.94 0.00 0.00 52.86 51.42 1vi8 s ASN 86 Cb -0.04 0.15 0.05 0.00 -2.00 0.00 0.00 41.25 39.41 1vi8 s ASN 86 CO -0.00 -0.28 0.50 0.00 -2.94 0.00 0.00 177.10 174.37 1vi8 s ALA 87 N -1.20 -1.27 -0.11 3.54 0.00 -1.26 -0.94 121.76 120.52 1vi8 s ALA 87 Ca -0.13 0.96 -0.01 0.00 0.00 0.00 0.00 51.96 52.79 1vi8 s ALA 87 Cb -0.08 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 1vi8 s ALA 87 CO 0.00 -0.30 -0.07 -0.80 0.00 0.00 0.00 175.76 174.59 1vi8 s ASN 88 N -0.91 4.56 -0.45 0.00 -0.87 -0.59 -4.97 114.94 111.71 1vi8 s ASN 88 Ca -0.09 -0.11 -0.13 0.00 -1.57 0.00 0.00 52.86 50.95 1vi8 s ASN 88 Cb -0.03 -1.43 0.07 0.00 -0.02 0.00 0.00 41.25 39.84 1vi8 s ASN 88 CO 0.06 0.27 0.35 -1.00 -2.57 0.00 0.00 177.10 174.20 1vi8 s HIS 89 N -0.23 3.28 -0.12 2.20 3.76 -1.26 -2.03 115.29 120.88 1vi8 s HIS 89 Ca 0.03 -1.13 0.22 0.00 -0.15 0.00 0.00 55.06 54.03 1vi8 s HIS 89 Cb -0.13 -3.08 -0.24 0.00 1.11 0.00 0.00 32.58 30.24 1vi8 s HIS 89 CO 0.03 -0.81 0.65 1.33 -0.85 0.00 0.00 174.74 175.09 1vi8 n VAL 90 N 5.10 0.16 -3.70 -0.90 0.24 -0.87 -4.98 118.33 113.39 1vi8 n VAL 90 Ca -0.12 -0.49 -0.14 0.00 -2.04 0.00 0.00 64.34 61.55 1vi8 n VAL 90 Cb 0.43 -0.06 -0.09 0.00 -1.47 0.00 0.00 33.84 32.66 1vi8 n VAL 90 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1vi8 s ARG 91 N -3.46 0.65 0.59 7.34 3.52 -1.13 -4.96 118.95 121.50 1vi8 s ARG 91 Ca -0.05 0.36 -0.10 0.00 -0.13 0.00 0.00 55.73 55.81 1vi8 s ARG 91 Cb 0.13 0.31 0.14 0.00 -1.56 0.00 0.00 34.95 33.96 1vi8 s ARG 91 CO 0.88 -0.13 0.69 0.43 -0.81 0.00 0.00 175.30 176.36 1vi8 n SER 92 N 2.14 -0.51 -3.64 -2.12 7.64 -1.26 -4.59 113.62 111.27 1vi8 n SER 92 Ca -0.16 -1.13 -0.06 0.00 1.01 0.00 0.00 58.87 58.53 1vi8 n SER 92 Cb 0.57 -0.56 -0.07 0.00 -1.01 0.00 0.00 64.21 63.13 1vi8 n SER 92 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1vi8 s ALA 93 N -3.65 -2.13 -0.00 -0.43 0.00 -1.26 -4.93 121.76 109.36 1vi8 s ALA 93 Ca 0.41 1.88 0.00 0.00 0.00 0.00 0.00 51.96 54.25 1vi8 s ALA 93 Cb -0.02 -1.61 0.00 0.00 0.00 0.00 0.00 23.12 21.50 1vi8 s ALA 93 CO 0.30 -0.22 0.61 2.89 0.00 0.00 0.00 175.76 179.34 1vi8 n ARG 94 N 2.31 0.44 -3.74 0.00 1.85 -1.26 0.34 116.66 116.59 1vi8 n ARG 94 Ca -0.13 -0.70 -0.06 0.00 -1.00 0.00 0.00 57.85 55.96 1vi8 n ARG 94 Cb 0.56 -0.58 -0.02 0.00 -1.05 0.00 0.00 32.46 31.37 1vi8 n ARG 94 CO 0.00 0.00 0.00 -1.83 -0.01 0.00 0.00 177.63 175.79 1vi8 s GLU 95 N -0.18 1.43 4.40 2.89 -1.05 -1.26 -4.94 118.70 119.98 1vi8 s GLU 95 Ca 0.00 -0.75 0.00 0.00 -0.15 0.00 0.00 54.97 54.07 1vi8 s GLU 95 Cb 0.00 0.51 0.00 0.00 -0.44 0.00 0.00 34.13 34.20 1vi8 s GLU 95 CO 0.00 -0.65 0.00 0.41 0.95 0.00 0.00 175.26 175.97 1vi8 n GLY 96 N -0.44 1.20 3.06 -3.83 0.00 -1.26 -4.74 105.19 99.18 1vi8 n GLY 96 Ca -0.07 -0.70 -0.16 0.00 0.00 0.00 0.00 46.02 45.09 1vi8 n GLY 96 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vi8 s ARG 97 N 0.00 0.65 0.16 1.61 0.52 -1.26 -1.07 118.95 119.55 1vi8 s ARG 97 Ca 0.00 -0.58 0.04 0.00 -0.52 0.00 0.00 55.73 54.66 1vi8 s ARG 97 Cb 0.00 -0.56 -0.04 0.00 0.52 0.00 0.00 34.95 34.87 1vi8 s ARG 97 CO 0.00 0.13 0.22 0.14 0.02 0.00 0.00 175.30 175.82 1vi8 s VAL 98 N -0.81 4.94 -0.11 3.52 -7.23 -0.08 -4.09 120.40 116.54 1vi8 s VAL 98 Ca -0.02 -0.89 0.03 0.00 -1.81 0.00 0.00 61.98 59.29 1vi8 s VAL 98 Cb -0.07 -3.55 0.00 0.00 0.56 0.00 0.00 36.38 33.33 1vi8 s VAL 98 CO 0.00 -0.12 -0.22 -0.60 -0.31 0.00 0.00 175.10 173.85 1vi8 s ARG 99 N -3.23 2.96 -0.13 4.82 3.52 -0.15 -1.07 118.95 125.66 1vi8 s ARG 99 Ca 0.33 -0.84 -0.09 0.00 -0.13 0.00 0.00 55.73 55.00 1vi8 s ARG 99 Cb -0.10 -2.30 -0.04 0.00 -1.56 0.00 0.00 34.95 30.94 1vi8 s ARG 99 CO 0.26 0.09 0.18 0.20 -0.81 0.00 0.00 175.30 175.22 1vi8 s GLY 100 N 0.55 2.16 -0.24 8.12 0.00 0.14 -1.29 107.32 116.77 1vi8 s GLY 100 Ca -0.14 -0.60 0.02 0.00 0.00 0.00 0.00 44.72 44.00 1vi8 s GLY 100 CO 0.04 -0.11 -0.09 0.14 0.00 0.00 0.00 173.10 173.08 1vi8 s VAL 101 N -0.52 1.82 -0.10 1.40 1.01 0.67 -1.64 120.40 123.04 1vi8 s VAL 101 Ca 0.14 -1.35 -0.04 0.00 0.00 0.00 0.00 61.98 60.73 1vi8 s VAL 101 Cb -0.12 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.24 1vi8 s VAL 101 CO 0.03 -0.01 0.05 0.00 0.00 0.00 0.00 175.10 175.17 1vi8 s LYS 103 N -0.90 0.71 0.34 0.00 -2.85 -0.46 -2.30 119.74 114.28 1vi8 s LYS 103 Ca 0.14 -0.99 -0.18 0.00 -1.00 0.00 0.00 55.97 53.93 1vi8 s LYS 103 Cb -0.12 0.27 -0.09 0.00 -2.06 0.00 0.00 37.83 35.83 1vi8 s LYS 103 CO 0.03 -0.19 0.80 -1.25 0.10 0.00 0.00 175.35 174.85 1vi8 s PRO 104 N -3.58 4.13 0.00 1.78 0.04 -1.26 -1.07 135.00 135.03 1vi8 s PRO 104 Ca 0.03 0.85 0.00 0.00 0.04 0.00 0.00 61.00 61.92 1vi8 s PRO 104 Cb 0.04 -2.43 0.00 0.00 0.04 0.00 0.00 34.50 32.15 1vi8 s PRO 104 CO -0.09 0.14 0.00 1.28 0.04 0.00 0.00 177.00 178.37 1vi8 n LEU 105 N -0.27 0.00 -3.64 -3.56 4.77 -0.05 -4.87 117.00 109.38 1vi8 n LEU 105 Ca 0.04 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.96 1vi8 n LEU 105 Cb 0.53 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.55 1vi8 n LEU 105 CO 0.41 0.00 0.64 -2.28 -1.33 0.00 0.00 177.39 174.83 1vi8 s HIS 106 N -1.84 -0.62 -0.54 -1.77 5.04 -1.06 -4.93 115.29 109.58 1vi8 s HIS 106 Ca 0.00 1.32 0.06 0.00 -1.54 0.00 0.00 55.06 54.90 1vi8 s HIS 106 Cb 0.00 0.39 0.21 0.00 0.04 0.00 0.00 32.58 33.22 1vi8 s HIS 106 CO 0.00 -0.30 0.53 1.28 -2.34 0.00 0.00 174.74 173.90 1vi8 n LEU 107 N 3.24 1.62 0.00 8.88 4.77 -1.26 -1.70 117.00 132.55 1vi8 n LEU 107 Ca -0.17 -4.93 -0.25 0.00 -0.03 0.00 0.00 56.01 50.63 1vi8 n LEU 107 Cb 0.57 -0.06 0.16 0.00 -2.33 0.00 0.00 43.42 41.76 1vi8 n LEU 107 CO 0.02 1.94 0.71 0.61 -1.33 0.00 0.00 177.39 179.33 1vi8 n GLY 108 N 1.76 -0.73 0.11 -0.72 0.00 -0.54 -5.00 105.19 100.09 1vi8 n GLY 108 Ca 0.25 -1.82 -0.01 0.00 0.00 0.00 0.00 46.02 44.44 1vi8 n GLY 108 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1vi8 h SER 109 N -1.24 0.00 0.00 1.61 4.64 -2.00 -3.36 113.55 113.20 1vi8 h SER 109 Ca -0.36 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.90 1vi8 h SER 109 Cb 1.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 1vi8 h SER 109 CO 0.30 0.70 -1.55 0.54 -0.87 0.00 0.00 176.83 175.94 1vi8 n ARG 110 N -3.39 0.96 -3.72 4.77 1.74 -1.26 -4.84 116.66 110.91 1vi8 n ARG 110 Ca 0.00 -0.07 -0.10 0.00 -0.77 0.00 0.00 57.85 56.92 1vi8 n ARG 110 Cb 0.77 -1.26 -0.04 0.00 -1.02 0.00 0.00 32.46 30.92 1vi8 n ARG 110 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1vi8 s HIS 111 N -2.59 -0.14 0.20 -1.55 -3.43 -1.26 0.48 115.29 106.99 1vi8 s HIS 111 Ca -0.04 -0.19 0.03 0.00 -0.80 0.00 0.00 55.06 54.05 1vi8 s HIS 111 Cb 0.06 0.40 -0.05 0.00 -1.43 0.00 0.00 32.58 31.56 1vi8 s HIS 111 CO 0.44 -0.91 0.00 -0.65 -2.00 0.00 0.00 174.74 171.62 1vi8 s GLN 112 N -3.86 1.21 -0.05 -0.38 -0.21 -0.23 -1.47 119.66 114.68 1vi8 s GLN 112 Ca 0.08 -1.60 -0.02 0.00 0.02 0.00 0.00 55.36 53.85 1vi8 s GLN 112 Cb -0.01 -0.41 0.03 0.00 1.00 0.00 0.00 33.01 33.62 1vi8 s GLN 112 CO -0.04 -0.12 0.08 0.08 -2.12 0.00 0.00 175.29 173.17 1vi8 s VAL 113 N -3.56 -0.12 0.19 1.09 1.01 -0.69 -0.60 120.40 117.72 1vi8 s VAL 113 Ca 0.26 0.34 0.11 0.00 0.00 0.00 0.00 61.98 62.69 1vi8 s VAL 113 Cb 0.06 -0.17 -0.04 0.00 0.00 0.00 0.00 36.38 36.23 1vi8 s VAL 113 CO 0.06 0.14 -0.21 0.26 0.00 0.00 0.00 175.10 175.35 1vi8 s TRP 114 N 1.82 2.38 -0.12 5.22 0.52 0.10 -0.87 118.94 127.99 1vi8 s TRP 114 Ca -0.00 -0.33 0.01 0.00 0.02 0.00 0.00 56.10 55.80 1vi8 s TRP 114 Cb -0.12 -1.17 0.02 0.00 -1.15 0.00 0.00 33.47 31.04 1vi8 s TRP 114 CO -0.04 0.50 -0.14 -1.14 0.02 0.00 0.00 176.95 176.15 1vi8 s GLN 115 N -2.69 2.16 -0.16 4.98 0.74 -0.23 0.26 119.66 124.71 1vi8 s GLN 115 Ca 0.22 -0.52 0.01 0.00 0.05 0.00 0.00 55.36 55.11 1vi8 s GLN 115 Cb -0.08 -1.92 0.02 0.00 1.10 0.00 0.00 33.01 32.13 1vi8 s GLN 115 CO 0.11 -0.15 -0.16 0.42 -0.55 0.00 0.00 175.29 174.96 1vi8 s ILE 116 N 1.25 1.72 -0.03 -2.34 1.09 -0.50 -1.35 121.20 121.04 1vi8 s ILE 116 Ca -0.01 -0.73 0.00 0.00 -1.10 0.00 0.00 60.65 58.81 1vi8 s ILE 116 Cb -0.14 -1.59 -0.04 0.00 -1.06 0.00 0.00 42.46 39.64 1vi8 s ILE 116 CO -0.06 0.48 0.02 -1.61 -0.10 0.00 0.00 174.94 173.68 1vi8 s GLU 117 N 1.39 2.91 -0.10 2.79 2.02 -0.83 -0.77 118.70 126.12 1vi8 s GLU 117 Ca 0.04 -0.52 0.03 0.00 0.02 0.00 0.00 54.97 54.54 1vi8 s GLU 117 Cb -0.13 -2.76 0.01 0.00 0.10 0.00 0.00 34.13 31.35 1vi8 s GLU 117 CO -0.11 0.65 -0.19 0.42 0.02 0.00 0.00 175.26 176.05 1vi8 s ILE 118 N -1.06 1.74 0.27 -1.63 1.01 0.79 -0.24 121.20 122.08 1vi8 s ILE 118 Ca 0.19 -0.82 0.11 0.00 0.00 0.00 0.00 60.65 60.13 1vi8 s ILE 118 Cb -0.12 -1.53 -0.05 0.00 0.01 0.00 0.00 42.46 40.78 1vi8 s ILE 118 CO 0.09 0.49 -0.13 -0.36 0.00 0.00 0.00 174.94 175.03 1vi8 s PHE 119 N 0.58 2.44 0.00 3.97 0.40 -0.41 -0.59 117.98 124.37 1vi8 s PHE 119 Ca -0.15 -0.29 0.00 0.00 -0.60 0.00 0.00 56.93 55.89 1vi8 s PHE 119 Cb -0.17 -1.07 0.00 0.00 0.51 0.00 0.00 43.02 42.29 1vi8 s PHE 119 CO 0.05 0.67 0.00 -0.40 0.70 0.00 0.00 175.22 176.24 1vi8 n ASP 120 N -0.67 0.00 0.09 1.36 3.85 -0.72 -0.98 116.55 119.48 1vi8 n ASP 120 Ca -0.06 -0.08 -0.13 0.00 -0.71 0.00 0.00 54.79 53.81 1vi8 n ASP 120 Cb 0.59 0.00 -0.08 0.00 -1.35 0.00 0.00 41.12 40.28 1vi8 n ASP 120 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1vi8 h GLU 121 N 0.00 -0.19 0.00 0.11 4.39 -1.89 -2.79 114.58 114.21 1vi8 h GLU 121 Ca 0.00 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1vi8 h GLU 121 Cb 0.00 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 1vi8 h GLU 121 CO 0.00 0.00 0.00 1.63 -1.16 0.00 0.00 179.01 179.48 1vi8 n LYS 122 N -5.11 0.19 -1.06 2.33 4.01 -1.26 -4.79 118.16 112.47 1vi8 n LYS 122 Ca -0.09 0.02 -0.02 0.00 -0.51 0.00 0.00 58.31 57.71 1vi8 n LYS 122 Cb 0.16 -1.50 -0.01 0.00 -0.51 0.00 0.00 35.03 33.17 1vi8 n LYS 122 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1vi8 n GLY 123 N -0.62 0.56 3.82 0.72 0.00 -1.05 -5.02 105.19 103.59 1vi8 n GLY 123 Ca 0.05 -0.75 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 1vi8 n GLY 123 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vi8 s ARG 124 N -1.81 4.17 0.24 1.61 0.52 -1.26 -4.82 118.95 117.61 1vi8 s ARG 124 Ca 0.00 0.71 -0.30 0.00 -0.52 0.00 0.00 55.73 55.62 1vi8 s ARG 124 Cb 0.00 -3.13 -0.10 0.00 0.52 0.00 0.00 34.95 32.24 1vi8 s ARG 124 CO 0.00 0.58 1.36 -1.17 0.02 0.00 0.00 175.30 176.09 1vi8 s LEU 125 N -1.39 4.41 0.00 2.53 2.96 -1.26 -1.76 118.68 124.16 1vi8 s LEU 125 Ca 0.33 2.56 0.00 0.00 -0.22 0.00 0.00 54.13 56.80 1vi8 s LEU 125 Cb -0.18 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 42.88 1vi8 s LEU 125 CO 0.19 -0.60 0.00 0.00 -1.32 0.00 0.00 176.35 174.63 1vi8 s SER 128 N 1.36 3.72 0.34 0.00 0.15 -0.86 -0.15 113.70 118.26 1vi8 s SER 128 Ca -0.08 -1.01 0.10 0.00 0.70 0.00 0.00 55.95 55.65 1vi8 s SER 128 Cb -0.05 -1.43 -0.06 0.00 -1.71 0.00 0.00 66.02 62.77 1vi8 s SER 128 CO -0.15 -0.12 -0.08 -0.55 1.20 0.00 0.00 173.24 173.54 1vi8 s SER 129 N 1.25 3.81 -0.01 5.45 0.15 0.05 -1.55 113.70 122.86 1vi8 s SER 129 Ca -0.02 -1.15 0.01 0.00 0.70 0.00 0.00 55.95 55.49 1vi8 s SER 129 Cb -0.17 -0.38 0.01 0.00 -1.71 0.00 0.00 66.02 63.77 1vi8 s SER 129 CO -0.08 -0.19 -0.02 -0.13 1.20 0.00 0.00 173.24 174.01 1vi8 s ARG 130 N -3.62 0.24 -0.08 5.44 0.52 -0.12 -1.40 118.95 119.92 1vi8 s ARG 130 Ca 0.33 -0.05 0.01 0.00 -0.52 0.00 0.00 55.73 55.50 1vi8 s ARG 130 Cb 0.01 -0.28 0.02 0.00 0.52 0.00 0.00 34.95 35.22 1vi8 s ARG 130 CO 0.17 0.01 -0.08 -1.17 0.02 0.00 0.00 175.30 174.24 1vi8 s LEU 131 N 0.23 1.33 -0.20 2.53 2.96 0.14 -1.62 118.68 124.05 1vi8 s LEU 131 Ca -0.02 -0.25 -0.06 0.00 -0.22 0.00 0.00 54.13 53.58 1vi8 s LEU 131 Cb -0.04 -0.74 -0.03 0.00 0.50 0.00 0.00 46.19 45.88 1vi8 s LEU 131 CO -0.01 -0.06 0.03 -0.89 -1.32 0.00 0.00 176.35 174.10 1vi8 s THR 132 N 1.21 4.21 0.22 3.68 2.01 0.26 0.01 115.64 127.24 1vi8 s THR 132 Ca -0.05 -0.23 0.10 0.00 0.31 0.00 0.00 61.69 61.83 1vi8 s THR 132 Cb -0.14 -2.91 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 1vi8 s THR 132 CO -0.02 0.42 -0.14 0.42 -0.69 0.00 0.00 174.62 174.60 1vi8 s THR 133 N 0.97 2.86 -0.11 -0.82 -4.23 0.23 0.96 115.64 115.50 1vi8 s THR 133 Ca 0.02 -1.95 -0.02 0.00 -1.18 0.00 0.00 61.69 58.57 1vi8 s THR 133 Cb -0.14 -2.44 -0.03 0.00 1.34 0.00 0.00 72.50 71.23 1vi8 s THR 133 CO 0.02 -0.21 -0.03 0.00 -0.54 0.00 0.00 174.62 173.86 1vi8 s ALA 134 N -1.95 3.09 -0.32 3.99 0.00 0.12 -1.06 121.76 125.63 1vi8 s ALA 134 Ca 0.26 -0.83 -0.16 0.00 0.00 0.00 0.00 51.96 51.22 1vi8 s ALA 134 Cb -0.07 -1.46 -0.02 0.00 0.00 0.00 0.00 23.12 21.57 1vi8 s ALA 134 CO 0.14 0.41 0.43 0.42 0.00 0.00 0.00 175.76 177.16 1vi8 s ILE 135 N -0.28 5.11 -0.11 0.00 1.01 0.18 -1.28 121.20 125.83 1vi8 s ILE 135 Ca 0.05 0.36 -0.05 0.00 0.00 0.00 0.00 60.65 61.01 1vi8 s ILE 135 Cb -0.13 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 1vi8 s ILE 135 CO 0.02 -0.04 0.08 -0.76 0.00 0.00 0.00 174.94 174.24 1vi8 s LEU 136 N 2.18 4.02 0.00 2.97 1.43 -0.53 -4.81 118.68 123.94 1vi8 s LEU 136 Ca 0.16 0.31 0.31 0.00 -1.03 0.00 0.00 54.13 53.88 1vi8 s LEU 136 Cb -0.16 -1.96 1.75 0.00 0.03 0.00 0.00 46.19 45.85 1vi8 s LEU 136 CO 0.11 0.38 2.14 -0.62 0.23 0.00 0.00 176.35 178.60