#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vc9 s GLU 2 N 0.00 2.92 0.75 2.12 2.02 0.00 -4.99 118.70 121.52 1vc9 s GLU 2 Ca 0.00 -0.81 -0.14 0.00 0.02 0.00 0.00 54.97 54.04 1vc9 s GLU 2 Cb 0.00 -2.40 0.05 0.00 0.10 0.00 0.00 34.13 31.89 1vc9 s GLU 2 CO 0.00 -0.06 1.17 -0.51 0.02 0.00 0.00 175.26 175.88 1vc9 s LEU 3 N 0.94 3.22 0.08 1.80 1.43 -1.26 -2.51 118.68 122.37 1vc9 s LEU 3 Ca -0.04 2.22 -0.08 0.00 -1.03 0.00 0.00 54.13 55.20 1vc9 s LEU 3 Cb -0.15 -4.57 -0.00 0.00 0.03 0.00 0.00 46.19 41.49 1vc9 s LEU 3 CO -0.04 -2.29 0.17 -0.83 0.23 0.00 0.00 176.35 173.59 1vc9 s GLY 4 N -2.35 0.12 -0.10 -3.19 0.00 -0.02 -4.50 107.32 97.27 1vc9 s GLY 4 Ca 0.71 -0.62 -0.04 0.00 0.00 0.00 0.00 44.72 44.77 1vc9 s GLY 4 CO 0.48 -0.79 0.21 0.00 0.00 0.00 0.00 173.10 173.00 1vc9 s ALA 5 N -3.64 -0.44 0.35 3.20 0.00 -0.33 -0.92 121.76 119.99 1vc9 s ALA 5 Ca 0.03 0.86 0.03 0.00 0.00 0.00 0.00 51.96 52.88 1vc9 s ALA 5 Cb 0.04 -0.68 -0.01 0.00 0.00 0.00 0.00 23.12 22.47 1vc9 s ALA 5 CO -0.10 -0.31 0.40 0.41 0.00 0.00 0.00 175.76 176.16 1vc9 n GLY 6 N 4.56 2.48 3.09 0.00 0.00 -0.50 -1.73 105.19 113.09 1vc9 n GLY 6 Ca -0.20 -1.77 -0.17 0.00 0.00 0.00 0.00 46.02 43.88 1vc9 n GLY 6 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1vc9 s GLY 7 N -3.32 0.63 -0.46 -0.02 0.00 -0.78 -2.25 107.32 101.13 1vc9 s GLY 7 Ca 0.36 -0.72 -0.09 0.00 0.00 0.00 0.00 44.72 44.26 1vc9 s GLY 7 CO 0.25 -0.71 0.33 0.14 0.00 0.00 0.00 173.10 173.11 1vc9 s VAL 8 N -0.89 4.23 -0.13 1.40 1.01 -0.66 -4.05 120.40 121.32 1vc9 s VAL 8 Ca -0.02 -1.69 -0.06 0.00 0.00 0.00 0.00 61.98 60.21 1vc9 s VAL 8 Cb -0.08 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1vc9 s VAL 8 CO 0.01 -0.71 0.10 -0.69 0.00 0.00 0.00 175.10 173.81 1vc9 s VAL 9 N 1.38 5.18 0.01 2.92 1.01 -1.26 -0.34 120.40 129.30 1vc9 s VAL 9 Ca 0.05 0.09 0.05 0.00 0.00 0.00 0.00 61.98 62.18 1vc9 s VAL 9 Cb -0.25 -3.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.84 1vc9 s VAL 9 CO 0.00 0.58 -0.17 -0.36 0.00 0.00 0.00 175.10 175.15 1vc9 s PHE 10 N -0.69 1.50 0.54 5.22 0.08 -0.35 -1.13 117.98 123.15 1vc9 s PHE 10 Ca 0.13 -0.31 0.08 0.00 0.12 0.00 0.00 56.93 56.95 1vc9 s PHE 10 Cb -0.12 -0.94 0.06 0.00 -0.57 0.00 0.00 43.02 41.45 1vc9 s PHE 10 CO 0.03 0.01 0.65 0.54 -0.10 0.00 0.00 175.22 176.34 1vc9 s ASN 11 N -0.67 5.03 0.35 1.36 2.20 -0.86 -0.96 114.94 121.39 1vc9 s ASN 11 Ca 0.06 -0.91 0.14 0.00 -0.94 0.00 0.00 52.86 51.21 1vc9 s ASN 11 Cb -0.07 0.19 0.99 0.00 -2.00 0.00 0.00 41.25 40.36 1vc9 s ASN 11 CO 0.00 -1.19 1.74 0.00 -2.94 0.00 0.00 177.10 174.71 1vc9 h ALA 12 N 0.42 1.99 0.00 3.54 0.00 -1.92 0.51 119.26 123.80 1vc9 h ALA 12 Ca -0.33 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1vc9 h ALA 12 Cb 1.29 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1vc9 h ALA 12 CO 0.46 -0.45 0.00 1.63 0.00 0.00 0.00 179.25 180.89 1vc9 n LYS 13 N -4.78 0.80 -3.06 0.00 5.02 -1.26 -4.84 118.16 110.04 1vc9 n LYS 13 Ca 0.27 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.37 1vc9 n LYS 13 Cb 0.82 -1.30 0.04 0.00 -0.02 0.00 0.00 35.03 34.57 1vc9 n LYS 13 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1vc9 n ARG 14 N -0.80 -4.88 -3.76 1.97 1.74 0.18 -5.01 116.66 106.09 1vc9 n ARG 14 Ca 0.12 0.71 -0.32 0.00 -0.77 0.00 0.00 57.85 57.59 1vc9 n ARG 14 Cb 0.05 -5.23 -0.05 0.00 -1.02 0.00 0.00 32.46 26.21 1vc9 n ARG 14 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1vc9 s GLU 15 N -5.69 3.56 -0.10 5.56 2.02 -1.25 -4.45 118.70 118.36 1vc9 s GLU 15 Ca 0.33 -0.18 -0.03 0.00 0.02 0.00 0.00 54.97 55.11 1vc9 s GLU 15 Cb -0.15 -2.97 -0.04 0.00 0.10 0.00 0.00 34.13 31.08 1vc9 s GLU 15 CO 0.41 0.56 0.04 0.54 0.02 0.00 0.00 175.26 176.83 1vc9 s VAL 16 N -1.51 4.65 -0.34 2.63 0.11 0.34 -2.04 120.40 124.24 1vc9 s VAL 16 Ca 0.35 -0.12 -0.29 0.00 -2.93 0.00 0.00 61.98 59.00 1vc9 s VAL 16 Cb -0.13 -2.98 0.01 0.00 -1.53 0.00 0.00 36.38 31.75 1vc9 s VAL 16 CO 0.23 0.60 1.20 -0.22 -3.33 0.00 0.00 175.10 173.58 1vc9 s LEU 17 N -0.86 3.85 0.17 2.54 2.96 -0.28 -0.95 118.68 126.10 1vc9 s LEU 17 Ca 0.13 1.02 0.11 0.00 -0.22 0.00 0.00 54.13 55.17 1vc9 s LEU 17 Cb -0.12 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.99 1vc9 s LEU 17 CO 0.03 -1.05 -0.23 -0.76 -1.32 0.00 0.00 176.35 173.02 1vc9 s LEU 18 N 4.16 2.41 0.11 -0.68 1.43 -0.88 -4.47 118.68 120.76 1vc9 s LEU 18 Ca 0.51 -0.84 0.05 0.00 -1.03 0.00 0.00 54.13 52.82 1vc9 s LEU 18 Cb -0.13 -1.10 -0.04 0.00 0.03 0.00 0.00 46.19 44.95 1vc9 s LEU 18 CO 0.22 0.10 -0.12 -0.76 0.23 0.00 0.00 176.35 176.02 1vc9 s LEU 19 N -2.55 2.42 -0.27 1.79 1.43 0.34 -2.63 118.68 119.21 1vc9 s LEU 19 Ca 0.18 -0.84 -0.06 0.00 -1.03 0.00 0.00 54.13 52.38 1vc9 s LEU 19 Cb -0.08 -0.41 0.00 0.00 0.03 0.00 0.00 46.19 45.73 1vc9 s LEU 19 CO 0.08 -0.22 0.05 -0.60 0.23 0.00 0.00 176.35 175.89 1vc9 s ARG 20 N -2.88 3.22 0.70 1.70 3.52 -0.16 -0.28 118.95 124.78 1vc9 s ARG 20 Ca 0.08 -0.76 -0.12 0.00 -0.13 0.00 0.00 55.73 54.81 1vc9 s ARG 20 Cb -0.03 -3.27 0.16 0.00 -1.56 0.00 0.00 34.95 30.25 1vc9 s ARG 20 CO 0.01 -0.35 0.90 -0.40 -0.81 0.00 0.00 175.30 174.65 1vc9 n ASP 21 N 4.85 -0.13 -0.22 -2.12 5.68 -0.33 -4.16 116.55 120.12 1vc9 n ASP 21 Ca -0.16 -1.29 0.02 0.00 -0.50 0.00 0.00 54.79 52.86 1vc9 n ASP 21 Cb 0.49 -0.70 0.13 0.00 -1.14 0.00 0.00 41.12 39.90 1vc9 n ASP 21 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1vc9 h ARG 22 N 0.00 0.34 -0.10 0.11 3.08 -1.78 -1.80 114.38 114.23 1vc9 h ARG 22 Ca -0.30 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.73 1vc9 h ARG 22 Cb 0.83 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1vc9 h ARG 22 CO 0.21 0.22 0.00 -1.33 -1.07 0.00 0.00 179.97 178.00 1vc9 n MET 23 N -5.06 1.13 -0.91 0.04 2.81 -1.26 -4.88 117.12 109.00 1vc9 n MET 23 Ca 0.11 -0.20 0.00 0.00 -1.81 0.00 0.00 57.70 55.80 1vc9 n MET 23 Cb 0.34 -1.07 0.00 0.00 -0.71 0.00 0.00 33.22 31.78 1vc9 n MET 23 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1vc9 n GLY 24 N 0.56 0.47 3.76 3.03 0.00 -0.68 -5.05 105.19 107.29 1vc9 n GLY 24 Ca 0.02 -0.66 -0.36 0.00 0.00 0.00 0.00 46.02 45.02 1vc9 n GLY 24 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vc9 s PHE 25 N -2.00 3.43 -0.15 1.61 0.08 -1.26 -4.85 117.98 114.84 1vc9 s PHE 25 Ca 0.00 0.34 -0.26 0.00 0.12 0.00 0.00 56.93 57.14 1vc9 s PHE 25 Cb 0.00 -2.05 -0.02 0.00 -0.57 0.00 0.00 43.02 40.39 1vc9 s PHE 25 CO 0.00 0.43 0.86 -1.58 -0.10 0.00 0.00 175.22 174.83 1vc9 s TRP 26 N -0.20 3.44 0.31 0.36 0.52 -1.26 -1.19 118.94 120.93 1vc9 s TRP 26 Ca 0.10 1.31 0.04 0.00 0.02 0.00 0.00 56.10 57.58 1vc9 s TRP 26 Cb -0.12 -3.03 -0.03 0.00 -1.15 0.00 0.00 33.47 29.14 1vc9 s TRP 26 CO 0.01 -0.22 0.29 0.14 0.02 0.00 0.00 176.95 177.18 1vc9 s VAL 27 N 2.06 0.00 0.36 4.03 -7.23 0.62 -2.87 120.40 117.37 1vc9 s VAL 27 Ca 0.40 -1.93 -0.10 0.00 -1.81 0.00 0.00 61.98 58.54 1vc9 s VAL 27 Cb -0.17 -2.52 -0.06 0.00 0.56 0.00 0.00 36.38 34.19 1vc9 s VAL 27 CO 0.13 0.00 0.70 -0.36 -0.31 0.00 0.00 175.10 175.26 1vc9 s PHE 28 N -3.49 3.46 0.22 2.82 0.08 -1.26 -0.51 117.98 119.29 1vc9 s PHE 28 Ca 0.39 0.96 -0.30 0.00 0.12 0.00 0.00 56.93 58.10 1vc9 s PHE 28 Cb 0.03 -2.36 -0.08 0.00 -0.57 0.00 0.00 43.02 40.03 1vc9 s PHE 28 CO 0.24 0.01 1.12 -1.25 -0.10 0.00 0.00 175.22 175.24 1vc9 s PRO 29 N -3.60 4.59 0.10 0.24 0.04 -1.26 -4.86 135.00 130.25 1vc9 s PRO 29 Ca 0.50 1.79 -0.26 0.00 0.04 0.00 0.00 61.00 63.07 1vc9 s PRO 29 Cb -0.10 -3.24 0.08 0.00 0.04 0.00 0.00 34.50 31.28 1vc9 s PRO 29 CO 0.29 0.09 0.78 -1.59 0.04 0.00 0.00 177.00 176.60 1vc9 s LYS 30 N -0.73 1.12 0.18 4.56 0.00 -1.26 -1.86 119.74 121.75 1vc9 s LYS 30 Ca 0.48 -0.47 -0.08 0.00 0.00 0.00 0.00 55.97 55.91 1vc9 s LYS 30 Cb -0.31 0.48 0.03 0.00 0.00 0.00 0.00 37.83 38.03 1vc9 s LYS 30 CO 0.38 -0.50 0.41 0.41 0.00 0.00 0.00 175.35 176.05 1vc9 n GLY 31 N -0.34 1.41 3.75 0.59 0.00 -0.70 -4.93 105.19 104.97 1vc9 n GLY 31 Ca -0.11 -1.12 -0.40 0.00 0.00 0.00 0.00 46.02 44.39 1vc9 n GLY 31 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1vc9 s HIS 32 N -5.42 3.86 0.58 1.61 3.76 -1.26 -1.18 115.29 117.24 1vc9 s HIS 32 Ca 0.08 1.84 -0.18 0.00 -0.15 0.00 0.00 55.06 56.66 1vc9 s HIS 32 Cb -0.02 -3.07 -0.04 0.00 1.11 0.00 0.00 32.58 30.56 1vc9 s HIS 32 CO 0.05 0.15 1.12 -2.14 -0.85 0.00 0.00 174.74 173.08 1vc9 s PRO 33 N -1.10 3.17 0.32 8.40 0.02 -1.26 -4.93 135.00 139.63 1vc9 s PRO 33 Ca 0.43 1.52 0.01 0.00 0.02 0.00 0.00 61.00 62.97 1vc9 s PRO 33 Cb -0.27 -1.99 -0.03 0.00 0.02 0.00 0.00 34.50 32.22 1vc9 s PRO 33 CO 0.34 -0.98 0.52 -1.21 -0.33 0.00 0.00 177.00 175.34 1vc9 s GLU 34 N -3.58 3.49 0.19 5.54 2.02 -1.26 -5.00 118.70 120.10 1vc9 s GLU 34 Ca 0.70 -0.36 -0.33 0.00 0.02 0.00 0.00 54.97 55.01 1vc9 s GLU 34 Cb -0.22 -2.69 -0.14 0.00 0.10 0.00 0.00 34.13 31.17 1vc9 s GLU 34 CO 0.32 0.20 1.47 -2.30 0.02 0.00 0.00 175.26 174.97 1vc9 n PRO 35 N -1.63 1.99 -0.92 0.39 -0.02 -1.26 -1.15 135.00 132.40 1vc9 n PRO 35 Ca -0.05 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1vc9 n PRO 35 Cb 0.56 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1vc9 n PRO 35 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vc9 n GLY 36 N 2.76 0.68 3.81 -1.23 0.00 -1.26 -5.01 105.19 104.94 1vc9 n GLY 36 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 1vc9 n GLY 36 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1vc9 s GLU 37 N -0.28 3.99 0.72 1.61 2.12 -0.30 -5.08 118.70 121.48 1vc9 s GLU 37 Ca 0.00 0.32 -0.11 0.00 0.36 0.00 0.00 54.97 55.54 1vc9 s GLU 37 Cb 0.00 -3.28 0.02 0.00 0.26 0.00 0.00 34.13 31.13 1vc9 s GLU 37 CO 0.00 0.55 1.07 -1.54 -0.54 0.00 0.00 175.26 174.81 1vc9 s SER 38 N -0.60 5.20 0.25 -1.70 1.04 -1.26 -4.72 113.70 111.91 1vc9 s SER 38 Ca 0.22 1.45 -0.04 0.00 0.48 0.00 0.00 55.95 58.06 1vc9 s SER 38 Cb -0.15 -2.30 0.29 0.00 0.10 0.00 0.00 66.02 63.96 1vc9 s SER 38 CO 0.11 -1.54 1.81 -0.07 0.98 0.00 0.00 173.24 174.53 1vc9 h LEU 39 N -0.79 0.93 -0.28 2.42 3.38 -1.98 0.15 115.31 119.16 1vc9 h LEU 39 Ca -0.45 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.35 1vc9 h LEU 39 Cb 1.23 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1vc9 h LEU 39 CO 0.59 0.86 0.08 -0.08 0.09 0.00 0.00 178.44 179.98 1vc9 h GLU 40 N 0.98 0.44 -0.67 1.13 4.81 -1.95 0.18 114.58 119.50 1vc9 h GLU 40 Ca 0.22 -0.10 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 1vc9 h GLU 40 Cb 0.25 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 1vc9 h GLU 40 CO -0.01 0.50 0.17 1.49 -0.73 0.00 0.00 179.01 180.43 1vc9 h GLU 41 N 0.29 1.06 -0.51 1.92 4.81 -1.90 -1.43 114.58 118.81 1vc9 h GLU 41 Ca 0.09 -0.25 -0.01 0.00 -0.13 0.00 0.00 59.36 59.06 1vc9 h GLU 41 Cb 0.25 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1vc9 h GLU 41 CO -0.00 0.95 0.27 0.00 -0.73 0.00 0.00 179.01 179.49 1vc9 h ALA 42 N 1.07 0.66 -0.46 2.92 0.00 -0.64 -1.33 119.26 121.47 1vc9 h ALA 42 Ca 0.21 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1vc9 h ALA 42 Cb 0.35 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1vc9 h ALA 42 CO 0.00 0.19 0.29 0.00 0.00 0.00 0.00 179.25 179.74 1vc9 h ALA 43 N 1.11 0.58 -0.67 0.00 0.00 -0.30 0.34 119.26 120.31 1vc9 h ALA 43 Ca 0.18 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1vc9 h ALA 43 Cb 0.08 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1vc9 h ALA 43 CO -0.03 0.00 0.13 0.28 0.00 0.00 0.00 179.25 179.64 1vc9 h VAL 44 N 0.59 1.26 -0.17 0.00 2.07 -1.03 -1.65 116.25 117.32 1vc9 h VAL 44 Ca 0.17 -0.99 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 1vc9 h VAL 44 Cb -0.04 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 1vc9 h VAL 44 CO -0.06 0.38 0.04 -0.09 0.02 0.00 0.00 177.57 177.86 1vc9 h ARG 45 N 1.02 0.27 -0.91 1.57 2.43 -0.79 -2.19 114.38 115.78 1vc9 h ARG 45 Ca 0.21 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.32 1vc9 h ARG 45 Cb 0.40 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.87 1vc9 h ARG 45 CO 0.01 0.41 0.60 0.93 -1.51 0.00 0.00 179.97 180.41 1vc9 h GLU 46 N 0.08 1.18 0.02 0.20 4.39 -0.75 0.79 114.58 120.50 1vc9 h GLU 46 Ca 0.05 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 1vc9 h GLU 46 Cb 0.26 -0.27 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1vc9 h GLU 46 CO 0.00 0.78 -0.01 0.28 -1.16 0.00 0.00 179.01 178.90 1vc9 h VAL 47 N 1.22 1.10 -0.60 3.13 2.07 -1.18 -1.69 116.25 120.30 1vc9 h VAL 47 Ca 0.34 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 1vc9 h VAL 47 Cb -0.12 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 1vc9 h VAL 47 CO -0.08 0.10 0.35 -0.25 0.02 0.00 0.00 177.57 177.72 1vc9 h TRP 48 N -0.20 0.80 -0.40 1.57 7.01 -1.01 -1.24 115.95 122.46 1vc9 h TRP 48 Ca -0.00 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 60.98 1vc9 h TRP 48 Cb 0.19 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 26.97 1vc9 h TRP 48 CO -0.02 0.55 0.22 0.93 -2.79 0.00 0.00 178.44 177.34 1vc9 h GLU 49 N 0.81 0.56 -0.00 2.65 5.08 -0.79 0.68 114.58 123.57 1vc9 h GLU 49 Ca 0.21 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1vc9 h GLU 49 Cb -0.00 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.14 1vc9 h GLU 49 CO -0.04 0.45 -0.26 1.04 -1.00 0.00 0.00 179.01 179.20 1vc9 n GLN 50 N -4.74 0.21 0.00 2.33 6.02 -0.64 -4.41 117.38 116.15 1vc9 n GLN 50 Ca 0.00 -0.09 0.00 0.00 -0.01 0.00 0.00 57.00 56.91 1vc9 n GLN 50 Cb 0.08 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.84 1vc9 n GLN 50 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1vc9 n THR 51 N -1.32 0.00 -1.02 5.09 -2.24 -0.48 -3.69 114.28 110.63 1vc9 n THR 51 Ca 0.08 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.86 1vc9 n THR 51 Cb 0.33 0.97 -0.00 0.00 -2.10 0.00 0.00 70.33 69.52 1vc9 n THR 51 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vc9 n GLY 52 N 0.00 0.33 3.73 3.38 0.00 0.24 -1.67 105.19 111.20 1vc9 n GLY 52 Ca 0.00 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 1vc9 n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vc9 s VAL 53 N -1.60 5.16 -0.36 1.61 1.01 -1.26 -4.96 120.40 119.99 1vc9 s VAL 53 Ca 0.00 0.96 -0.19 0.00 0.00 0.00 0.00 61.98 62.76 1vc9 s VAL 53 Cb 0.00 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1vc9 s VAL 53 CO 0.00 0.35 0.55 -0.13 0.00 0.00 0.00 175.10 175.87 1vc9 s ARG 54 N 0.44 3.57 0.18 2.72 1.81 -1.26 -3.44 118.95 122.98 1vc9 s ARG 54 Ca 0.26 -0.17 0.11 0.00 -1.72 0.00 0.00 55.73 54.22 1vc9 s ARG 54 Cb -0.15 -3.83 -0.04 0.00 -0.45 0.00 0.00 34.95 30.47 1vc9 s ARG 54 CO 0.11 -0.71 -0.24 0.00 -0.68 0.00 0.00 175.30 173.78 1vc9 s ALA 55 N 2.49 2.46 -0.16 2.13 0.00 -1.26 -4.44 121.76 122.98 1vc9 s ALA 55 Ca 0.20 -1.60 -0.05 0.00 0.00 0.00 0.00 51.96 50.51 1vc9 s ALA 55 Cb -0.15 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.62 1vc9 s ALA 55 CO 0.14 0.42 0.00 -1.21 0.00 0.00 0.00 175.76 175.12 1vc9 s GLU 56 N -2.60 3.71 -0.00 0.00 2.02 -0.18 -4.91 118.70 116.73 1vc9 s GLU 56 Ca 0.19 -0.45 -0.30 0.00 0.02 0.00 0.00 54.97 54.44 1vc9 s GLU 56 Cb -0.08 -3.00 -0.04 0.00 0.10 0.00 0.00 34.13 31.11 1vc9 s GLU 56 CO 0.09 0.30 1.11 0.08 0.02 0.00 0.00 175.26 176.86 1vc9 s VAL 57 N 0.23 4.42 -0.18 2.63 1.01 -1.26 -1.43 120.40 125.81 1vc9 s VAL 57 Ca 0.00 1.74 0.02 0.00 0.00 0.00 0.00 61.98 63.74 1vc9 s VAL 57 Cb -0.13 -4.11 -0.22 0.00 0.00 0.00 0.00 36.38 31.91 1vc9 s VAL 57 CO 0.02 0.09 0.12 0.18 0.00 0.00 0.00 175.10 175.51 1vc9 n LEU 58 N 4.32 2.26 -3.62 3.92 4.77 -0.09 -4.98 117.00 123.58 1vc9 n LEU 58 Ca 0.08 0.06 -0.03 0.00 -0.03 0.00 0.00 56.01 56.09 1vc9 n LEU 58 Cb 0.48 -0.69 -0.02 0.00 -2.33 0.00 0.00 43.42 40.86 1vc9 n LEU 58 CO 0.54 0.80 1.08 -1.48 -1.33 0.00 0.00 177.39 177.00 1vc9 s LEU 59 N -6.53 -0.09 0.57 2.23 0.05 -1.23 -5.03 118.68 108.65 1vc9 s LEU 59 Ca -0.24 0.01 -0.16 0.00 0.05 0.00 0.00 54.13 53.79 1vc9 s LEU 59 Cb 0.08 1.24 -0.05 0.00 -2.05 0.00 0.00 46.19 45.41 1vc9 s LEU 59 CO 0.71 -0.14 1.03 -2.16 -0.55 0.00 0.00 176.35 175.25 1vc9 s PRO 60 N -2.15 3.52 0.00 1.48 0.04 -1.26 -1.03 135.00 135.61 1vc9 s PRO 60 Ca 0.10 1.10 0.00 0.00 0.04 0.00 0.00 61.00 62.24 1vc9 s PRO 60 Cb -0.01 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1vc9 s PRO 60 CO -0.04 -0.64 0.00 1.28 0.04 0.00 0.00 177.00 177.64 1vc9 n LEU 61 N -1.95 0.00 -3.91 -3.56 4.77 -0.43 -4.73 117.00 107.18 1vc9 n LEU 61 Ca 0.08 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.97 1vc9 n LEU 61 Cb 0.53 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.54 1vc9 n LEU 61 CO 0.48 0.00 -0.16 -0.72 -1.33 0.00 0.00 177.39 175.66 1vc9 s TYR 62 N 3.26 0.24 0.35 -1.77 1.13 -1.26 -4.91 117.35 114.40 1vc9 s TYR 62 Ca 0.00 -0.70 -0.20 0.00 -1.41 0.00 0.00 57.07 54.76 1vc9 s TYR 62 Cb 0.00 -0.14 -0.10 0.00 -1.10 0.00 0.00 41.96 40.62 1vc9 s TYR 62 CO 0.00 -0.51 0.85 -1.25 -2.51 0.00 0.00 175.55 172.13 1vc9 s PRO 63 N -3.88 4.21 0.13 -3.49 0.04 -1.26 -3.50 135.00 127.25 1vc9 s PRO 63 Ca 0.06 0.97 0.09 0.00 0.04 0.00 0.00 61.00 62.15 1vc9 s PRO 63 Cb 0.06 -2.46 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 1vc9 s PRO 63 CO -0.10 0.14 -0.16 0.95 0.04 0.00 0.00 177.00 177.87 1vc9 s THR 64 N -1.93 2.95 0.11 1.26 -4.23 -0.01 -4.92 115.64 108.86 1vc9 s THR 64 Ca 0.55 -1.52 0.06 0.00 -1.18 0.00 0.00 61.69 59.61 1vc9 s THR 64 Cb -0.12 -2.38 -0.04 0.00 1.34 0.00 0.00 72.50 71.31 1vc9 s THR 64 CO 0.17 0.06 -0.16 -0.13 -0.54 0.00 0.00 174.62 174.02 1vc9 s ARG 65 N -2.28 1.01 -0.22 3.99 0.52 -1.26 -0.59 118.95 120.12 1vc9 s ARG 65 Ca 0.20 -1.16 -0.36 0.00 -0.52 0.00 0.00 55.73 53.88 1vc9 s ARG 65 Cb -0.10 -1.02 0.15 0.00 0.52 0.00 0.00 34.95 34.49 1vc9 s ARG 65 CO 0.11 0.22 1.31 1.52 0.02 0.00 0.00 175.30 178.48 1vc9 s TYR 66 N -1.69 -0.06 -0.21 -0.53 1.13 -0.98 -5.01 117.35 110.00 1vc9 s TYR 66 Ca 0.06 0.03 -0.07 0.00 -1.41 0.00 0.00 57.07 55.68 1vc9 s TYR 66 Cb -0.07 0.51 -0.03 0.00 -1.10 0.00 0.00 41.96 41.26 1vc9 s TYR 66 CO 0.03 -0.11 0.06 0.08 -2.51 0.00 0.00 175.55 173.11 1vc9 s VAL 67 N -2.22 4.51 0.86 -3.49 1.01 -1.26 0.00 120.40 119.82 1vc9 s VAL 67 Ca 0.11 -0.12 -0.12 0.00 0.00 0.00 0.00 61.98 61.85 1vc9 s VAL 67 Cb -0.00 -3.07 0.11 0.00 0.00 0.00 0.00 36.38 33.42 1vc9 s VAL 67 CO -0.04 0.40 1.15 0.54 0.00 0.00 0.00 175.10 177.15 1vc9 s ASN 68 N 1.00 3.97 0.15 3.32 2.20 0.38 -4.90 114.94 121.07 1vc9 s ASN 68 Ca 0.04 0.92 0.09 0.00 -0.94 0.00 0.00 52.86 52.97 1vc9 s ASN 68 Cb -0.14 -1.48 0.47 0.00 -2.00 0.00 0.00 41.25 38.10 1vc9 s ASN 68 CO 0.03 -2.26 1.21 -2.65 -2.94 0.00 0.00 177.10 170.49 1vc9 n PRO 69 N -3.57 0.06 -0.30 3.55 -0.02 -1.26 -1.13 135.00 132.32 1vc9 n PRO 69 Ca 0.07 0.51 0.10 0.00 -2.02 0.00 0.00 63.50 62.16 1vc9 n PRO 69 Cb 0.60 -1.78 0.27 0.00 -0.02 0.00 0.00 33.50 32.56 1vc9 n PRO 69 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1vc9 n LYS 70 N -1.78 2.40 -1.03 -0.52 5.02 -1.26 -4.92 118.16 116.07 1vc9 n LYS 70 Ca -0.01 -2.18 -0.01 0.00 -2.02 0.00 0.00 58.31 54.10 1vc9 n LYS 70 Cb 0.11 -1.47 -0.00 0.00 -0.02 0.00 0.00 35.03 33.64 1vc9 n LYS 70 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1vc9 n GLY 71 N 1.46 0.49 3.64 0.72 0.00 -0.29 -5.01 105.19 106.20 1vc9 n GLY 71 Ca 0.20 -0.37 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 1vc9 n GLY 71 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vc9 s VAL 72 N -1.96 5.08 -0.03 1.61 1.01 -1.25 -4.89 120.40 119.97 1vc9 s VAL 72 Ca 0.00 0.08 -0.27 0.00 0.00 0.00 0.00 61.98 61.79 1vc9 s VAL 72 Cb 0.00 -3.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.01 1vc9 s VAL 72 CO 0.00 0.39 0.85 -0.70 0.00 0.00 0.00 175.10 175.65 1vc9 s GLU 73 N 0.82 4.50 -0.02 2.72 2.12 -1.26 -0.47 118.70 127.11 1vc9 s GLU 73 Ca 0.06 1.18 0.05 0.00 0.36 0.00 0.00 54.97 56.61 1vc9 s GLU 73 Cb -0.13 -3.46 -0.03 0.00 0.26 0.00 0.00 34.13 30.78 1vc9 s GLU 73 CO 0.02 -0.00 -0.15 1.03 -0.54 0.00 0.00 175.26 175.62 1vc9 s ARG 74 N 0.93 2.38 -0.28 4.30 1.81 0.10 -0.82 118.95 127.37 1vc9 s ARG 74 Ca 0.45 -0.78 0.03 0.00 -1.72 0.00 0.00 55.73 53.71 1vc9 s ARG 74 Cb -0.19 -2.32 0.07 0.00 -0.45 0.00 0.00 34.95 32.05 1vc9 s ARG 74 CO 0.23 0.60 -0.06 -2.00 -0.68 0.00 0.00 175.30 173.39 1vc9 s GLU 75 N -0.98 1.96 -0.24 3.54 2.12 -1.05 -2.31 118.70 121.74 1vc9 s GLU 75 Ca 0.13 -1.47 -0.08 0.00 0.36 0.00 0.00 54.97 53.91 1vc9 s GLU 75 Cb -0.11 -2.95 -0.03 0.00 0.26 0.00 0.00 34.13 31.30 1vc9 s GLU 75 CO 0.02 -0.68 0.09 0.08 -0.54 0.00 0.00 175.26 174.23 1vc9 s VAL 76 N 1.07 4.56 -0.16 3.70 1.01 0.24 -0.84 120.40 129.98 1vc9 s VAL 76 Ca -0.03 -0.09 -0.17 0.00 0.00 0.00 0.00 61.98 61.69 1vc9 s VAL 76 Cb -0.20 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 1vc9 s VAL 76 CO -0.06 0.35 0.46 -1.00 0.00 0.00 0.00 175.10 174.85 1vc9 s HIS 77 N 1.39 3.44 0.16 5.22 3.76 -0.10 -0.83 115.29 128.33 1vc9 s HIS 77 Ca 0.06 0.78 0.06 0.00 -0.15 0.00 0.00 55.06 55.80 1vc9 s HIS 77 Cb -0.15 -2.57 -0.04 0.00 1.11 0.00 0.00 32.58 30.93 1vc9 s HIS 77 CO 0.04 0.05 0.07 -1.58 -0.85 0.00 0.00 174.74 172.48 1vc9 s TRP 78 N 1.06 3.02 -0.01 1.40 0.52 -1.23 -1.41 118.94 122.30 1vc9 s TRP 78 Ca 0.23 -0.06 0.00 0.00 0.02 0.00 0.00 56.10 56.29 1vc9 s TRP 78 Cb -0.15 -1.46 0.01 0.00 -1.15 0.00 0.00 33.47 30.72 1vc9 s TRP 78 CO 0.09 0.52 0.00 -0.06 0.02 0.00 0.00 176.95 177.52 1vc9 s PHE 79 N -1.71 0.11 0.06 -1.98 0.08 -0.95 -1.31 117.98 112.27 1vc9 s PHE 79 Ca 0.29 0.02 -0.30 0.00 0.12 0.00 0.00 56.93 57.06 1vc9 s PHE 79 Cb -0.10 -0.16 -0.05 0.00 -0.57 0.00 0.00 43.02 42.14 1vc9 s PHE 79 CO 0.21 -0.04 1.13 -1.17 -0.10 0.00 0.00 175.22 175.25 1vc9 s LEU 80 N 0.41 4.38 0.23 -0.37 2.96 -0.20 -1.65 118.68 124.45 1vc9 s LEU 80 Ca -0.04 1.93 0.03 0.00 -0.22 0.00 0.00 54.13 55.83 1vc9 s LEU 80 Cb -0.06 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 43.00 1vc9 s LEU 80 CO -0.01 -0.39 0.03 -0.04 -1.32 0.00 0.00 176.35 174.61 1vc9 s MET 81 N 0.93 1.32 -0.03 1.98 -1.94 0.54 -0.91 119.30 121.19 1vc9 s MET 81 Ca 0.56 -1.68 0.05 0.00 -1.71 0.00 0.00 55.69 52.91 1vc9 s MET 81 Cb -0.27 -0.46 -0.01 0.00 2.01 0.00 0.00 34.83 36.10 1vc9 s MET 81 CO 0.29 -0.16 -0.17 0.50 -0.01 0.00 0.00 175.02 175.47 1vc9 s ARG 82 N -3.92 1.57 0.15 2.03 6.06 -0.52 -1.21 118.95 123.11 1vc9 s ARG 82 Ca 0.30 -0.61 -0.25 0.00 -2.50 0.00 0.00 55.73 52.67 1vc9 s ARG 82 Cb 0.06 -1.44 0.06 0.00 0.06 0.00 0.00 34.95 33.70 1vc9 s ARG 82 CO 0.09 0.31 0.97 0.20 -2.50 0.00 0.00 175.30 174.37 1vc9 s GLY 83 N -0.20 -0.22 0.27 8.12 0.00 -0.14 -1.01 107.32 114.14 1vc9 s GLY 83 Ca 0.02 0.11 -0.07 0.00 0.00 0.00 0.00 44.72 44.78 1vc9 s GLY 83 CO 0.01 0.05 0.39 -0.54 0.00 0.00 0.00 173.10 173.01 1vc9 s GLU 84 N -3.24 1.58 0.00 2.90 0.41 -1.26 -3.53 118.70 115.55 1vc9 s GLU 84 Ca 0.13 -1.50 0.00 0.00 -0.41 0.00 0.00 54.97 53.18 1vc9 s GLU 84 Cb -0.01 0.41 0.00 0.00 -1.78 0.00 0.00 34.13 32.75 1vc9 s GLU 84 CO 0.02 -0.63 0.00 0.41 -0.49 0.00 0.00 175.26 174.58 1vc9 n GLY 85 N -0.41 2.36 3.69 -1.39 0.00 -1.26 -4.59 105.19 103.59 1vc9 n GLY 85 Ca 0.00 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 1vc9 n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vc9 s ALA 86 N -2.46 3.54 0.47 4.61 0.00 -1.26 -4.97 121.76 121.68 1vc9 s ALA 86 Ca 0.00 0.72 -0.24 0.00 0.00 0.00 0.00 51.96 52.44 1vc9 s ALA 86 Cb 0.00 -3.55 -0.07 0.00 0.00 0.00 0.00 23.12 19.49 1vc9 s ALA 86 CO 0.00 -0.84 1.35 -1.25 0.00 0.00 0.00 175.76 175.01 1vc9 s PRO 87 N 2.36 3.60 -0.41 0.00 0.04 -1.26 -4.93 135.00 134.40 1vc9 s PRO 87 Ca 0.59 2.23 -0.01 0.00 0.04 0.00 0.00 61.00 63.85 1vc9 s PRO 87 Cb -0.27 -2.54 0.11 0.00 0.04 0.00 0.00 34.50 31.84 1vc9 s PRO 87 CO 0.23 -0.82 0.18 0.50 0.04 0.00 0.00 177.00 177.14 1vc9 s ARG 88 N -2.56 1.89 0.27 4.56 3.52 -0.67 -4.96 118.95 121.01 1vc9 s ARG 88 Ca 0.63 -1.92 -0.31 0.00 -0.13 0.00 0.00 55.73 54.01 1vc9 s ARG 88 Cb -0.40 -3.48 -0.12 0.00 -1.56 0.00 0.00 34.95 29.40 1vc9 s ARG 88 CO 0.50 -1.04 1.61 1.47 -0.81 0.00 0.00 175.30 177.02 1vc9 n LEU 89 N 4.36 4.16 -4.86 -0.88 -0.00 -1.26 -4.07 117.00 114.46 1vc9 n LEU 89 Ca 0.01 1.13 -0.31 0.00 -0.00 0.00 0.00 56.01 56.84 1vc9 n LEU 89 Cb 0.41 -1.57 0.04 0.00 -0.00 0.00 0.00 43.42 42.30 1vc9 n LEU 89 CO 0.30 0.10 0.73 -0.70 -0.00 0.00 0.00 177.39 177.81 1vc9 s GLU 90 N -0.16 3.01 0.00 1.47 2.12 -1.24 -4.86 118.70 119.04 1vc9 s GLU 90 Ca 0.67 0.67 0.00 0.00 0.36 0.00 0.00 54.97 56.67 1vc9 s GLU 90 Cb -0.51 -2.02 0.00 0.00 0.26 0.00 0.00 34.13 31.86 1vc9 s GLU 90 CO 0.45 -0.97 0.00 0.39 -0.54 0.00 0.00 175.26 174.59 1vc9 n GLU 91 N -3.00 0.00 -1.43 4.30 -0.58 -1.26 0.53 120.64 119.19 1vc9 n GLU 91 Ca 0.07 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.80 1vc9 n GLU 91 Cb 0.55 -0.97 0.10 0.00 -0.57 0.00 0.00 31.44 30.55 1vc9 n GLU 91 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1vc9 n GLY 92 N 0.22 3.59 0.00 0.62 0.00 -1.26 -5.04 105.19 103.31 1vc9 n GLY 92 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1vc9 n GLY 92 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1vc9 n MET 93 N -0.47 2.85 0.00 1.61 0.00 0.19 -4.40 117.12 116.90 1vc9 n MET 93 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.87 1vc9 n MET 93 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 33.22 34.12 1vc9 n MET 93 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1vc9 n THR 94 N 0.00 0.00 0.00 3.17 -2.24 -1.26 -4.47 114.28 109.48 1vc9 n THR 94 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1vc9 n THR 94 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1vc9 n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vc9 n GLY 95 N -0.23 1.21 3.56 3.38 0.00 -1.26 -4.94 105.19 106.91 1vc9 n GLY 95 Ca 0.00 -0.23 -0.07 0.00 0.00 0.00 0.00 46.02 45.72 1vc9 n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vc9 s ALA 96 N -1.82 -1.96 0.00 4.61 0.00 -1.26 -0.99 121.76 120.34 1vc9 s ALA 96 Ca 0.00 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.34 1vc9 s ALA 96 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.07 1vc9 s ALA 96 CO 0.00 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 175.59 1vc9 n GLY 97 N -0.01 0.52 3.73 0.00 0.00 -1.08 -5.01 105.19 103.34 1vc9 n GLY 97 Ca -0.05 -1.18 -0.35 0.00 0.00 0.00 0.00 46.02 44.44 1vc9 n GLY 97 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1vc9 s TRP 98 N -2.00 3.36 0.08 1.61 0.52 -1.26 -2.07 118.94 119.18 1vc9 s TRP 98 Ca 0.00 0.27 0.06 0.00 0.02 0.00 0.00 56.10 56.45 1vc9 s TRP 98 Cb 0.00 -2.01 -0.03 0.00 -1.15 0.00 0.00 33.47 30.28 1vc9 s TRP 98 CO 0.00 0.39 -0.17 -0.06 0.02 0.00 0.00 176.95 177.13 1vc9 s PHE 99 N -0.20 1.48 0.72 -1.98 0.08 -0.13 -4.85 117.98 113.10 1vc9 s PHE 99 Ca 0.09 -0.43 -0.11 0.00 0.12 0.00 0.00 56.93 56.60 1vc9 s PHE 99 Cb -0.12 -0.83 0.03 0.00 -0.57 0.00 0.00 43.02 41.53 1vc9 s PHE 99 CO 0.01 0.12 1.07 -1.54 -0.10 0.00 0.00 175.22 174.78 1vc9 s SER 100 N -1.73 5.13 0.24 1.36 1.04 -1.26 0.13 113.70 118.60 1vc9 s SER 100 Ca 0.02 1.53 -0.05 0.00 0.48 0.00 0.00 55.95 57.94 1vc9 s SER 100 Cb -0.10 -2.37 0.44 0.00 0.10 0.00 0.00 66.02 64.09 1vc9 s SER 100 CO 0.03 -1.59 1.72 -0.65 0.98 0.00 0.00 173.24 173.73 1vc9 h PRO 101 N -0.82 0.39 -0.75 4.02 0.11 -1.97 0.90 132.00 133.88 1vc9 h PRO 101 Ca -0.45 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.58 1vc9 h PRO 101 Cb 1.23 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1vc9 h PRO 101 CO 0.57 0.26 0.24 1.49 -0.21 0.00 0.00 178.00 180.35 1vc9 h GLU 102 N 0.41 1.17 -0.27 1.05 4.57 -1.98 -0.77 114.58 118.75 1vc9 h GLU 102 Ca 0.40 -0.25 -0.16 0.00 -1.18 0.00 0.00 59.36 58.18 1vc9 h GLU 102 Cb 0.61 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 1vc9 h GLU 102 CO -0.41 0.99 -0.46 0.93 -1.18 0.00 0.00 179.01 178.88 1vc9 h GLU 103 N 1.12 0.71 -0.28 1.92 5.08 -1.67 -2.85 114.58 118.61 1vc9 h GLU 103 Ca 0.24 -0.40 -0.05 0.00 -1.00 0.00 0.00 59.36 58.15 1vc9 h GLU 103 Cb 0.31 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1vc9 h GLU 103 CO -0.01 1.02 -0.05 0.00 -1.00 0.00 0.00 179.01 178.98 1vc9 h ALA 104 N 0.92 1.41 0.00 3.43 0.00 -0.52 -1.75 119.26 122.74 1vc9 h ALA 104 Ca 0.03 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1vc9 h ALA 104 Cb 1.01 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1vc9 h ALA 104 CO 0.10 0.41 -0.15 0.00 0.00 0.00 0.00 179.25 179.61 1vc9 h ARG 105 N 0.42 0.00 -0.00 0.00 3.08 -0.91 -1.37 114.38 115.59 1vc9 h ARG 105 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1vc9 h ARG 105 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1vc9 h ARG 105 CO 0.01 0.15 -0.65 0.00 -1.07 0.00 0.00 179.97 178.41 1vc9 n ALA 106 N -2.26 3.95 -0.10 0.04 0.00 -0.72 -4.53 120.51 116.89 1vc9 n ALA 106 Ca -0.01 -0.50 -0.21 0.00 0.00 0.00 0.00 53.44 52.72 1vc9 n ALA 106 Cb 0.29 -0.93 -0.08 0.00 0.00 0.00 0.00 19.45 18.73 1vc9 n ALA 106 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1vc9 n LEU 107 N -1.13 1.67 -4.65 0.00 4.77 -0.84 -4.99 117.00 111.84 1vc9 n LEU 107 Ca 0.07 0.19 -0.58 0.00 -0.03 0.00 0.00 56.01 55.66 1vc9 n LEU 107 Cb 0.36 -0.61 -0.08 0.00 -2.33 0.00 0.00 43.42 40.76 1vc9 n LEU 107 CO 0.36 0.48 1.06 0.18 -1.33 0.00 0.00 177.39 178.14 1vc9 n LEU 108 N -3.78 1.58 0.13 2.23 4.77 -0.56 -4.41 117.00 116.96 1vc9 n LEU 108 Ca -0.39 1.12 0.12 0.00 -0.03 0.00 0.00 56.01 56.83 1vc9 n LEU 108 Cb 0.80 -1.07 0.21 0.00 -2.33 0.00 0.00 43.42 41.03 1vc9 n LEU 108 CO 0.05 -0.91 0.59 0.00 -1.33 0.00 0.00 177.39 175.78 1vc9 h ALA 109 N 5.39 0.81 -4.02 -1.18 0.00 -1.88 -3.48 119.26 114.90 1vc9 h ALA 109 Ca -0.47 0.00 -0.63 0.00 0.00 0.00 0.00 54.91 53.81 1vc9 h ALA 109 Cb 1.35 0.00 -0.24 0.00 0.00 0.00 0.00 17.79 18.90 1vc9 h ALA 109 CO 0.86 0.00 -0.85 -0.06 0.00 0.00 0.00 179.25 179.20 1vc9 s PHE 110 N -3.19 2.04 0.21 0.00 0.08 -1.26 -5.04 117.98 110.81 1vc9 s PHE 110 Ca 0.07 -0.39 -0.10 0.00 0.12 0.00 0.00 56.93 56.62 1vc9 s PHE 110 Cb 0.10 -1.18 0.28 0.00 -0.57 0.00 0.00 43.02 41.66 1vc9 s PHE 110 CO 0.68 0.17 1.72 -1.35 -0.10 0.00 0.00 175.22 176.34 1vc9 h PRO 111 N 4.50 0.30 -0.87 0.24 0.11 -1.99 -0.86 132.00 133.43 1vc9 h PRO 111 Ca -0.46 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.68 1vc9 h PRO 111 Cb 1.16 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 1vc9 h PRO 111 CO 0.42 0.20 0.57 0.93 -0.21 0.00 0.00 178.00 179.90 1vc9 h GLU 112 N 0.30 1.00 0.03 1.05 3.07 -1.96 -0.03 114.58 118.05 1vc9 h GLU 112 Ca 0.31 -0.06 -0.25 0.00 -0.50 0.00 0.00 59.36 58.86 1vc9 h GLU 112 Cb 0.43 -0.23 0.01 0.00 -0.84 0.00 0.00 28.75 28.13 1vc9 h GLU 112 CO -0.37 0.66 -1.04 -0.44 -1.40 0.00 0.00 179.01 176.43 1vc9 h ASP 113 N 1.03 0.64 -0.44 1.42 3.32 -1.65 -1.34 116.42 119.40 1vc9 h ASP 113 Ca 0.36 -0.54 -0.02 0.00 0.02 0.00 0.00 57.03 56.85 1vc9 h ASP 113 Cb 0.11 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1vc9 h ASP 113 CO -0.12 1.35 0.19 -0.07 -1.72 0.00 0.00 179.24 178.87 1vc9 h LEU 114 N 0.25 0.59 -0.58 1.55 3.38 -0.85 -0.04 115.31 119.61 1vc9 h LEU 114 Ca -0.11 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1vc9 h LEU 114 Cb 1.69 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 42.26 1vc9 h LEU 114 CO 0.19 0.58 0.32 1.23 0.09 0.00 0.00 178.44 180.85 1vc9 h GLY 115 N 0.56 0.86 1.15 0.83 0.00 -1.00 -2.45 103.07 103.02 1vc9 h GLY 115 Ca 0.15 -0.38 -0.04 0.00 0.00 0.00 0.00 47.33 47.06 1vc9 h GLY 115 CO -0.01 0.37 0.32 -2.00 0.00 0.00 0.00 176.54 175.21 1vc9 h LEU 116 N 0.78 1.00 -0.04 3.11 5.85 -0.95 -2.70 115.31 122.35 1vc9 h LEU 116 Ca 0.20 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.81 1vc9 h LEU 116 Cb 0.04 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.78 1vc9 h LEU 116 CO -0.03 0.87 -0.10 0.25 -0.34 0.00 0.00 178.44 179.09 1vc9 h LEU 117 N 1.07 -0.29 0.01 2.25 5.85 -0.54 -0.84 115.31 122.82 1vc9 h LEU 117 Ca 0.25 0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.03 1vc9 h LEU 117 Cb 0.17 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1vc9 h LEU 117 CO -0.02 -0.14 -0.03 -0.33 -0.34 0.00 0.00 178.44 177.58 1vc9 h GLU 118 N -0.14 -0.05 -0.51 1.25 4.39 -1.33 -0.44 114.58 117.74 1vc9 h GLU 118 Ca 0.05 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.81 1vc9 h GLU 118 Cb 0.21 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.85 1vc9 h GLU 118 CO -0.13 -0.04 0.34 0.28 -1.16 0.00 0.00 179.01 178.30 1vc9 h VAL 119 N -0.06 0.99 -0.18 3.13 2.07 -1.31 -1.38 116.25 119.51 1vc9 h VAL 119 Ca 0.01 -0.16 -0.11 0.00 0.82 0.00 0.00 66.70 67.26 1vc9 h VAL 119 Cb 0.07 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1vc9 h VAL 119 CO -0.03 0.09 -0.32 0.00 0.02 0.00 0.00 177.57 177.33 1vc9 h ALA 120 N 1.72 0.28 -0.88 1.67 0.00 -0.60 -2.99 119.26 118.46 1vc9 h ALA 120 Ca 0.22 -0.42 0.05 0.00 0.00 0.00 0.00 54.91 54.76 1vc9 h ALA 120 Cb 0.27 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1vc9 h ALA 120 CO -0.06 0.32 0.57 -0.07 0.00 0.00 0.00 179.25 180.01 1vc9 h LEU 121 N 0.18 0.90 -1.17 0.00 3.38 -0.18 -1.48 115.31 116.95 1vc9 h LEU 121 Ca 0.01 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 1vc9 h LEU 121 Cb 0.92 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1vc9 h LEU 121 CO 0.07 0.60 -0.32 -0.33 0.09 0.00 0.00 178.44 178.55 1vc9 h GLU 122 N 1.03 0.17 -0.01 1.13 5.08 -1.22 -2.99 114.58 117.78 1vc9 h GLU 122 Ca 0.36 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 1vc9 h GLU 122 Cb 0.13 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1vc9 h GLU 122 CO -0.12 0.47 -0.47 0.54 -1.00 0.00 0.00 179.01 178.43 1vc9 n ARG 123 N -4.12 0.52 -2.43 2.33 1.74 -0.83 -4.85 116.66 109.03 1vc9 n ARG 123 Ca -0.01 -0.35 -0.43 0.00 -0.77 0.00 0.00 57.85 56.29 1vc9 n ARG 123 Cb 0.40 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.32 1vc9 n ARG 123 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1vc9 s LEU 124 N -2.72 3.56 0.87 0.55 2.96 -0.62 -5.00 118.68 118.28 1vc9 s LEU 124 Ca 0.17 0.62 -0.10 0.00 -0.22 0.00 0.00 54.13 54.59 1vc9 s LEU 124 Cb 0.18 -3.45 0.12 0.00 0.50 0.00 0.00 46.19 43.55 1vc9 s LEU 124 CO 0.63 -1.45 1.13 -2.84 -1.32 0.00 0.00 176.35 172.51 1vc9 s PRO 125 N 4.93 1.37 0.00 0.98 0.02 -1.26 -5.01 135.00 136.03 1vc9 s PRO 125 Ca 0.56 1.45 0.27 0.00 0.02 0.00 0.00 61.00 63.29 1vc9 s PRO 125 Cb -0.11 -1.78 0.77 0.00 0.02 0.00 0.00 34.50 33.40 1vc9 s PRO 125 CO 0.31 -2.35 1.59 1.28 -0.33 0.00 0.00 177.00 177.49