#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cv4 s GLY 3 N 0.00 0.18 0.20 0.55 0.00 -1.26 -5.12 107.32 101.88 2cv4 s GLY 3 Ca 0.00 -0.57 -0.30 0.00 0.00 0.00 0.00 44.72 43.85 2cv4 s GLY 3 CO 0.00 -0.70 1.16 -0.45 0.00 0.00 0.00 173.10 173.11 2cv4 s SER 4 N -2.14 7.15 0.07 1.64 0.15 -1.26 -5.06 113.70 114.25 2cv4 s SER 4 Ca -0.05 2.22 -0.16 0.00 0.70 0.00 0.00 55.95 58.66 2cv4 s SER 4 Cb -0.01 -2.61 0.03 0.00 -1.71 0.00 0.00 66.02 61.72 2cv4 s SER 4 CO -0.05 -0.30 0.37 -0.63 1.20 0.00 0.00 173.24 173.83 2cv4 s ILE 5 N -0.31 0.07 0.81 6.45 1.09 -1.26 -3.86 121.20 124.18 2cv4 s ILE 5 Ca 0.50 -0.60 -0.11 0.00 -1.10 0.00 0.00 60.65 59.35 2cv4 s ILE 5 Cb -0.32 -1.04 0.08 0.00 -1.06 0.00 0.00 42.46 40.12 2cv4 s ILE 5 CO 0.37 -0.33 1.09 -2.84 -0.10 0.00 0.00 174.94 173.13 2cv4 s PRO 6 N -2.97 1.97 0.10 2.79 0.02 -1.26 -5.03 135.00 130.63 2cv4 s PRO 6 Ca -0.02 0.96 0.09 0.00 0.02 0.00 0.00 61.00 62.05 2cv4 s PRO 6 Cb 0.00 -1.88 -0.03 0.00 0.02 0.00 0.00 34.50 32.61 2cv4 s PRO 6 CO -0.06 -1.78 -0.23 -0.51 -0.33 0.00 0.00 177.00 174.09 2cv4 s LEU 7 N -5.96 2.28 0.19 -5.54 1.43 -1.26 -5.08 118.68 104.74 2cv4 s LEU 7 Ca 0.61 -0.67 -0.33 0.00 -1.03 0.00 0.00 54.13 52.71 2cv4 s LEU 7 Cb -0.17 -1.03 -0.14 0.00 0.03 0.00 0.00 46.19 44.89 2cv4 s LEU 7 CO 0.56 0.12 1.46 -0.38 0.23 0.00 0.00 176.35 178.34 2cv4 n ILE 8 N 1.20 0.51 0.00 -0.59 5.41 -1.26 -1.22 119.36 123.41 2cv4 n ILE 8 Ca -0.19 -0.13 0.00 0.00 1.00 0.00 0.00 62.75 63.44 2cv4 n ILE 8 Cb 0.53 -1.42 0.00 0.00 -0.71 0.00 0.00 39.64 38.04 2cv4 n ILE 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2cv4 n GLY 9 N 2.66 3.27 3.91 7.39 0.00 -0.10 -5.02 105.19 117.30 2cv4 n GLY 9 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 2cv4 n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cv4 s GLU 10 N -0.79 3.41 0.27 1.61 2.02 -0.36 -4.78 118.70 120.07 2cv4 s GLU 10 Ca 0.00 0.20 -0.29 0.00 0.02 0.00 0.00 54.97 54.89 2cv4 s GLU 10 Cb 0.00 -2.33 -0.09 0.00 0.10 0.00 0.00 34.13 31.81 2cv4 s GLU 10 CO 0.00 -0.34 1.00 0.50 0.02 0.00 0.00 175.26 176.44 2cv4 s ARG 11 N -4.83 4.74 0.24 1.61 3.52 -1.26 -0.91 118.95 122.06 2cv4 s ARG 11 Ca 0.49 1.59 -0.31 0.00 -0.13 0.00 0.00 55.73 57.37 2cv4 s ARG 11 Cb -0.10 -3.18 -0.13 0.00 -1.56 0.00 0.00 34.95 29.98 2cv4 s ARG 11 CO 0.46 0.37 1.56 0.34 -0.81 0.00 0.00 175.30 177.22 2cv4 n PHE 12 N 1.26 2.54 -1.70 5.12 -0.00 0.17 -4.86 117.46 119.99 2cv4 n PHE 12 Ca -0.01 0.27 -0.42 0.00 -0.00 0.00 0.00 57.45 57.28 2cv4 n PHE 12 Cb 0.47 -2.56 -0.00 0.00 -0.00 0.00 0.00 39.48 37.38 2cv4 n PHE 12 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 2cv4 n PRO 13 N 2.67 2.12 -2.00 -7.13 -0.02 -1.26 -4.51 135.00 124.87 2cv4 n PRO 13 Ca 0.12 0.74 -0.34 0.00 -2.02 0.00 0.00 63.50 62.00 2cv4 n PRO 13 Cb 0.33 -2.34 0.03 0.00 -0.02 0.00 0.00 33.50 31.50 2cv4 n PRO 13 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2cv4 s GLU 14 N -1.91 3.05 -0.03 -0.52 0.41 -1.26 -4.29 118.70 114.15 2cv4 s GLU 14 Ca 0.56 1.54 0.06 0.00 -0.41 0.00 0.00 54.97 56.72 2cv4 s GLU 14 Cb -0.56 -1.97 -0.01 0.00 -1.78 0.00 0.00 34.13 29.80 2cv4 s GLU 14 CO 0.62 -1.08 -0.22 -1.21 -0.49 0.00 0.00 175.26 172.88 2cv4 s GLU 16 N -3.65 1.92 0.08 1.61 2.02 -1.26 -4.99 118.70 114.42 2cv4 s GLU 16 Ca 0.71 -0.78 0.03 0.00 0.02 0.00 0.00 54.97 54.94 2cv4 s GLU 16 Cb -0.23 -1.78 -0.03 0.00 0.10 0.00 0.00 34.13 32.19 2cv4 s GLU 16 CO 0.34 0.42 -0.09 0.14 0.02 0.00 0.00 175.26 176.10 2cv4 s VAL 17 N -0.37 0.77 -0.23 2.63 -7.23 0.11 -4.98 120.40 111.10 2cv4 s VAL 17 Ca 0.05 -1.51 -0.10 0.00 -1.81 0.00 0.00 61.98 58.61 2cv4 s VAL 17 Cb -0.10 -1.18 -0.05 0.00 0.56 0.00 0.00 36.38 35.61 2cv4 s VAL 17 CO 0.00 -0.56 0.13 -0.89 -0.31 0.00 0.00 175.10 173.48 2cv4 s THR 18 N -2.32 5.16 0.37 5.32 2.01 -1.26 -0.40 115.64 124.52 2cv4 s THR 18 Ca 0.02 0.11 0.04 0.00 0.31 0.00 0.00 61.69 62.16 2cv4 s THR 18 Cb -0.04 -3.39 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 2cv4 s THR 18 CO -0.01 0.37 0.09 0.42 -0.69 0.00 0.00 174.62 174.80 2cv4 s THR 19 N 0.95 0.90 0.44 -0.82 -4.23 -0.35 -0.33 115.64 112.21 2cv4 s THR 19 Ca 0.07 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 58.85 2cv4 s THR 19 Cb -0.13 -2.55 0.47 0.00 1.34 0.00 0.00 72.50 71.63 2cv4 s THR 19 CO 0.03 0.00 1.71 0.44 -0.54 0.00 0.00 174.62 176.26 2cv4 h ASP 20 N 1.92 0.28 -0.08 3.99 5.19 -1.67 -1.42 116.42 124.63 2cv4 h ASP 20 Ca -0.38 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.11 2cv4 h ASP 20 Cb 1.26 0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.83 2cv4 h ASP 20 CO 0.64 -0.04 0.00 1.41 -3.12 0.00 0.00 179.24 178.13 2cv4 n HIS 21 N -4.56 0.08 0.00 4.55 8.25 -1.26 -4.97 115.22 117.31 2cv4 n HIS 21 Ca 0.31 -0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.71 2cv4 n HIS 21 Cb 1.20 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.31 2cv4 n HIS 21 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cv4 n GLY 22 N 0.93 1.01 3.74 -1.41 0.00 -0.54 -5.06 105.19 103.86 2cv4 n GLY 22 Ca 0.10 -2.19 -0.40 0.00 0.00 0.00 0.00 46.02 43.53 2cv4 n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cv4 s VAL 23 N -1.04 4.36 0.05 1.61 1.01 -1.26 -1.21 120.40 123.93 2cv4 s VAL 23 Ca 0.00 1.98 0.01 0.00 0.00 0.00 0.00 61.98 63.97 2cv4 s VAL 23 Cb 0.00 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 2cv4 s VAL 23 CO 0.00 0.41 -0.06 -0.63 0.00 0.00 0.00 175.10 174.83 2cv4 s ILE 24 N -0.55 0.42 -0.11 2.22 1.01 0.46 -4.96 121.20 119.69 2cv4 s ILE 24 Ca 0.43 -1.36 -0.01 0.00 0.00 0.00 0.00 60.65 59.70 2cv4 s ILE 24 Cb -0.24 -0.93 -0.03 0.00 0.01 0.00 0.00 42.46 41.28 2cv4 s ILE 24 CO 0.29 -0.63 -0.06 -0.75 0.00 0.00 0.00 174.94 173.79 2cv4 s LYS 25 N -2.47 3.19 0.04 2.79 2.20 -1.26 0.09 119.74 124.32 2cv4 s LYS 25 Ca -0.03 -0.55 0.08 0.00 -0.36 0.00 0.00 55.97 55.10 2cv4 s LYS 25 Cb -0.03 -2.72 -0.03 0.00 -1.51 0.00 0.00 37.83 33.54 2cv4 s LYS 25 CO -0.03 0.44 -0.22 -0.51 -0.36 0.00 0.00 175.35 174.68 2cv4 s LEU 26 N -0.21 2.42 0.00 5.43 1.43 -1.26 -0.50 118.68 125.99 2cv4 s LEU 26 Ca 0.03 -0.50 0.29 0.00 -1.03 0.00 0.00 54.13 52.92 2cv4 s LEU 26 Cb -0.13 -1.41 1.25 0.00 0.03 0.00 0.00 46.19 45.93 2cv4 s LEU 26 CO 0.03 0.26 1.86 -0.81 0.23 0.00 0.00 176.35 177.91 2cv4 n PRO 27 N 1.63 1.34 -0.36 1.29 -0.04 -1.26 -4.13 135.00 133.46 2cv4 n PRO 27 Ca -0.17 -0.62 -0.05 0.00 -0.04 0.00 0.00 63.50 62.62 2cv4 n PRO 27 Cb 0.52 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.47 2cv4 n PRO 27 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2cv4 n ASP 28 N -0.29 -0.76 -0.39 3.54 9.92 -1.20 -1.33 116.55 126.04 2cv4 n ASP 28 Ca 0.19 1.60 0.31 0.00 -0.53 0.00 0.00 54.79 56.36 2cv4 n ASP 28 Cb 0.29 -0.29 0.61 0.00 -0.64 0.00 0.00 41.12 41.09 2cv4 n ASP 28 CO 0.00 0.00 0.00 -0.74 0.13 0.00 0.00 177.20 176.59 2cv4 h HIS 29 N 0.00 0.47 0.01 1.24 2.76 -1.14 -0.54 115.15 117.95 2cv4 h HIS 29 Ca 0.24 0.02 -0.36 0.00 -2.20 0.00 0.00 60.37 58.06 2cv4 h HIS 29 Cb 0.46 -0.13 -0.06 0.00 1.55 0.00 0.00 27.41 29.23 2cv4 h HIS 29 CO -0.86 -0.05 -2.28 0.66 -1.30 0.00 0.00 177.93 174.09 2cv4 n TYR 30 N -4.55 0.26 0.27 5.26 4.01 -0.44 -4.17 117.16 117.80 2cv4 n TYR 30 Ca 0.31 0.08 -0.17 0.00 -0.16 0.00 0.00 57.90 57.96 2cv4 n TYR 30 Cb 1.20 -1.04 -0.08 0.00 -0.31 0.00 0.00 39.34 39.10 2cv4 n TYR 30 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2cv4 h VAL 31 N 0.01 0.19 0.00 -0.72 2.07 -0.60 0.24 116.25 117.44 2cv4 h VAL 31 Ca -0.51 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.01 2cv4 h VAL 31 Cb 2.10 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 2cv4 h VAL 31 CO 0.01 0.00 0.19 0.77 0.02 0.00 0.00 177.57 178.56 2cv4 h SER 32 N -0.86 0.00 -0.58 0.57 4.64 -1.33 0.79 113.55 116.78 2cv4 h SER 32 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2cv4 h SER 32 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 2cv4 h SER 32 CO -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.92 2cv4 n GLN 33 N -2.45 3.54 -3.13 4.77 6.02 -0.67 -4.93 117.38 120.53 2cv4 n GLN 33 Ca -0.02 -2.79 -0.23 0.00 -0.01 0.00 0.00 57.00 53.96 2cv4 n GLN 33 Cb 0.23 -1.81 0.04 0.00 1.02 0.00 0.00 30.24 29.72 2cv4 n GLN 33 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cv4 n GLY 34 N 0.90 -0.52 3.38 1.08 0.00 0.27 -4.98 105.19 105.32 2cv4 n GLY 34 Ca 0.24 0.14 -0.26 0.00 0.00 0.00 0.00 46.02 46.14 2cv4 n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cv4 s LYS 35 N -5.82 1.40 0.59 1.61 -0.14 0.77 -4.90 119.74 113.25 2cv4 s LYS 35 Ca 0.35 -1.42 -0.07 0.00 -1.36 0.00 0.00 55.97 53.48 2cv4 s LYS 35 Cb -0.16 -1.71 -0.00 0.00 -1.68 0.00 0.00 37.83 34.28 2cv4 s LYS 35 CO 0.43 0.38 0.92 -1.58 -0.76 0.00 0.00 175.35 174.74 2cv4 s TRP 36 N -1.52 3.34 -0.06 3.18 0.52 -0.37 -3.98 118.94 120.05 2cv4 s TRP 36 Ca 0.16 0.77 -0.05 0.00 0.02 0.00 0.00 56.10 57.00 2cv4 s TRP 36 Cb -0.08 -2.72 0.02 0.00 -1.15 0.00 0.00 33.47 29.54 2cv4 s TRP 36 CO 0.08 -0.78 0.16 -0.59 0.02 0.00 0.00 176.95 175.83 2cv4 s PHE 37 N -3.02 -0.17 -0.30 -1.98 -0.71 -0.62 -1.03 117.98 110.14 2cv4 s PHE 37 Ca 0.54 0.43 -0.10 0.00 -1.04 0.00 0.00 56.93 56.75 2cv4 s PHE 37 Cb -0.11 0.05 -0.02 0.00 -1.21 0.00 0.00 43.02 41.73 2cv4 s PHE 37 CO 0.47 -0.09 0.17 0.08 -1.34 0.00 0.00 175.22 174.50 2cv4 s VAL 38 N 0.15 4.85 -0.30 -2.49 1.01 0.88 -1.44 120.40 123.06 2cv4 s VAL 38 Ca -0.01 -0.21 -0.10 0.00 0.00 0.00 0.00 61.98 61.66 2cv4 s VAL 38 Cb -0.02 -3.41 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 2cv4 s VAL 38 CO -0.00 0.13 0.17 -0.22 0.00 0.00 0.00 175.10 175.18 2cv4 s LEU 39 N 1.67 4.11 -0.04 3.92 0.20 -0.52 -1.99 118.68 126.02 2cv4 s LEU 39 Ca 0.06 -0.38 0.07 0.00 0.69 0.00 0.00 54.13 54.57 2cv4 s LEU 39 Cb -0.17 -2.04 -0.01 0.00 -0.43 0.00 0.00 46.19 43.54 2cv4 s LEU 39 CO 0.08 -0.16 -0.24 0.72 -0.29 0.00 0.00 176.35 176.46 2cv4 s PHE 40 N 1.66 2.27 0.26 5.38 -0.12 -0.85 -0.77 117.98 125.82 2cv4 s PHE 40 Ca 0.06 -0.55 0.07 0.00 -0.05 0.00 0.00 56.93 56.46 2cv4 s PHE 40 Cb -0.17 -1.47 -0.03 0.00 -0.63 0.00 0.00 43.02 40.71 2cv4 s PHE 40 CO 0.08 -0.12 0.21 -1.54 -0.05 0.00 0.00 175.22 173.79 2cv4 s SER 41 N -0.36 5.48 -0.02 1.98 1.04 -0.11 -1.29 113.70 120.43 2cv4 s SER 41 Ca 0.03 -0.29 -0.05 0.00 0.48 0.00 0.00 55.95 56.12 2cv4 s SER 41 Cb -0.11 -1.34 0.00 0.00 0.10 0.00 0.00 66.02 64.67 2cv4 s SER 41 CO 0.01 -0.08 0.11 -1.00 0.98 0.00 0.00 173.24 173.26 2cv4 s HIS 42 N -2.16 -0.01 0.23 5.02 3.76 0.78 -4.10 115.29 118.81 2cv4 s HIS 42 Ca 0.34 0.04 0.00 0.00 -0.15 0.00 0.00 55.06 55.29 2cv4 s HIS 42 Cb -0.08 -0.02 0.24 0.00 1.11 0.00 0.00 32.58 33.83 2cv4 s HIS 42 CO 0.25 -0.17 1.59 -1.00 -0.85 0.00 0.00 174.74 174.57 2cv4 h PRO 43 N 5.14 0.48 -1.97 8.40 0.13 -1.76 -3.37 132.00 139.05 2cv4 h PRO 43 Ca -0.28 -0.26 0.03 0.00 -0.87 0.00 0.00 66.00 64.62 2cv4 h PRO 43 Cb 1.20 0.01 -0.19 0.00 0.13 0.00 0.00 31.00 32.15 2cv4 h PRO 43 CO 0.42 0.83 0.38 0.00 -0.23 0.00 0.00 178.00 179.40 2cv4 s ALA 44 N -4.15 -1.83 0.67 -0.56 0.00 -1.26 -4.36 121.76 110.27 2cv4 s ALA 44 Ca -0.07 1.30 -0.12 0.00 0.00 0.00 0.00 51.96 53.07 2cv4 s ALA 44 Cb 0.12 -0.13 -0.00 0.00 0.00 0.00 0.00 23.12 23.11 2cv4 s ALA 44 CO 0.82 -0.43 1.06 -0.51 0.00 0.00 0.00 175.76 176.69 2cv4 s ASP 45 N -1.51 5.48 -1.13 0.00 1.01 -1.26 -3.95 116.67 115.31 2cv4 s ASP 45 Ca -0.04 1.67 -0.06 0.00 0.71 0.00 0.00 52.55 54.83 2cv4 s ASP 45 Cb -0.00 -2.51 0.01 0.00 1.01 0.00 0.00 42.92 41.43 2cv4 s ASP 45 CO 0.01 -1.38 0.98 0.49 0.21 0.00 0.00 175.17 175.49 2cv4 n PHE 46 N -2.83 -2.36 -4.80 4.23 3.01 -1.26 -5.01 117.46 108.44 2cv4 n PHE 46 Ca 0.08 0.85 -0.25 0.00 1.01 0.00 0.00 57.45 59.15 2cv4 n PHE 46 Cb 0.53 -4.47 -0.15 0.00 -0.01 0.00 0.00 39.48 35.39 2cv4 n PHE 46 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 2cv4 s THR 47 N -3.28 1.40 0.12 4.37 -4.23 -1.25 -5.08 115.64 107.69 2cv4 s THR 47 Ca 0.42 -0.81 -0.17 0.00 -1.18 0.00 0.00 61.69 59.95 2cv4 s THR 47 Cb -0.18 -1.17 -0.03 0.00 1.34 0.00 0.00 72.50 72.45 2cv4 s THR 47 CO 0.62 0.35 1.67 1.55 -0.54 0.00 0.00 174.62 178.27 2cv4 h PRO 48 N 5.58 0.50 -1.47 3.99 0.13 -1.95 -2.33 132.00 136.46 2cv4 h PRO 48 Ca -0.37 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2cv4 h PRO 48 Cb 1.15 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2cv4 h PRO 48 CO 0.48 0.50 0.00 0.28 -0.23 0.00 0.00 178.00 179.02 2cv4 n VAL 49 N -4.71 0.17 0.00 1.56 0.31 -1.26 -1.96 118.33 112.44 2cv4 n VAL 49 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2cv4 n VAL 49 Cb 0.13 -0.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.56 2cv4 n VAL 49 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2cv4 n THR 51 N 0.79 0.00 -0.12 2.52 -1.04 -0.88 -1.29 114.28 114.27 2cv4 n THR 51 Ca 0.00 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 2cv4 n THR 51 Cb 0.09 0.00 0.14 0.00 -1.82 0.00 0.00 70.33 68.74 2cv4 n THR 51 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 2cv4 h THR 52 N 0.00 1.25 -0.29 12.58 1.35 -1.69 -1.59 112.91 124.52 2cv4 h THR 52 Ca 0.00 -1.06 -0.03 0.00 -0.55 0.00 0.00 66.41 64.77 2cv4 h THR 52 Cb 0.00 0.91 -0.01 0.00 -1.73 0.00 0.00 68.15 67.32 2cv4 h THR 52 CO 0.00 0.37 0.07 -0.33 -0.25 0.00 0.00 175.52 175.39 2cv4 h GLU 53 N 0.75 0.47 -0.93 4.72 5.08 -1.47 0.33 114.58 123.53 2cv4 h GLU 53 Ca 0.14 -0.11 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2cv4 h GLU 53 Cb 0.50 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.64 2cv4 h GLU 53 CO 0.03 0.54 0.60 0.74 -1.00 0.00 0.00 179.01 179.92 2cv4 h PHE 54 N 0.31 1.18 -0.35 4.33 -1.00 -1.77 0.33 116.94 119.97 2cv4 h PHE 54 Ca 0.09 0.02 -0.08 0.00 2.81 0.00 0.00 57.97 60.81 2cv4 h PHE 54 Cb 0.28 -0.40 -0.01 0.00 3.61 0.00 0.00 35.95 39.44 2cv4 h PHE 54 CO 0.01 0.75 -0.08 0.28 -1.61 0.00 0.00 178.31 177.67 2cv4 h VAL 55 N 1.27 1.28 -0.48 -0.55 2.07 -1.05 -0.59 116.25 118.19 2cv4 h VAL 55 Ca 0.34 -1.14 0.01 0.00 0.82 0.00 0.00 66.70 66.73 2cv4 h VAL 55 Cb -0.12 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 2cv4 h VAL 55 CO -0.07 0.38 0.31 -1.28 0.02 0.00 0.00 177.57 176.92 2cv4 h SER 56 N 0.47 0.51 -0.48 0.57 0.87 -0.37 -0.01 113.55 115.12 2cv4 h SER 56 Ca 0.09 -0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.61 2cv4 h SER 56 Cb 0.59 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 2cv4 h SER 56 CO 0.03 0.37 0.16 -0.26 -0.53 0.00 0.00 176.83 176.60 2cv4 h PHE 57 N 0.62 0.77 -0.84 2.24 0.04 -0.75 -2.39 116.94 116.63 2cv4 h PHE 57 Ca 0.19 -0.07 -0.04 0.00 2.80 0.00 0.00 57.97 60.85 2cv4 h PHE 57 Cb -0.03 -0.22 -0.04 0.00 2.20 0.00 0.00 35.95 37.86 2cv4 h PHE 57 CO -0.05 0.67 0.38 0.00 -0.60 0.00 0.00 178.31 178.71 2cv4 h ALA 58 N 1.01 1.09 0.00 2.45 0.00 -0.77 0.88 119.26 123.93 2cv4 h ALA 58 Ca 0.16 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2cv4 h ALA 58 Cb 0.25 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2cv4 h ALA 58 CO -0.01 0.67 -0.06 0.00 0.00 0.00 0.00 179.25 179.86 2cv4 h ARG 59 N 1.21 0.00 -0.35 0.00 2.47 -0.75 -2.23 114.38 114.73 2cv4 h ARG 59 Ca 0.29 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.01 2cv4 h ARG 59 Cb 0.15 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.47 2cv4 h ARG 59 CO -0.03 0.06 0.00 0.54 0.56 0.00 0.00 179.97 181.09 2cv4 n ARG 60 N -3.28 2.41 -0.11 0.04 1.74 -0.24 -4.60 116.66 112.62 2cv4 n ARG 60 Ca -0.01 -2.20 -0.07 0.00 -0.77 0.00 0.00 57.85 54.80 2cv4 n ARG 60 Cb 0.24 -1.48 -0.00 0.00 -1.02 0.00 0.00 32.46 30.19 2cv4 n ARG 60 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 2cv4 h TYR 61 N 4.21 -0.71 -0.83 -1.55 5.03 -0.26 -0.79 116.97 122.08 2cv4 h TYR 61 Ca 0.00 0.05 0.00 0.00 2.58 0.00 0.00 58.73 61.36 2cv4 h TYR 61 Cb 0.94 0.37 -0.04 0.00 1.55 0.00 0.00 36.73 39.55 2cv4 h TYR 61 CO 0.22 -0.34 0.52 0.93 -1.32 0.00 0.00 178.16 178.17 2cv4 h GLU 62 N -0.21 1.11 -0.57 1.82 5.08 -1.81 0.79 114.58 120.78 2cv4 h GLU 62 Ca 0.18 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2cv4 h GLU 62 Cb 0.49 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.47 2cv4 h GLU 62 CO -0.49 0.76 0.33 -0.44 -1.00 0.00 0.00 179.01 178.17 2cv4 h ASP 63 N 1.13 0.70 -0.43 1.42 3.32 -1.69 0.17 116.42 121.04 2cv4 h ASP 63 Ca 0.30 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.25 2cv4 h ASP 63 Cb -0.08 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 2cv4 h ASP 63 CO -0.06 0.57 0.16 -0.26 -1.72 0.00 0.00 179.24 177.93 2cv4 h PHE 64 N 0.77 0.66 -0.90 4.55 0.04 -0.59 -2.85 116.94 118.61 2cv4 h PHE 64 Ca 0.20 -0.05 -0.02 0.00 2.80 0.00 0.00 57.97 60.90 2cv4 h PHE 64 Cb 0.01 -0.19 -0.04 0.00 2.20 0.00 0.00 35.95 37.92 2cv4 h PHE 64 CO -0.02 0.58 0.50 1.96 -0.60 0.00 0.00 178.31 180.73 2cv4 h GLN 65 N 0.54 1.26 0.00 1.51 1.08 -0.31 -0.10 115.11 119.10 2cv4 h GLN 65 Ca 0.14 -0.14 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 2cv4 h GLN 65 Cb 0.21 -0.25 -0.00 0.00 -0.05 0.00 0.00 27.48 27.39 2cv4 h GLN 65 CO -0.01 0.91 -0.07 -0.09 -0.95 0.00 0.00 178.83 178.63 2cv4 h ARG 66 N 1.26 0.00 -0.13 1.46 1.12 -0.49 -0.95 114.38 116.65 2cv4 h ARG 66 Ca 0.32 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.19 2cv4 h ARG 66 Cb 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 29.98 2cv4 h ARG 66 CO -0.05 0.07 0.00 1.28 -3.11 0.00 0.00 179.97 178.16 2cv4 n LEU 67 N -3.62 1.67 0.00 3.80 4.77 -0.19 -4.89 117.00 118.54 2cv4 n LEU 67 Ca -0.02 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.30 2cv4 n LEU 67 Cb 0.18 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2cv4 n LEU 67 CO 0.28 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 2cv4 n GLY 68 N 1.15 0.55 3.43 -0.72 0.00 -0.36 -4.94 105.19 104.30 2cv4 n GLY 68 Ca 0.17 -0.83 -0.33 0.00 0.00 0.00 0.00 46.02 45.03 2cv4 n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cv4 s VAL 69 N -2.00 3.23 0.09 1.61 1.01 -0.38 -1.23 120.40 122.73 2cv4 s VAL 69 Ca 0.00 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 61.41 2cv4 s VAL 69 Cb 0.00 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 2cv4 s VAL 69 CO 0.00 0.54 0.03 -1.81 0.00 0.00 0.00 175.10 173.86 2cv4 s ASP 70 N 0.02 5.19 -0.02 3.32 1.01 -0.20 -3.38 116.67 122.62 2cv4 s ASP 70 Ca -0.03 -0.13 0.03 0.00 0.71 0.00 0.00 52.55 53.13 2cv4 s ASP 70 Cb -0.14 -1.29 -0.03 0.00 1.01 0.00 0.00 42.92 42.47 2cv4 s ASP 70 CO 0.04 0.17 -0.08 -0.76 0.21 0.00 0.00 175.17 174.75 2cv4 s LEU 71 N -2.36 3.10 -0.16 1.23 1.43 -1.26 -0.08 118.68 120.57 2cv4 s LEU 71 Ca 0.27 -0.13 -0.08 0.00 -1.03 0.00 0.00 54.13 53.16 2cv4 s LEU 71 Cb -0.12 -1.74 0.06 0.00 0.03 0.00 0.00 46.19 44.42 2cv4 s LEU 71 CO 0.20 0.31 0.38 -0.51 0.23 0.00 0.00 176.35 176.95 2cv4 s ILE 72 N -0.91 -0.06 0.60 -0.59 2.07 -0.84 -4.22 121.20 117.24 2cv4 s ILE 72 Ca 0.15 0.11 0.06 0.00 -1.41 0.00 0.00 60.65 59.56 2cv4 s ILE 72 Cb -0.11 -0.57 0.09 0.00 0.13 0.00 0.00 42.46 42.00 2cv4 s ILE 72 CO 0.05 0.04 0.82 -0.83 -1.91 0.00 0.00 174.94 173.12 2cv4 s GLY 73 N 1.44 1.77 -0.19 1.50 0.00 -0.22 -2.00 107.32 109.63 2cv4 s GLY 73 Ca -0.09 -1.92 -0.14 0.00 0.00 0.00 0.00 44.72 42.58 2cv4 s GLY 73 CO -0.12 -1.47 0.47 -2.27 0.00 0.00 0.00 173.10 169.71 2cv4 s LEU 74 N -4.77 -0.03 0.02 0.66 0.20 -0.41 -0.48 118.68 113.85 2cv4 s LEU 74 Ca 0.62 0.99 -0.17 0.00 0.69 0.00 0.00 54.13 56.26 2cv4 s LEU 74 Cb -0.06 1.60 0.03 0.00 -0.43 0.00 0.00 46.19 47.33 2cv4 s LEU 74 CO 0.40 -0.18 0.38 -0.55 -0.29 0.00 0.00 176.35 176.11 2cv4 s SER 75 N 0.82 -0.26 0.05 3.68 0.15 -1.00 -0.15 113.70 116.98 2cv4 s SER 75 Ca -0.05 0.06 0.18 0.00 0.70 0.00 0.00 55.95 56.84 2cv4 s SER 75 Cb -0.05 0.38 0.76 0.00 -1.71 0.00 0.00 66.02 65.40 2cv4 s SER 75 CO -0.06 -0.58 1.57 0.52 1.20 0.00 0.00 173.24 175.89 2cv4 n VAL 76 N 0.81 0.84 -1.70 4.45 0.31 -1.26 -0.81 118.33 120.98 2cv4 n VAL 76 Ca -0.20 0.20 -0.30 0.00 -0.01 0.00 0.00 64.34 64.03 2cv4 n VAL 76 Cb 0.58 -0.96 0.06 0.00 -0.91 0.00 0.00 33.84 32.62 2cv4 n VAL 76 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2cv4 s ASP 77 N -3.24 5.06 0.86 4.52 1.01 -1.26 -2.60 116.67 121.02 2cv4 s ASP 77 Ca 0.07 1.29 -0.12 0.00 0.71 0.00 0.00 52.55 54.50 2cv4 s ASP 77 Cb 0.11 -2.08 0.10 0.00 1.01 0.00 0.00 42.92 42.06 2cv4 s ASP 77 CO 0.33 -1.60 1.12 -0.94 0.21 0.00 0.00 175.17 174.28 2cv4 s SER 78 N -4.08 3.99 0.30 0.27 1.04 -1.26 -3.17 113.70 110.80 2cv4 s SER 78 Ca 0.59 1.12 0.05 0.00 0.48 0.00 0.00 55.95 58.19 2cv4 s SER 78 Cb -0.13 -1.76 0.49 0.00 0.10 0.00 0.00 66.02 64.72 2cv4 s SER 78 CO 0.53 -2.26 1.75 -0.37 0.98 0.00 0.00 173.24 173.87 2cv4 h VAL 79 N -1.30 1.27 -0.44 5.02 -1.51 -1.94 -1.60 116.25 115.75 2cv4 h VAL 79 Ca -0.49 -1.28 -0.01 0.00 -1.23 0.00 0.00 66.70 63.69 2cv4 h VAL 79 Cb 1.30 1.45 -0.02 0.00 -2.13 0.00 0.00 31.29 31.90 2cv4 h VAL 79 CO 0.61 0.40 0.23 -0.26 -1.23 0.00 0.00 177.57 177.31 2cv4 h PHE 80 N 0.31 0.63 -0.46 5.19 0.04 -2.00 -0.42 116.94 120.22 2cv4 h PHE 80 Ca 0.04 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.78 2cv4 h PHE 80 Cb 0.68 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 38.61 2cv4 h PHE 80 CO 0.02 0.50 0.25 0.77 -0.60 0.00 0.00 178.31 179.24 2cv4 h SER 81 N 0.58 0.58 -0.60 2.17 0.02 -1.88 -1.74 113.55 112.68 2cv4 h SER 81 Ca 0.15 -0.10 0.11 0.00 -0.84 0.00 0.00 61.79 61.12 2cv4 h SER 81 Cb 0.09 -0.15 -0.08 0.00 0.14 0.00 0.00 62.40 62.40 2cv4 h SER 81 CO -0.02 0.51 0.14 0.45 -1.14 0.00 0.00 176.83 176.77 2cv4 h HIS 82 N 0.60 0.23 -0.26 3.45 3.86 -0.67 0.43 115.15 122.80 2cv4 h HIS 82 Ca 0.16 0.03 -0.13 0.00 -1.16 0.00 0.00 60.37 59.28 2cv4 h HIS 82 Cb 0.07 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.51 2cv4 h HIS 82 CO -0.02 -0.01 -0.38 0.82 0.86 0.00 0.00 177.93 179.20 2cv4 h ILE 83 N 0.28 1.29 -0.32 2.45 2.04 -0.75 0.23 117.51 122.74 2cv4 h ILE 83 Ca 0.31 -1.53 -0.06 0.00 1.00 0.00 0.00 64.86 64.58 2cv4 h ILE 83 Cb 0.45 1.51 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 2cv4 h ILE 83 CO -0.39 0.49 -0.03 0.11 0.00 0.00 0.00 178.15 178.33 2cv4 h LYS 84 N 0.49 0.58 -0.14 2.37 1.79 -0.36 0.25 116.57 121.55 2cv4 h LYS 84 Ca 0.05 -0.20 0.00 0.00 -2.18 0.00 0.00 60.65 58.31 2cv4 h LYS 84 Cb 0.88 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.48 2cv4 h LYS 84 CO 0.08 0.74 0.09 2.35 -1.08 0.00 0.00 179.45 181.62 2cv4 h TRP 85 N 0.37 0.18 -0.80 -1.35 7.01 0.05 0.77 115.95 122.17 2cv4 h TRP 85 Ca 0.09 0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.13 2cv4 h TRP 85 Cb 0.50 -0.06 -0.05 0.00 -2.10 0.00 0.00 29.16 27.45 2cv4 h TRP 85 CO 0.04 0.14 0.53 0.87 -2.79 0.00 0.00 178.44 177.23 2cv4 h LYS 86 N 0.17 0.93 -0.46 2.65 1.57 -0.34 -0.76 116.57 120.33 2cv4 h LYS 86 Ca 0.05 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 2cv4 h LYS 86 Cb 0.01 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 2cv4 h LYS 86 CO -0.01 0.62 -0.14 1.49 -0.57 0.00 0.00 179.45 180.83 2cv4 h GLU 87 N 0.96 0.88 -0.62 3.15 4.81 0.29 -1.98 114.58 122.07 2cv4 h GLU 87 Ca 0.33 -0.32 -0.08 0.00 -0.13 0.00 0.00 59.36 59.16 2cv4 h GLU 87 Cb 0.10 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 2cv4 h GLU 87 CO -0.10 0.96 0.07 2.35 -0.73 0.00 0.00 179.01 181.56 2cv4 h TRP 88 N 0.78 1.12 -0.72 0.92 7.01 0.02 -1.56 115.95 123.52 2cv4 h TRP 88 Ca 0.12 -0.17 -0.04 0.00 2.11 0.00 0.00 58.89 60.92 2cv4 h TRP 88 Cb 0.67 -0.30 -0.03 0.00 -2.10 0.00 0.00 29.16 27.39 2cv4 h TRP 88 CO 0.04 0.96 0.31 0.82 -2.79 0.00 0.00 178.44 177.78 2cv4 h ILE 89 N 0.95 1.24 -0.60 2.65 2.04 -0.89 0.15 117.51 123.05 2cv4 h ILE 89 Ca 0.18 -0.73 -0.04 0.00 1.00 0.00 0.00 64.86 65.27 2cv4 h ILE 89 Cb 0.47 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 2cv4 h ILE 89 CO 0.02 0.30 0.20 -0.08 0.00 0.00 0.00 178.15 178.59 2cv4 h GLU 90 N 1.02 0.93 -0.04 2.37 4.81 -1.14 0.42 114.58 122.95 2cv4 h GLU 90 Ca 0.24 -0.19 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 2cv4 h GLU 90 Cb 0.17 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.42 2cv4 h GLU 90 CO -0.02 0.82 -0.27 -0.09 -0.73 0.00 0.00 179.01 178.72 2cv4 h ARG 91 N 0.85 0.25 0.00 1.92 2.43 -0.91 -1.78 114.38 117.15 2cv4 h ARG 91 Ca 0.20 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2cv4 h ARG 91 Cb 0.26 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2cv4 h ARG 91 CO -0.01 0.88 -0.97 0.72 -1.51 0.00 0.00 179.97 179.08 2cv4 n HIS 92 N -4.49 0.78 0.08 2.20 8.25 0.50 -4.32 115.22 118.22 2cv4 n HIS 92 Ca -0.09 0.23 0.03 0.00 -0.26 0.00 0.00 57.72 57.63 2cv4 n HIS 92 Cb 0.48 -0.83 -0.05 0.00 1.12 0.00 0.00 29.99 30.72 2cv4 n HIS 92 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2cv4 n ILE 93 N -2.47 0.00 -2.14 1.59 5.41 0.12 -5.01 119.36 116.86 2cv4 n ILE 93 Ca 0.01 -0.21 -0.07 0.00 1.00 0.00 0.00 62.75 63.49 2cv4 n ILE 93 Cb 0.52 0.54 -0.00 0.00 -0.71 0.00 0.00 39.64 39.98 2cv4 n ILE 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2cv4 n GLY 94 N 1.85 0.11 2.95 7.39 0.00 -0.67 -5.01 105.19 111.81 2cv4 n GLY 94 Ca -0.01 -0.61 -0.22 0.00 0.00 0.00 0.00 46.02 45.19 2cv4 n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cv4 s VAL 95 N -2.34 0.78 -0.19 1.61 1.01 -1.25 -5.01 120.40 115.01 2cv4 s VAL 95 Ca 0.00 -0.28 -0.16 0.00 0.00 0.00 0.00 61.98 61.55 2cv4 s VAL 95 Cb -0.00 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 2cv4 s VAL 95 CO 0.00 0.27 0.40 -0.60 0.00 0.00 0.00 175.10 175.18 2cv4 s ARG 96 N 0.76 4.19 -0.17 2.72 3.52 -1.26 -3.21 118.95 125.50 2cv4 s ARG 96 Ca -0.12 0.22 -0.29 0.00 -0.13 0.00 0.00 55.73 55.41 2cv4 s ARG 96 Cb -0.15 -3.52 -0.01 0.00 -1.56 0.00 0.00 34.95 29.71 2cv4 s ARG 96 CO 0.02 -0.01 1.28 0.42 -0.81 0.00 0.00 175.30 176.20 2cv4 s ILE 97 N 1.21 4.24 -1.18 4.11 1.09 -1.26 -4.90 121.20 124.51 2cv4 s ILE 97 Ca 0.20 1.50 0.26 0.00 -1.10 0.00 0.00 60.65 61.50 2cv4 s ILE 97 Cb -0.15 -3.98 0.08 0.00 -1.06 0.00 0.00 42.46 37.35 2cv4 s ILE 97 CO 0.08 -0.15 1.47 -0.81 -0.10 0.00 0.00 174.94 175.43 2cv4 n PRO 98 N 6.67 0.20 -4.11 2.79 -0.04 -1.26 -4.93 135.00 134.33 2cv4 n PRO 98 Ca 0.14 -0.11 -0.24 0.00 -0.04 0.00 0.00 63.50 63.24 2cv4 n PRO 98 Cb 0.45 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.36 2cv4 n PRO 98 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2cv4 s PHE 99 N -2.88 3.11 0.70 0.54 -0.71 -1.26 -5.09 117.98 112.39 2cv4 s PHE 99 Ca 0.14 -0.06 -0.13 0.00 -1.04 0.00 0.00 56.93 55.84 2cv4 s PHE 99 Cb 0.18 -1.46 0.02 0.00 -1.21 0.00 0.00 43.02 40.55 2cv4 s PHE 99 CO 0.65 0.52 1.10 -1.25 -1.34 0.00 0.00 175.22 174.90 2cv4 s PRO 100 N -3.39 2.63 -0.09 1.99 0.04 -1.26 -4.87 135.00 130.05 2cv4 s PRO 100 Ca 0.31 1.26 -0.01 0.00 0.04 0.00 0.00 61.00 62.61 2cv4 s PRO 100 Cb -0.09 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.54 2cv4 s PRO 100 CO 0.24 -1.37 -0.05 0.42 0.04 0.00 0.00 177.00 176.29 2cv4 s ILE 101 N -2.61 0.76 0.25 0.56 1.01 -1.26 -1.05 121.20 118.85 2cv4 s ILE 101 Ca 0.64 -0.12 -0.30 0.00 0.00 0.00 0.00 60.65 60.86 2cv4 s ILE 101 Cb -0.18 -0.83 -0.10 0.00 0.01 0.00 0.00 42.46 41.36 2cv4 s ILE 101 CO 0.48 0.32 1.44 -0.63 0.00 0.00 0.00 174.94 176.55 2cv4 s ILE 102 N 1.77 2.66 -0.29 2.92 1.01 0.36 -1.64 121.20 128.01 2cv4 s ILE 102 Ca 0.04 0.56 -0.08 0.00 0.00 0.00 0.00 60.65 61.17 2cv4 s ILE 102 Cb -0.13 -3.36 -0.01 0.00 0.01 0.00 0.00 42.46 38.98 2cv4 s ILE 102 CO -0.07 0.09 0.11 0.00 0.00 0.00 0.00 174.94 175.07 2cv4 s ALA 103 N 0.00 3.19 -0.59 9.38 0.00 0.55 -2.38 121.76 131.91 2cv4 s ALA 103 Ca 0.59 -1.31 0.06 0.00 0.00 0.00 0.00 51.96 51.30 2cv4 s ALA 103 Cb -0.42 -2.22 0.30 0.00 0.00 0.00 0.00 23.12 20.78 2cv4 s ALA 103 CO 0.43 -0.76 0.84 -3.47 0.00 0.00 0.00 175.76 172.81 2cv4 n ASP 104 N 4.94 3.92 -0.34 0.00 2.03 0.01 -4.60 116.55 122.51 2cv4 n ASP 104 Ca -0.15 -3.53 0.30 0.00 0.52 0.00 0.00 54.79 51.93 2cv4 n ASP 104 Cb 0.50 -0.61 0.63 0.00 -0.72 0.00 0.00 41.12 40.92 2cv4 n ASP 104 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2cv4 h PRO 105 N 3.51 0.18 -5.10 -0.67 0.11 -1.66 -3.31 132.00 125.05 2cv4 h PRO 105 Ca 0.16 -0.01 -0.67 0.00 0.11 0.00 0.00 66.00 65.59 2cv4 h PRO 105 Cb 0.60 -0.04 -0.33 0.00 0.11 0.00 0.00 31.00 31.34 2cv4 h PRO 105 CO 0.80 0.12 -0.83 -0.65 -0.21 0.00 0.00 178.00 177.24 2cv4 s GLN 106 N -5.22 3.11 0.00 1.05 -1.52 -1.26 -4.94 119.66 110.88 2cv4 s GLN 106 Ca -0.07 -0.78 0.00 0.00 -1.95 0.00 0.00 55.36 52.56 2cv4 s GLN 106 Cb 0.25 -2.63 0.00 0.00 -0.22 0.00 0.00 33.01 30.40 2cv4 s GLN 106 CO 0.80 -0.13 0.00 0.41 -0.25 0.00 0.00 175.29 176.13 2cv4 n GLY 107 N 4.44 0.00 0.32 3.09 0.00 -1.25 -3.95 105.19 107.84 2cv4 n GLY 107 Ca -0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.84 2cv4 n GLY 107 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2cv4 h THR 108 N 0.04 0.14 0.04 2.61 2.02 -1.93 2.09 112.91 117.91 2cv4 h THR 108 Ca 0.00 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 66.98 2cv4 h THR 108 Cb 0.00 0.14 0.02 0.00 -1.74 0.00 0.00 68.15 66.56 2cv4 h THR 108 CO 0.00 0.00 -0.82 0.58 0.37 0.00 0.00 175.52 175.65 2cv4 h VAL 109 N -0.01 1.39 -0.01 3.16 2.07 -1.91 -2.06 116.25 118.88 2cv4 h VAL 109 Ca 0.39 -2.24 0.03 0.00 0.82 0.00 0.00 66.70 65.70 2cv4 h VAL 109 Cb 0.62 2.66 -0.04 0.00 -1.52 0.00 0.00 31.29 33.01 2cv4 h VAL 109 CO -0.87 0.66 -0.19 0.00 0.02 0.00 0.00 177.57 177.19 2cv4 h ALA 110 N 0.29 -0.23 -0.39 1.67 0.00 -1.38 -1.38 119.26 117.84 2cv4 h ALA 110 Ca -0.11 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.81 2cv4 h ALA 110 Cb 1.53 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 19.64 2cv4 h ALA 110 CO 0.16 -0.68 0.26 0.00 0.00 0.00 0.00 179.25 178.99 2cv4 h ARG 111 N -0.30 0.51 -0.23 0.00 3.08 0.32 0.17 114.38 117.93 2cv4 h ARG 111 Ca 0.06 -0.03 0.07 0.00 0.07 0.00 0.00 59.98 60.14 2cv4 h ARG 111 Cb 0.38 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 2cv4 h ARG 111 CO -0.18 0.34 0.23 -0.09 -1.07 0.00 0.00 179.97 179.20 2cv4 h ARG 112 N 0.53 0.00 -0.55 0.04 9.65 -0.86 0.16 114.38 123.35 2cv4 h ARG 112 Ca 0.14 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.02 2cv4 h ARG 112 Cb -0.06 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.52 2cv4 h ARG 112 CO -0.03 0.00 0.00 1.28 2.80 0.00 0.00 179.97 184.02 2cv4 n LEU 113 N -3.87 3.52 -3.45 3.80 4.77 -0.56 -4.80 117.00 116.41 2cv4 n LEU 113 Ca 0.03 -1.91 -0.24 0.00 -0.03 0.00 0.00 56.01 53.85 2cv4 n LEU 113 Cb 0.37 -0.37 0.05 0.00 -2.33 0.00 0.00 43.42 41.14 2cv4 n LEU 113 CO 0.28 0.86 0.13 0.61 -1.33 0.00 0.00 177.39 177.95 2cv4 n GLY 114 N 1.25 -0.53 0.66 -0.72 0.00 0.55 -4.38 105.19 102.02 2cv4 n GLY 114 Ca 0.19 0.20 0.13 0.00 0.00 0.00 0.00 46.02 46.54 2cv4 n GLY 114 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cv4 n LEU 115 N -4.58 2.02 -4.40 0.99 4.77 0.50 -4.66 117.00 111.63 2cv4 n LEU 115 Ca -0.03 -0.74 -0.45 0.00 -0.03 0.00 0.00 56.01 54.76 2cv4 n LEU 115 Cb 0.57 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.60 2cv4 n LEU 115 CO 0.60 0.37 0.93 -0.22 -1.33 0.00 0.00 177.39 177.74 2cv4 s LEU 116 N -1.84 5.74 0.00 2.23 2.96 -1.26 -0.66 118.68 125.84 2cv4 s LEU 116 Ca 0.35 -2.83 0.00 0.00 -0.22 0.00 0.00 54.13 51.43 2cv4 s LEU 116 Cb 0.20 -2.31 0.00 0.00 0.50 0.00 0.00 46.19 44.58 2cv4 s LEU 116 CO 0.31 -0.68 0.00 1.41 -1.32 0.00 0.00 176.35 176.07 2cv4 n HIS 117 N 4.82 -2.81 1.34 5.38 8.25 -1.26 -5.01 115.22 125.92 2cv4 n HIS 117 Ca 0.25 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.85 2cv4 n HIS 117 Cb 0.44 0.00 0.39 0.00 1.12 0.00 0.00 29.99 31.95 2cv4 n HIS 117 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2cv4 n ALA 118 N -3.00 2.66 0.82 -1.41 0.00 -1.26 -4.03 120.51 114.29 2cv4 n ALA 118 Ca 0.00 -0.50 0.10 0.00 0.00 0.00 0.00 53.44 53.04 2cv4 n ALA 118 Cb 0.00 -1.07 0.47 0.00 0.00 0.00 0.00 19.45 18.86 2cv4 n ALA 118 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2cv4 n GLU 119 N 0.31 0.12 0.00 0.00 2.13 -1.26 -4.75 120.64 117.20 2cv4 n GLU 119 Ca 0.17 0.12 0.00 0.00 0.66 0.00 0.00 57.16 58.11 2cv4 n GLU 119 Cb 0.41 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.62 2cv4 n GLU 119 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2cv4 n SER 120 N -1.41 0.00 -4.73 4.31 7.64 -1.26 -5.11 113.62 113.07 2cv4 n SER 120 Ca 0.07 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.62 2cv4 n SER 120 Cb 0.21 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.51 2cv4 n SER 120 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2cv4 s ALA 121 N 0.00 2.09 -0.26 -0.43 0.00 -1.26 -3.68 121.76 118.22 2cv4 s ALA 121 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 51.96 52.67 2cv4 s ALA 121 Cb 0.00 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.70 2cv4 s ALA 121 CO 0.00 -1.89 0.00 0.25 0.00 0.00 0.00 175.76 174.12 2cv4 n THR 122 N -2.98 0.00 -3.44 0.00 -2.24 -1.26 -4.94 114.28 99.42 2cv4 n THR 122 Ca 0.12 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.84 2cv4 n THR 122 Cb 0.51 -0.96 -0.07 0.00 -2.10 0.00 0.00 70.33 67.71 2cv4 n THR 122 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2cv4 s HIS 123 N -1.37 -0.98 0.25 4.78 4.02 -1.24 -5.02 115.29 115.73 2cv4 s HIS 123 Ca 0.00 1.31 -0.29 0.00 1.02 0.00 0.00 55.06 57.09 2cv4 s HIS 123 Cb 0.00 0.26 -0.15 0.00 -1.02 0.00 0.00 32.58 31.67 2cv4 s HIS 123 CO 0.00 -0.67 1.05 2.41 1.02 0.00 0.00 174.74 178.55 2cv4 n THR 124 N 5.39 1.65 -0.62 1.30 -1.04 -1.26 -4.78 114.28 114.92 2cv4 n THR 124 Ca -0.05 -0.41 -0.28 0.00 -2.04 0.00 0.00 64.05 61.26 2cv4 n THR 124 Cb 0.50 -0.93 0.25 0.00 -1.82 0.00 0.00 70.33 68.33 2cv4 n THR 124 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2cv4 s VAL 125 N -0.78 1.91 -1.24 12.58 1.01 0.16 -2.85 120.40 131.19 2cv4 s VAL 125 Ca 0.63 0.00 -0.05 0.00 0.00 0.00 0.00 61.98 62.56 2cv4 s VAL 125 Cb -0.75 -2.13 0.10 0.00 0.00 0.00 0.00 36.38 33.60 2cv4 s VAL 125 CO 0.57 0.00 2.46 -1.14 0.00 0.00 0.00 175.10 176.99 2cv4 n ARG 126 N -4.94 4.34 -2.99 2.72 0.63 -1.25 -4.04 116.66 111.13 2cv4 n ARG 126 Ca 0.04 -3.28 -0.34 0.00 -0.92 0.00 0.00 57.85 53.35 2cv4 n ARG 126 Cb 0.55 -2.59 -0.06 0.00 0.45 0.00 0.00 32.46 30.81 2cv4 n ARG 126 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2cv4 s GLY 127 N 0.47 2.44 -0.06 5.14 0.00 -1.26 -2.43 107.32 111.62 2cv4 s GLY 127 Ca 0.55 0.23 -0.01 0.00 0.00 0.00 0.00 44.72 45.49 2cv4 s GLY 127 CO -0.11 0.50 0.01 0.14 0.00 0.00 0.00 173.10 173.65 2cv4 s VAL 128 N -1.95 0.26 -0.14 1.40 1.01 0.07 -0.93 120.40 120.12 2cv4 s VAL 128 Ca 0.55 0.19 -0.02 0.00 0.00 0.00 0.00 61.98 62.70 2cv4 s VAL 128 Cb -0.11 -0.44 -0.02 0.00 0.00 0.00 0.00 36.38 35.81 2cv4 s VAL 128 CO 0.17 0.24 -0.08 -0.36 0.00 0.00 0.00 175.10 175.06 2cv4 s PHE 129 N 1.96 2.92 -0.32 5.22 0.40 0.05 -1.45 117.98 126.76 2cv4 s PHE 129 Ca 0.04 -0.43 -0.06 0.00 -0.60 0.00 0.00 56.93 55.88 2cv4 s PHE 129 Cb -0.12 -1.88 0.03 0.00 0.51 0.00 0.00 43.02 41.56 2cv4 s PHE 129 CO -0.05 -0.09 0.09 0.42 0.70 0.00 0.00 175.22 176.29 2cv4 s ILE 130 N 0.26 3.74 -0.10 0.64 1.01 -0.67 -1.44 121.20 124.64 2cv4 s ILE 130 Ca -0.06 -1.04 -0.01 0.00 0.00 0.00 0.00 60.65 59.54 2cv4 s ILE 130 Cb -0.15 -3.07 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 2cv4 s ILE 130 CO 0.04 -0.10 -0.05 -0.69 0.00 0.00 0.00 174.94 174.14 2cv4 s VAL 131 N 1.41 3.81 0.70 2.92 1.01 -0.52 -0.36 120.40 129.36 2cv4 s VAL 131 Ca -0.01 -0.42 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 2cv4 s VAL 131 Cb -0.19 -2.60 0.15 0.00 0.00 0.00 0.00 36.38 33.74 2cv4 s VAL 131 CO 0.02 0.56 0.96 -0.90 0.00 0.00 0.00 175.10 175.74 2cv4 n ASP 132 N 2.72 0.85 0.00 3.32 5.68 -0.34 -1.60 116.55 127.19 2cv4 n ASP 132 Ca -0.18 -1.82 0.06 0.00 -0.50 0.00 0.00 54.79 52.35 2cv4 n ASP 132 Cb 0.53 -0.66 0.34 0.00 -1.14 0.00 0.00 41.12 40.19 2cv4 n ASP 132 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2cv4 n ALA 133 N -3.17 1.95 -0.64 2.12 0.00 -1.26 -0.23 120.51 119.28 2cv4 n ALA 133 Ca -0.16 -0.07 0.07 0.00 0.00 0.00 0.00 53.44 53.28 2cv4 n ALA 133 Cb 0.51 -1.19 0.19 0.00 0.00 0.00 0.00 19.45 18.96 2cv4 n ALA 133 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2cv4 n ARG 134 N -0.97 2.72 -1.17 0.00 1.85 -1.26 -4.71 116.66 113.11 2cv4 n ARG 134 Ca 0.09 -2.42 -0.04 0.00 -1.00 0.00 0.00 57.85 54.48 2cv4 n ARG 134 Cb 0.04 -1.53 -0.02 0.00 -1.05 0.00 0.00 32.46 29.90 2cv4 n ARG 134 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2cv4 n GLY 135 N -0.29 0.64 3.72 2.89 0.00 0.67 -4.94 105.19 107.88 2cv4 n GLY 135 Ca 0.15 -0.89 -0.36 0.00 0.00 0.00 0.00 46.02 44.92 2cv4 n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cv4 s VAL 136 N -2.14 5.35 -0.11 1.61 1.01 -1.25 0.43 120.40 125.29 2cv4 s VAL 136 Ca 0.00 0.38 -0.29 0.00 0.00 0.00 0.00 61.98 62.07 2cv4 s VAL 136 Cb 0.00 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 2cv4 s VAL 136 CO 0.00 0.39 1.48 -0.63 0.00 0.00 0.00 175.10 176.35 2cv4 s ILE 137 N 0.54 3.89 -0.23 2.22 1.01 -0.08 -1.19 121.20 127.35 2cv4 s ILE 137 Ca 0.12 1.07 0.14 0.00 0.00 0.00 0.00 60.65 61.98 2cv4 s ILE 137 Cb -0.12 -3.70 -0.20 0.00 0.01 0.00 0.00 42.46 38.45 2cv4 s ILE 137 CO 0.02 -0.11 0.40 0.54 0.00 0.00 0.00 174.94 175.79 2cv4 n ARG 138 N 6.94 1.10 -1.88 2.79 5.12 0.51 -0.92 116.66 130.32 2cv4 n ARG 138 Ca 0.16 -0.09 -0.01 0.00 -1.93 0.00 0.00 57.85 55.98 2cv4 n ARG 138 Cb 0.44 -1.28 0.01 0.00 -1.16 0.00 0.00 32.46 30.47 2cv4 n ARG 138 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 2cv4 n THR 139 N -1.77 0.00 -3.65 0.55 -1.04 -1.22 -4.94 114.28 102.22 2cv4 n THR 139 Ca -0.01 -0.16 -0.03 0.00 -2.04 0.00 0.00 64.05 61.81 2cv4 n THR 139 Cb 0.32 0.20 -0.07 0.00 -1.82 0.00 0.00 70.33 68.96 2cv4 n THR 139 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2cv4 s LEU 141 N 0.00 -0.19 -0.43 -4.42 1.43 -0.53 -1.66 118.68 112.88 2cv4 s LEU 141 Ca 0.05 0.35 0.02 0.00 -1.03 0.00 0.00 54.13 53.52 2cv4 s LEU 141 Cb -0.01 1.35 0.14 0.00 0.03 0.00 0.00 46.19 47.69 2cv4 s LEU 141 CO 0.02 -0.06 0.24 -0.31 0.23 0.00 0.00 176.35 176.46 2cv4 s TYR 142 N 0.43 1.82 0.53 0.29 2.02 -1.26 -0.75 117.35 120.42 2cv4 s TYR 142 Ca 0.01 -2.32 -0.08 0.00 -0.37 0.00 0.00 57.07 54.32 2cv4 s TYR 142 Cb -0.04 -1.76 -0.04 0.00 -0.40 0.00 0.00 41.96 39.72 2cv4 s TYR 142 CO -0.12 -0.79 0.88 0.71 -1.57 0.00 0.00 175.55 174.66 2cv4 s TYR 143 N 0.44 3.58 0.00 2.71 4.12 -1.02 -4.99 117.35 122.20 2cv4 s TYR 143 Ca 0.18 1.02 0.00 0.00 0.02 0.00 0.00 57.07 58.29 2cv4 s TYR 143 Cb -0.24 -2.48 0.00 0.00 -1.52 0.00 0.00 41.96 37.72 2cv4 s TYR 143 CO 0.00 -0.42 0.00 -0.35 0.02 0.00 0.00 175.55 174.80 2cv4 n PRO 144 N -2.37 0.00 0.00 -1.71 -0.04 -1.26 -3.95 135.00 125.67 2cv4 n PRO 144 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 2cv4 n PRO 144 Cb 0.55 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.01 2cv4 n PRO 144 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2cv4 n GLU 146 N 0.00 0.00 -3.98 0.54 0.00 -1.26 -4.64 120.64 111.30 2cv4 n GLU 146 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 57.16 56.86 2cv4 n GLU 146 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 31.44 31.28 2cv4 n GLU 146 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 2cv4 s LEU 147 N 0.00 2.05 0.45 -1.84 1.98 -1.26 -5.09 118.68 114.97 2cv4 s LEU 147 Ca 0.00 -0.77 -0.24 0.00 -2.89 0.00 0.00 54.13 50.23 2cv4 s LEU 147 Cb 0.00 -1.16 -0.07 0.00 0.66 0.00 0.00 46.19 45.61 2cv4 s LEU 147 CO 0.00 -0.14 1.23 -0.83 -1.89 0.00 0.00 176.35 174.72 2cv4 s GLY 148 N 1.46 2.85 0.90 7.98 0.00 -1.26 -4.91 107.32 114.34 2cv4 s GLY 148 Ca 0.00 1.08 -0.11 0.00 0.00 0.00 0.00 44.72 45.69 2cv4 s GLY 148 CO -0.09 1.58 1.09 0.50 0.00 0.00 0.00 173.10 176.19 2cv4 s ARG 149 N -2.56 1.18 -0.53 2.90 0.52 -1.26 -4.99 118.95 114.20 2cv4 s ARG 149 Ca 0.62 0.96 -0.05 0.00 -0.52 0.00 0.00 55.73 56.74 2cv4 s ARG 149 Cb -0.33 -1.79 0.14 0.00 0.52 0.00 0.00 34.95 33.49 2cv4 s ARG 149 CO 0.41 -2.34 0.37 -1.17 0.02 0.00 0.00 175.30 172.59 2cv4 s LEU 150 N -6.31 5.49 0.48 2.53 0.20 -1.26 -4.96 118.68 114.86 2cv4 s LEU 150 Ca 0.64 -2.33 0.21 0.00 0.69 0.00 0.00 54.13 53.34 2cv4 s LEU 150 Cb -0.19 -1.92 1.24 0.00 -0.43 0.00 0.00 46.19 44.89 2cv4 s LEU 150 CO 0.58 -0.53 2.03 0.58 -0.29 0.00 0.00 176.35 178.72 2cv4 h VAL 151 N 5.81 0.83 0.00 1.68 2.07 -1.97 -1.66 116.25 123.02 2cv4 h VAL 151 Ca -0.10 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 66.79 2cv4 h VAL 151 Cb 1.02 1.36 -0.00 0.00 -1.52 0.00 0.00 31.29 32.14 2cv4 h VAL 151 CO 0.75 0.16 -0.14 0.44 0.02 0.00 0.00 177.57 178.80 2cv4 h ASP 152 N 0.00 0.00 0.28 0.57 3.32 -1.92 -2.55 116.42 116.12 2cv4 h ASP 152 Ca -0.00 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.86 2cv4 h ASP 152 Cb 0.34 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.89 2cv4 h ASP 152 CO 0.02 0.14 -0.76 -0.08 -1.72 0.00 0.00 179.24 176.84 2cv4 h GLU 153 N 0.00 0.40 -0.42 3.56 4.57 -1.67 -2.46 114.58 118.56 2cv4 h GLU 153 Ca -0.00 -0.34 -0.02 0.00 -1.18 0.00 0.00 59.36 57.82 2cv4 h GLU 153 Cb 0.41 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.06 2cv4 h GLU 153 CO 0.02 0.98 0.19 0.82 -1.18 0.00 0.00 179.01 179.84 2cv4 h ILE 154 N 0.26 1.15 -0.31 2.32 2.04 -1.51 0.06 117.51 121.52 2cv4 h ILE 154 Ca -0.04 -0.44 -0.18 0.00 1.00 0.00 0.00 64.86 65.20 2cv4 h ILE 154 Cb 1.34 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 38.05 2cv4 h ILE 154 CO 0.13 0.18 -0.51 -0.07 0.00 0.00 0.00 178.15 177.88 2cv4 h LEU 155 N 0.58 0.98 -0.47 1.44 3.38 -1.39 -2.39 115.31 117.45 2cv4 h LEU 155 Ca 0.15 -0.52 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 2cv4 h LEU 155 Cb 0.09 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2cv4 h LEU 155 CO -0.02 1.31 0.25 -0.09 0.09 0.00 0.00 178.44 179.99 2cv4 h ARG 156 N 0.68 0.66 0.31 1.13 2.43 -0.91 0.34 114.38 119.02 2cv4 h ARG 156 Ca 0.02 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2cv4 h ARG 156 Cb 1.12 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.52 2cv4 h ARG 156 CO 0.12 0.52 -0.30 0.82 -1.51 0.00 0.00 179.97 179.62 2cv4 h ILE 157 N 0.62 0.37 -0.96 1.20 2.04 -0.91 0.60 117.51 120.47 2cv4 h ILE 157 Ca 0.16 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.03 2cv4 h ILE 157 Cb 0.06 0.37 -0.05 0.00 -0.74 0.00 0.00 36.82 36.47 2cv4 h ILE 157 CO -0.03 0.00 0.63 0.58 0.00 0.00 0.00 178.15 179.34 2cv4 h VAL 158 N -0.64 1.24 0.10 1.67 2.07 -1.26 0.30 116.25 119.73 2cv4 h VAL 158 Ca -0.02 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.06 2cv4 h VAL 158 Cb 0.58 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 2cv4 h VAL 158 CO -0.05 0.24 -0.05 0.50 0.02 0.00 0.00 177.57 178.23 2cv4 h LYS 159 N 1.29 -0.12 -0.63 1.57 1.63 -0.51 -1.32 116.57 118.48 2cv4 h LYS 159 Ca 0.35 0.01 -0.07 0.00 -0.85 0.00 0.00 60.65 60.09 2cv4 h LYS 159 Cb -0.15 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 31.49 2cv4 h LYS 159 CO -0.08 -0.01 0.10 0.00 -3.45 0.00 0.00 179.45 176.01 2cv4 h ALA 160 N 0.69 0.99 -0.88 5.00 0.00 -0.60 -2.04 119.26 122.43 2cv4 h ALA 160 Ca -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2cv4 h ALA 160 Cb 0.17 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 2cv4 h ALA 160 CO 0.02 0.64 0.49 -0.07 0.00 0.00 0.00 179.25 180.33 2cv4 h LEU 161 N 0.96 1.08 -0.47 0.00 4.07 -0.84 0.23 115.31 120.34 2cv4 h LEU 161 Ca 0.19 -0.09 -0.16 0.00 0.08 0.00 0.00 57.88 57.90 2cv4 h LEU 161 Cb 0.42 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 2cv4 h LEU 161 CO 0.01 0.86 -0.45 0.11 -1.08 0.00 0.00 178.44 177.89 2cv4 h LYS 162 N 1.22 0.77 -0.67 1.13 1.57 -0.94 -0.72 116.57 118.93 2cv4 h LYS 162 Ca 0.31 -0.43 -0.07 0.00 -1.87 0.00 0.00 60.65 58.59 2cv4 h LYS 162 Cb 0.01 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 2cv4 h LYS 162 CO -0.05 1.06 0.14 -0.07 -0.57 0.00 0.00 179.45 179.96 2cv4 h LEU 163 N 0.62 1.03 0.56 2.94 3.38 -1.07 -1.70 115.31 121.06 2cv4 h LEU 163 Ca 0.04 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 2cv4 h LEU 163 Cb 1.01 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.49 2cv4 h LEU 163 CO 0.10 1.00 -0.33 1.23 0.09 0.00 0.00 178.44 180.53 2cv4 h GLY 164 N 1.06 -0.90 0.38 0.83 0.00 -0.24 -0.05 103.07 104.16 2cv4 h GLY 164 Ca 0.21 0.37 0.16 0.00 0.00 0.00 0.00 47.33 48.07 2cv4 h GLY 164 CO 0.01 -0.33 0.60 -0.55 0.00 0.00 0.00 176.54 176.27 2cv4 h ASP 165 N -0.84 0.70 0.42 0.19 5.19 -1.03 0.42 116.42 121.48 2cv4 h ASP 165 Ca -0.07 0.06 -0.30 0.00 -0.62 0.00 0.00 57.03 56.09 2cv4 h ASP 165 Cb 0.68 -0.08 -0.05 0.00 0.18 0.00 0.00 39.33 40.06 2cv4 h ASP 165 CO 0.08 0.32 -1.80 -1.54 -3.12 0.00 0.00 179.24 173.18 2cv4 n SER 166 N -4.61 0.87 -0.75 6.45 3.41 -0.65 -4.00 113.62 114.34 2cv4 n SER 166 Ca 0.19 0.36 0.13 0.00 -0.26 0.00 0.00 58.87 59.29 2cv4 n SER 166 Cb 0.51 -0.01 0.31 0.00 -0.26 0.00 0.00 64.21 64.76 2cv4 n SER 166 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2cv4 n LEU 167 N -3.04 2.31 -3.68 1.04 4.77 -0.04 -4.97 117.00 113.37 2cv4 n LEU 167 Ca -0.20 -0.82 -0.28 0.00 -0.03 0.00 0.00 56.01 54.68 2cv4 n LEU 167 Cb 1.06 -0.04 0.04 0.00 -2.33 0.00 0.00 43.42 42.15 2cv4 n LEU 167 CO 0.45 0.41 -0.08 0.29 -1.33 0.00 0.00 177.39 177.12 2cv4 n LYS 168 N 0.79 -2.02 -4.22 3.23 5.02 0.14 -5.01 118.16 116.08 2cv4 n LYS 168 Ca 0.17 0.50 -0.13 0.00 -2.02 0.00 0.00 58.31 56.83 2cv4 n LYS 168 Cb 0.47 -4.44 -0.10 0.00 -0.02 0.00 0.00 35.03 30.94 2cv4 n LYS 168 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2cv4 s ARG 169 N -5.93 1.08 0.17 1.97 1.81 -0.73 -4.61 118.95 112.72 2cv4 s ARG 169 Ca 0.36 -1.52 0.07 0.00 -1.72 0.00 0.00 55.73 52.91 2cv4 s ARG 169 Cb -0.12 -0.12 -0.04 0.00 -0.45 0.00 0.00 34.95 34.22 2cv4 s ARG 169 CO 0.85 -0.18 0.03 0.00 -0.68 0.00 0.00 175.30 175.32 2cv4 s ALA 170 N -3.78 3.30 -0.22 2.13 0.00 0.10 -4.49 121.76 118.80 2cv4 s ALA 170 Ca 0.25 -1.33 -0.05 0.00 0.00 0.00 0.00 51.96 50.82 2cv4 s ALA 170 Cb 0.07 -1.08 -0.02 0.00 0.00 0.00 0.00 23.12 22.08 2cv4 s ALA 170 CO 0.04 0.48 0.01 0.08 0.00 0.00 0.00 175.76 176.37 2cv4 s VAL 171 N -1.75 3.89 0.91 0.00 1.01 -1.26 -0.83 120.40 122.37 2cv4 s VAL 171 Ca 0.28 -0.33 -0.11 0.00 0.00 0.00 0.00 61.98 61.83 2cv4 s VAL 171 Cb -0.09 -2.78 0.14 0.00 0.00 0.00 0.00 36.38 33.65 2cv4 s VAL 171 CO 0.20 0.40 1.11 -2.16 0.00 0.00 0.00 175.10 174.65 2cv4 s PRO 172 N 1.27 1.07 0.22 2.72 0.04 -1.26 -4.90 135.00 134.17 2cv4 s PRO 172 Ca 0.04 1.24 -0.32 0.00 0.04 0.00 0.00 61.00 62.00 2cv4 s PRO 172 Cb -0.15 -1.76 -0.13 0.00 0.04 0.00 0.00 34.50 32.51 2cv4 s PRO 172 CO 0.01 -2.49 1.49 0.00 0.04 0.00 0.00 177.00 176.04 2cv4 n ALA 173 N -4.11 1.39 -1.30 8.56 0.00 -1.26 -1.64 120.51 122.15 2cv4 n ALA 173 Ca 0.09 0.42 -0.10 0.00 0.00 0.00 0.00 53.44 53.84 2cv4 n ALA 173 Cb 0.53 -2.32 -0.04 0.00 0.00 0.00 0.00 19.45 17.61 2cv4 n ALA 173 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2cv4 n ASP 174 N 2.55 -4.49 -4.76 0.00 8.00 -1.26 -4.25 116.55 112.34 2cv4 n ASP 174 Ca 0.13 0.26 -0.40 0.00 0.71 0.00 0.00 54.79 55.49 2cv4 n ASP 174 Cb 0.31 -2.90 0.02 0.00 -0.02 0.00 0.00 41.12 38.53 2cv4 n ASP 174 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 2cv4 s TRP 175 N -2.31 2.40 -0.41 1.24 -0.00 -0.65 -0.19 118.94 119.02 2cv4 s TRP 175 Ca 0.00 1.25 0.06 0.00 -0.00 0.00 0.00 56.10 57.41 2cv4 s TRP 175 Cb 0.00 -3.95 0.50 0.00 -0.00 0.00 0.00 33.47 30.02 2cv4 s TRP 175 CO 0.00 -3.04 1.45 -0.35 -0.00 0.00 0.00 176.95 175.00 2cv4 n PRO 176 N -0.29 2.82 -2.20 5.86 -0.04 -1.26 -4.92 135.00 134.97 2cv4 n PRO 176 Ca 0.06 -2.04 -0.26 0.00 -0.04 0.00 0.00 63.50 61.21 2cv4 n PRO 176 Cb 0.42 -1.91 0.01 0.00 -0.04 0.00 0.00 33.50 31.98 2cv4 n PRO 176 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2cv4 n ASN 177 N -0.02 5.05 -4.77 3.54 3.02 0.73 -3.15 115.26 119.67 2cv4 n ASN 177 Ca 0.27 -3.74 -0.39 0.00 -0.03 0.00 0.00 54.58 50.69 2cv4 n ASN 177 Cb 1.05 -0.45 -0.01 0.00 -0.61 0.00 0.00 39.78 39.76 2cv4 n ASN 177 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2cv4 s ASN 178 N -3.40 6.36 0.34 6.41 2.47 -0.03 -4.84 114.94 122.26 2cv4 s ASN 178 Ca 0.50 2.58 0.11 0.00 0.42 0.00 0.00 52.86 56.48 2cv4 s ASN 178 Cb 0.41 -2.63 0.60 0.00 -1.45 0.00 0.00 41.25 38.18 2cv4 s ASN 178 CO -0.09 -0.81 1.76 -0.33 -3.72 0.00 0.00 177.10 173.92 2cv4 h GLU 179 N 2.68 0.05 0.06 0.43 5.08 -1.88 -1.28 114.58 119.71 2cv4 h GLU 179 Ca -0.49 -0.02 -0.30 0.00 -1.00 0.00 0.00 59.36 57.54 2cv4 h GLU 179 Cb 1.24 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 2cv4 h GLU 179 CO 0.63 0.47 -1.65 -0.89 -1.00 0.00 0.00 179.01 176.56 2cv4 n ILE 180 N -4.03 1.65 0.12 3.13 5.41 -1.26 -4.64 119.36 119.73 2cv4 n ILE 180 Ca -0.02 -0.32 0.02 0.00 1.00 0.00 0.00 62.75 63.43 2cv4 n ILE 180 Cb 0.46 -1.89 0.02 0.00 -0.71 0.00 0.00 39.64 37.51 2cv4 n ILE 180 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 2cv4 n ILE 181 N -3.99 0.15 0.00 1.39 -5.35 -1.25 -5.08 119.36 105.23 2cv4 n ILE 181 Ca -0.33 -0.58 0.00 0.00 -0.27 0.00 0.00 62.75 61.57 2cv4 n ILE 181 Cb 0.86 0.99 0.00 0.00 -1.74 0.00 0.00 39.64 39.74 2cv4 n ILE 181 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2cv4 n GLY 182 N 0.14 1.98 1.10 3.28 0.00 -0.48 -1.80 105.19 109.41 2cv4 n GLY 182 Ca 0.02 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.09 2cv4 n GLY 182 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2cv4 n GLU 183 N 3.68 2.48 -1.27 1.61 0.28 -1.19 -0.85 120.64 125.38 2cv4 n GLU 183 Ca 0.00 -2.28 -0.34 0.00 -0.16 0.00 0.00 57.16 54.38 2cv4 n GLU 183 Cb 0.00 -1.48 0.11 0.00 1.43 0.00 0.00 31.44 31.50 2cv4 n GLU 183 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2cv4 s GLY 184 N -1.28 2.32 0.01 -1.84 0.00 -0.74 -4.84 107.32 100.96 2cv4 s GLY 184 Ca 0.38 0.93 0.06 0.00 0.00 0.00 0.00 44.72 46.08 2cv4 s GLY 184 CO 0.29 1.35 -0.16 1.08 0.00 0.00 0.00 173.10 175.66 2cv4 s LEU 185 N -5.39 2.68 0.02 0.66 1.43 0.79 -4.60 118.68 114.28 2cv4 s LEU 185 Ca 0.75 -0.34 -0.21 0.00 -1.03 0.00 0.00 54.13 53.30 2cv4 s LEU 185 Cb -0.31 -1.56 -0.06 0.00 0.03 0.00 0.00 46.19 44.30 2cv4 s LEU 185 CO 0.48 0.28 0.61 -0.63 0.23 0.00 0.00 176.35 177.32 2cv4 s ILE 186 N -0.88 4.85 0.10 -0.59 1.01 -0.01 -2.03 121.20 123.65 2cv4 s ILE 186 Ca 0.14 1.29 -0.30 0.00 0.00 0.00 0.00 60.65 61.78 2cv4 s ILE 186 Cb -0.11 -3.95 -0.06 0.00 0.01 0.00 0.00 42.46 38.36 2cv4 s ILE 186 CO 0.04 0.44 0.97 -0.69 0.00 0.00 0.00 174.94 175.71 2cv4 s VAL 187 N -0.36 4.51 0.27 2.92 1.01 -0.01 -0.73 120.40 128.02 2cv4 s VAL 187 Ca 0.31 2.04 -0.31 0.00 0.00 0.00 0.00 61.98 64.03 2cv4 s VAL 187 Cb -0.19 -4.30 -0.12 0.00 0.00 0.00 0.00 36.38 31.77 2cv4 s VAL 187 CO 0.18 0.29 1.57 -2.65 0.00 0.00 0.00 175.10 174.49 2cv4 n PRO 188 N 2.92 2.56 -1.63 2.72 -0.02 -1.26 -4.60 135.00 135.69 2cv4 n PRO 188 Ca 0.03 0.91 -0.39 0.00 -2.02 0.00 0.00 63.50 62.03 2cv4 n PRO 188 Cb 0.49 -2.67 0.04 0.00 -0.02 0.00 0.00 33.50 31.34 2cv4 n PRO 188 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2cv4 n PRO 189 N 2.32 1.11 -2.26 0.52 -0.02 -1.26 -4.97 135.00 130.45 2cv4 n PRO 189 Ca 0.10 0.42 -0.39 0.00 -2.02 0.00 0.00 63.50 61.61 2cv4 n PRO 189 Cb 0.35 -2.20 -0.02 0.00 -0.02 0.00 0.00 33.50 31.61 2cv4 n PRO 189 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2cv4 s PRO 190 N -2.61 4.13 -0.00 0.52 0.02 -1.26 -4.95 135.00 130.84 2cv4 s PRO 190 Ca 0.72 1.92 0.08 0.00 0.02 0.00 0.00 61.00 63.75 2cv4 s PRO 190 Cb -0.44 -2.78 0.24 0.00 0.02 0.00 0.00 34.50 31.54 2cv4 s PRO 190 CO 0.50 -0.27 1.20 0.25 -0.33 0.00 0.00 177.00 178.34 2cv4 n THR 191 N 0.27 1.01 -3.88 0.99 -2.24 -1.26 -4.87 114.28 104.30 2cv4 n THR 191 Ca 0.03 -1.01 -0.11 0.00 -2.27 0.00 0.00 64.05 60.69 2cv4 n THR 191 Cb 0.45 0.49 -0.11 0.00 -2.10 0.00 0.00 70.33 69.06 2cv4 n THR 191 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2cv4 s THR 192 N -1.02 0.06 0.22 4.28 -4.23 -1.26 -5.05 115.64 108.63 2cv4 s THR 192 Ca 0.19 -0.46 -0.15 0.00 -1.18 0.00 0.00 61.69 60.08 2cv4 s THR 192 Cb 0.10 -0.29 0.25 0.00 1.34 0.00 0.00 72.50 73.90 2cv4 s THR 192 CO 0.12 -0.26 1.58 -0.33 -0.54 0.00 0.00 174.62 175.20 2cv4 h GLU 193 N 5.03 -0.05 -0.55 3.99 5.08 -1.99 0.15 114.58 126.24 2cv4 h GLU 193 Ca -0.29 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.10 2cv4 h GLU 193 Cb 1.20 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.43 2cv4 h GLU 193 CO 0.42 -0.03 0.34 -0.44 -1.00 0.00 0.00 179.01 178.29 2cv4 h ASP 194 N -0.05 0.56 -0.73 1.42 3.32 -1.99 -0.97 116.42 117.98 2cv4 h ASP 194 Ca 0.33 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.35 2cv4 h ASP 194 Cb 0.58 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.98 2cv4 h ASP 194 CO -0.82 0.39 0.33 1.56 -1.72 0.00 0.00 179.24 178.99 2cv4 h GLN 195 N 0.68 1.08 0.00 3.56 4.20 -1.49 -0.09 115.11 123.04 2cv4 h GLN 195 Ca 0.22 -0.17 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 2cv4 h GLN 195 Cb -0.00 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 2cv4 h GLN 195 CO -0.08 0.85 -0.25 0.00 -0.67 0.00 0.00 178.83 178.67 2cv4 h ALA 196 N 1.30 1.53 0.12 3.87 0.00 -0.02 -1.33 119.26 124.72 2cv4 h ALA 196 Ca 0.25 -0.23 -0.25 0.00 0.00 0.00 0.00 54.91 54.69 2cv4 h ALA 196 Cb 0.15 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 17.92 2cv4 h ALA 196 CO -0.03 0.32 -1.04 0.00 0.00 0.00 0.00 179.25 178.50 2cv4 h ARG 197 N 0.00 0.49 -0.63 0.00 3.08 -0.37 -3.24 114.38 113.71 2cv4 h ARG 197 Ca -0.00 -0.69 -0.02 0.00 0.07 0.00 0.00 59.98 59.34 2cv4 h ARG 197 Cb 0.46 0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.72 2cv4 h ARG 197 CO 0.03 1.30 0.33 0.00 -1.07 0.00 0.00 179.97 180.56 2cv4 h ALA 198 N 0.22 1.40 0.00 0.04 0.00 -0.83 -2.04 119.26 118.04 2cv4 h ALA 198 Ca -0.16 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2cv4 h ALA 198 Cb 1.76 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2cv4 h ALA 198 CO 0.20 0.49 0.00 -2.13 0.00 0.00 0.00 179.25 177.81 2cv4 n ARG 199 N -4.37 0.76 -1.17 0.00 0.63 -0.52 -4.18 116.66 107.81 2cv4 n ARG 199 Ca 0.06 0.00 -0.26 0.00 -0.92 0.00 0.00 57.85 56.73 2cv4 n ARG 199 Cb 0.11 -1.12 -0.14 0.00 0.45 0.00 0.00 32.46 31.76 2cv4 n ARG 199 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 2cv4 n GLU 201 N 1.50 0.00 0.03 -0.14 4.07 -0.77 -4.52 120.64 120.82 2cv4 n GLU 201 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2cv4 n GLU 201 Cb 0.38 -1.02 0.00 0.00 -0.06 0.00 0.00 31.44 30.74 2cv4 n GLU 201 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2cv4 n SER 202 N 6.68 -0.60 0.00 4.31 7.64 -1.26 -5.01 113.62 125.38 2cv4 n SER 202 Ca 0.52 0.24 0.00 0.00 1.01 0.00 0.00 58.87 60.64 2cv4 n SER 202 Cb 0.06 0.79 0.00 0.00 -1.01 0.00 0.00 64.21 64.04 2cv4 n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cv4 n GLY 203 N -1.39 0.89 0.23 0.23 0.00 -1.26 -4.96 105.19 98.93 2cv4 n GLY 203 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2cv4 n GLY 203 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2cv4 h GLN 204 N 0.00 0.55 -1.11 1.61 1.08 -1.95 -3.47 115.11 111.82 2cv4 h GLN 204 Ca 0.00 -0.27 0.19 0.00 -1.45 0.00 0.00 58.65 57.12 2cv4 h GLN 204 Cb 0.00 0.00 -0.33 0.00 -0.05 0.00 0.00 27.48 27.11 2cv4 h GLN 204 CO 0.00 0.85 0.80 0.71 -0.95 0.00 0.00 178.83 180.24 2cv4 s TYR 205 N -4.27 -0.10 -0.01 2.96 1.51 -1.26 -5.05 117.35 111.13 2cv4 s TYR 205 Ca -0.07 0.23 -0.02 0.00 -1.01 0.00 0.00 57.07 56.20 2cv4 s TYR 205 Cb 0.12 0.32 -0.01 0.00 -0.11 0.00 0.00 41.96 42.29 2cv4 s TYR 205 CO 0.82 -0.05 0.05 0.54 -1.11 0.00 0.00 175.55 175.80 2cv4 n ARG 206 N 2.20 0.00 -3.89 -0.62 5.12 -1.22 -4.38 116.66 113.87 2cv4 n ARG 206 Ca -0.13 0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 55.68 2cv4 n ARG 206 Cb 0.57 -0.06 -0.13 0.00 -1.16 0.00 0.00 32.46 31.68 2cv4 n ARG 206 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2cv4 n LEU 208 N 2.76 0.38 -3.77 0.00 4.77 0.52 -4.99 117.00 116.68 2cv4 n LEU 208 Ca -0.15 0.16 -0.03 0.00 -0.03 0.00 0.00 56.01 55.97 2cv4 n LEU 208 Cb 0.59 0.07 -0.00 0.00 -2.33 0.00 0.00 43.42 41.75 2cv4 n LEU 208 CO 0.24 0.05 0.80 -0.62 -1.33 0.00 0.00 177.39 176.54 2cv4 s ASP 209 N -5.12 -0.11 0.61 -1.43 -1.08 -1.23 -4.99 116.67 103.32 2cv4 s ASP 209 Ca -0.05 -0.43 0.39 0.00 -0.52 0.00 0.00 52.55 51.94 2cv4 s ASP 209 Cb 0.11 0.44 1.91 0.00 -1.46 0.00 0.00 42.92 43.92 2cv4 s ASP 209 CO 0.85 -0.83 2.19 4.11 0.52 0.00 0.00 175.17 182.01 2cv4 h TRP 210 N 2.00 0.00 -0.70 -5.34 5.08 -1.94 -1.37 115.95 113.67 2cv4 h TRP 210 Ca -0.26 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.71 2cv4 h TRP 210 Cb 1.22 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.38 2cv4 h TRP 210 CO 0.61 0.00 0.00 -2.67 -1.28 0.00 0.00 178.44 175.10 2cv4 n TRP 211 N -3.09 0.93 -3.34 0.12 4.27 -1.26 -4.47 117.44 110.61 2cv4 n TRP 211 Ca -0.01 -0.47 -0.24 0.00 -3.89 0.00 0.00 57.50 52.89 2cv4 n TRP 211 Cb 0.19 0.00 -0.09 0.00 -1.36 0.00 0.00 31.31 30.05 2cv4 n TRP 211 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 2cv4 s PHE 212 N -1.07 0.58 0.07 -2.67 2.19 -0.52 -4.65 117.98 111.92 2cv4 s PHE 212 Ca 0.48 -1.84 0.08 0.00 0.33 0.00 0.00 56.93 55.99 2cv4 s PHE 212 Cb 0.25 -0.73 -0.03 0.00 -1.31 0.00 0.00 43.02 41.21 2cv4 s PHE 212 CO 0.34 -0.89 -0.22 0.00 1.83 0.00 0.00 175.22 176.28 2cv4 s TRP 214 N -0.96 0.34 0.37 0.00 1.48 -0.11 -0.83 118.94 119.23 2cv4 s TRP 214 Ca 0.08 -0.69 -0.04 0.00 -1.06 0.00 0.00 56.10 54.39 2cv4 s TRP 214 Cb -0.09 0.13 0.01 0.00 -1.16 0.00 0.00 33.47 32.36 2cv4 s TRP 214 CO 0.03 -0.91 0.54 0.16 -4.06 0.00 0.00 176.95 172.71 2cv4 s ASP 215 N -2.99 0.90 -0.70 -2.66 -4.77 -0.86 -3.45 116.67 102.14 2cv4 s ASP 215 Ca 0.20 -1.49 0.05 0.00 -3.30 0.00 0.00 52.55 48.00 2cv4 s ASP 215 Cb 0.00 0.71 0.24 0.00 -1.09 0.00 0.00 42.92 42.79 2cv4 s ASP 215 CO 0.06 -1.39 0.77 0.35 0.70 0.00 0.00 175.17 175.65 2cv4 n THR 216 N -0.59 2.52 0.60 2.11 -2.24 -1.26 -0.15 114.28 115.27 2cv4 n THR 216 Ca -0.00 -5.22 0.13 0.00 -2.27 0.00 0.00 64.05 56.69 2cv4 n THR 216 Cb 0.61 -2.13 0.34 0.00 -2.10 0.00 0.00 70.33 67.05 2cv4 n THR 216 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2cv4 h PRO 217 N 4.58 0.00 -6.87 -0.78 0.13 -1.91 -3.47 132.00 123.68 2cv4 h PRO 217 Ca 0.19 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.80 2cv4 h PRO 217 Cb 0.68 0.00 0.06 0.00 0.13 0.00 0.00 31.00 31.87 2cv4 h PRO 217 CO 0.86 0.00 0.61 0.00 -0.23 0.00 0.00 178.00 179.24 2cv4 s ALA 218 N -3.12 3.46 0.64 -0.56 0.00 -1.26 -4.99 121.76 115.93 2cv4 s ALA 218 Ca 0.09 1.19 -0.16 0.00 0.00 0.00 0.00 51.96 53.09 2cv4 s ALA 218 Cb 0.12 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 2cv4 s ALA 218 CO 0.63 -0.57 1.11 -1.54 0.00 0.00 0.00 175.76 175.39 2cv4 s SER 219 N -0.58 5.24 0.49 0.00 1.04 -1.26 -4.87 113.70 113.77 2cv4 s SER 219 Ca 0.49 2.01 0.20 0.00 0.48 0.00 0.00 55.95 59.13 2cv4 s SER 219 Cb -0.38 -2.55 1.24 0.00 0.10 0.00 0.00 66.02 64.42 2cv4 s SER 219 CO 0.50 -1.54 2.01 -0.09 0.98 0.00 0.00 173.24 175.10 2cv4 h ARG 220 N 0.23 0.15 -0.02 4.02 2.43 -1.98 -1.19 114.38 118.02 2cv4 h ARG 220 Ca -0.47 -0.01 -0.18 0.00 -0.81 0.00 0.00 59.98 58.51 2cv4 h ARG 220 Cb 1.25 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 2cv4 h ARG 220 CO 0.55 0.10 -0.78 -0.44 -1.51 0.00 0.00 179.97 177.89 2cv4 h ASP 221 N 0.16 0.25 -0.36 -3.80 3.32 -1.98 -1.97 116.42 112.03 2cv4 h ASP 221 Ca 0.23 -0.18 -0.13 0.00 0.02 0.00 0.00 57.03 56.97 2cv4 h ASP 221 Cb 0.70 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 2cv4 h ASP 221 CO -0.03 0.93 -0.27 0.44 -1.72 0.00 0.00 179.24 178.59 2cv4 h ASP 222 N 0.13 0.87 -0.35 6.45 3.32 -1.59 -1.97 116.42 123.27 2cv4 h ASP 222 Ca -0.03 -0.44 -0.03 0.00 0.02 0.00 0.00 57.03 56.55 2cv4 h ASP 222 Cb 1.36 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.66 2cv4 h ASP 222 CO 0.12 1.12 0.08 0.58 -1.72 0.00 0.00 179.24 179.42 2cv4 h VAL 223 N 0.62 1.22 -0.75 -1.35 2.07 -1.45 -2.03 116.25 114.58 2cv4 h VAL 223 Ca 0.07 -0.76 0.01 0.00 0.82 0.00 0.00 66.70 66.84 2cv4 h VAL 223 Cb 0.84 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 2cv4 h VAL 223 CO 0.07 0.26 0.50 -0.08 0.02 0.00 0.00 177.57 178.34 2cv4 h GLU 224 N 0.42 0.97 -0.27 1.57 4.22 -1.36 0.11 114.58 120.23 2cv4 h GLU 224 Ca 0.11 -0.06 -0.16 0.00 0.08 0.00 0.00 59.36 59.33 2cv4 h GLU 224 Cb 0.31 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 2cv4 h GLU 224 CO 0.00 0.64 -0.49 1.49 -2.18 0.00 0.00 179.01 178.48 2cv4 h GLU 225 N 1.00 0.75 -0.42 1.92 4.81 -0.95 -0.99 114.58 120.70 2cv4 h GLU 225 Ca 0.28 -0.44 -0.10 0.00 -0.13 0.00 0.00 59.36 58.97 2cv4 h GLU 225 Cb -0.10 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 2cv4 h GLU 225 CO -0.06 1.06 -0.16 0.00 -0.73 0.00 0.00 179.01 179.12 2cv4 h ALA 226 N 0.86 0.93 -0.15 2.92 0.00 -0.83 -2.83 119.26 120.16 2cv4 h ALA 226 Ca 0.03 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.47 2cv4 h ALA 226 Cb 1.06 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2cv4 h ALA 226 CO 0.10 0.62 -0.46 -0.09 0.00 0.00 0.00 179.25 179.43 2cv4 h ARG 227 N 0.70 0.36 0.00 0.00 2.43 -0.64 -2.94 114.38 114.30 2cv4 h ARG 227 Ca 0.11 -0.19 -0.11 0.00 -0.81 0.00 0.00 59.98 58.97 2cv4 h ARG 227 Cb 0.66 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.20 2cv4 h ARG 227 CO 0.05 0.75 -0.54 0.07 -1.51 0.00 0.00 179.97 178.78 2cv4 h ARG 228 N 0.30 0.00 -0.39 0.20 0.11 -0.94 -1.75 114.38 111.90 2cv4 h ARG 228 Ca 0.02 0.00 0.03 0.00 0.10 0.00 0.00 59.98 60.12 2cv4 h ARG 228 Cb 0.92 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.97 2cv4 h ARG 228 CO 0.08 0.54 0.21 1.88 0.10 0.00 0.00 179.97 182.78 2cv4 h TYR 229 N 0.00 0.39 -0.44 4.08 0.05 -1.35 0.65 116.97 120.35 2cv4 h TYR 229 Ca -0.01 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.76 2cv4 h TYR 229 Cb 1.05 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 38.65 2cv4 h TYR 229 CO 0.00 0.21 0.16 -0.07 -1.05 0.00 0.00 178.16 177.42 2cv4 h LEU 230 N 0.42 0.62 -1.23 3.88 4.07 -1.52 -1.56 115.31 119.99 2cv4 h LEU 230 Ca 0.16 -0.18 -0.00 0.00 0.08 0.00 0.00 57.88 57.94 2cv4 h LEU 230 Cb 0.05 -0.16 -0.03 0.00 1.08 0.00 0.00 40.66 41.60 2cv4 h LEU 230 CO -0.10 0.63 0.42 0.03 -1.08 0.00 0.00 178.44 178.34 2cv4 h ARG 231 N 0.57 0.95 -0.32 1.13 3.08 -0.81 -1.00 114.38 117.98 2cv4 h ARG 231 Ca 0.15 -0.08 -0.12 0.00 0.07 0.00 0.00 59.98 60.00 2cv4 h ARG 231 Cb 0.21 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2cv4 h ARG 231 CO -0.01 0.67 -0.27 -0.09 -1.07 0.00 0.00 179.97 179.19 2cv4 h ARG 232 N 0.97 0.66 -0.10 0.04 2.43 -0.41 -1.11 114.38 116.86 2cv4 h ARG 232 Ca 0.25 -0.28 -0.08 0.00 -0.81 0.00 0.00 59.98 59.06 2cv4 h ARG 232 Cb -0.04 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 2cv4 h ARG 232 CO -0.05 0.86 -0.32 0.00 -1.51 0.00 0.00 179.97 178.95 2cv4 h ALA 233 N 1.13 1.28 0.00 2.80 0.00 -0.55 -3.11 119.26 120.81 2cv4 h ALA 233 Ca 0.07 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2cv4 h ALA 233 Cb 0.76 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 2cv4 h ALA 233 CO 0.06 0.50 -0.39 0.00 0.00 0.00 0.00 179.25 179.42 2cv4 h ALA 234 N 1.50 0.81 -2.32 0.00 0.00 -0.70 -3.47 119.26 115.08 2cv4 h ALA 234 Ca 0.02 -0.03 -0.46 0.00 0.00 0.00 0.00 54.91 54.44 2cv4 h ALA 234 Cb 0.66 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2cv4 h ALA 234 CO 0.05 0.04 0.36 -2.00 0.00 0.00 0.00 179.25 177.70 2cv4 s GLU 235 N -3.25 4.33 0.11 0.00 2.12 -0.47 -5.01 118.70 116.53 2cv4 s GLU 235 Ca 0.04 1.30 -0.30 0.00 0.36 0.00 0.00 54.97 56.37 2cv4 s GLU 235 Cb 0.07 -2.49 -0.06 0.00 0.26 0.00 0.00 34.13 31.91 2cv4 s GLU 235 CO 0.72 0.04 0.99 0.21 -0.54 0.00 0.00 175.26 176.68 2cv4 s LYS 236 N -2.61 4.66 0.28 4.30 2.20 -1.26 -4.98 119.74 122.33 2cv4 s LYS 236 Ca 0.57 1.50 -0.29 0.00 -0.36 0.00 0.00 55.97 57.38 2cv4 s LYS 236 Cb -0.16 -3.37 -0.10 0.00 -1.51 0.00 0.00 37.83 32.70 2cv4 s LYS 236 CO 0.21 0.15 1.26 -1.25 -0.36 0.00 0.00 175.35 175.35 2cv4 s PRO 237 N 0.08 4.44 -0.22 4.03 0.04 -1.26 -4.89 135.00 137.22 2cv4 s PRO 237 Ca 0.48 2.06 0.13 0.00 0.04 0.00 0.00 61.00 63.71 2cv4 s PRO 237 Cb -0.24 -3.14 0.76 0.00 0.04 0.00 0.00 34.50 31.92 2cv4 s PRO 237 CO 0.30 -0.11 1.66 0.00 0.04 0.00 0.00 177.00 178.89 2cv4 n ALA 238 N 1.45 3.81 -1.04 8.56 0.00 -1.26 -4.82 120.51 127.21 2cv4 n ALA 238 Ca 0.02 -1.78 0.00 0.00 0.00 0.00 0.00 53.44 51.67 2cv4 n ALA 238 Cb 0.43 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.75 2cv4 n ALA 238 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2cv4 n LYS 239 N 0.56 0.00 0.00 0.00 4.81 -1.26 -5.20 118.16 117.07 2cv4 n LYS 239 Ca 0.26 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 2cv4 n LYS 239 Cb 1.14 0.00 0.00 0.00 0.02 0.00 0.00 35.03 36.19 2cv4 n LYS 239 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2cv4 n LEU 240 N -0.89 0.00 0.00 3.14 4.77 -1.26 -5.32 117.00 117.44 2cv4 n LEU 240 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2cv4 n LEU 240 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2cv4 n LEU 240 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.39 175.95