#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 -0.54 0.98 0.55 0.00 -1.26 -5.08 107.32 101.97 2cv4 s GLY 3 Ca 0.00 0.85 -0.11 0.00 0.00 0.00 0.00 44.72 45.45 2cv4 s GLY 3 CO 0.00 0.35 1.09 -1.35 0.00 0.00 0.00 173.10 173.19 2cv4 s SER 4 N -2.41 2.54 -0.29 1.64 1.04 -1.26 -5.05 113.70 109.91 2cv4 s SER 4 Ca 0.01 1.75 -0.28 0.00 0.48 0.00 0.00 55.95 57.91 2cv4 s SER 4 Cb -0.01 -2.36 0.19 0.00 0.10 0.00 0.00 66.02 63.94 2cv4 s SER 4 CO -0.08 -3.27 1.37 -0.63 0.98 0.00 0.00 173.24 171.61 2cv4 s ILE 5 N -2.69 0.00 0.87 -1.02 1.09 -1.26 -4.44 121.20 113.75 2cv4 s ILE 5 Ca 0.66 0.00 -0.11 0.00 -1.10 0.00 0.00 60.65 60.10 2cv4 s ILE 5 Cb -0.22 -1.00 0.11 0.00 -1.06 0.00 0.00 42.46 40.30 2cv4 s ILE 5 CO 0.60 0.00 1.09 -2.84 -0.10 0.00 0.00 174.94 173.69 2cv4 s PRO 6 N -0.62 1.49 0.15 2.79 0.02 -1.26 -5.02 135.00 132.55 2cv4 s PRO 6 Ca 0.08 0.82 0.08 0.00 0.02 0.00 0.00 61.00 62.00 2cv4 s PRO 6 Cb -0.02 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.62 2cv4 s PRO 6 CO -0.10 -2.08 -0.18 -0.51 -0.33 0.00 0.00 177.00 173.80 2cv4 s LEU 7 N -6.12 2.41 0.29 -5.54 1.43 -1.26 -5.09 118.68 104.81 2cv4 s LEU 7 Ca 0.63 -0.83 -0.30 0.00 -1.03 0.00 0.00 54.13 52.60 2cv4 s LEU 7 Cb -0.17 -0.77 -0.11 0.00 0.03 0.00 0.00 46.19 45.16 2cv4 s LEU 7 CO 0.56 -0.05 1.60 -0.63 0.23 0.00 0.00 176.35 178.06 2cv4 s ILE 8 N -1.97 2.08 0.00 -0.59 1.01 -1.26 -1.68 121.20 118.80 2cv4 s ILE 8 Ca 0.13 0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.85 2cv4 s ILE 8 Cb -0.06 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.37 2cv4 s ILE 8 CO 0.05 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.62 2cv4 n GLY 9 N 2.26 3.28 3.86 6.18 0.00 0.14 -5.01 105.19 115.90 2cv4 n GLY 9 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.58 3.47 0.33 1.61 2.02 -0.68 -4.74 118.70 120.15 2cv4 s GLU 10 Ca 0.00 0.79 -0.27 0.00 0.02 0.00 0.00 54.97 55.52 2cv4 s GLU 10 Cb 0.00 -2.06 -0.09 0.00 0.10 0.00 0.00 34.13 32.07 2cv4 s GLU 10 CO 0.00 -0.67 1.03 0.50 0.02 0.00 0.00 175.26 176.14 2cv4 s ARG 11 N -5.13 4.45 0.25 1.61 3.52 -1.26 -1.59 118.95 120.80 2cv4 s ARG 11 Ca 0.56 1.55 -0.30 0.00 -0.13 0.00 0.00 55.73 57.40 2cv4 s ARG 11 Cb -0.12 -2.85 -0.11 0.00 -1.56 0.00 0.00 34.95 30.32 2cv4 s ARG 11 CO 0.54 0.11 1.53 0.12 -0.81 0.00 0.00 175.30 176.79 2cv4 s PHE 12 N -1.47 2.92 0.23 5.12 2.19 0.22 -4.85 117.98 122.35 2cv4 s PHE 12 Ca 0.51 0.84 -0.31 0.00 0.33 0.00 0.00 56.93 58.30 2cv4 s PHE 12 Cb -0.24 -3.95 -0.14 0.00 -1.31 0.00 0.00 43.02 37.38 2cv4 s PHE 12 CO 0.31 -3.22 1.25 -2.30 1.83 0.00 0.00 175.22 173.09 2cv4 n PRO 13 N 2.62 1.64 -2.22 10.12 -0.02 -1.26 -4.55 135.00 141.33 2cv4 n PRO 13 Ca 0.09 0.58 -0.34 0.00 -2.02 0.00 0.00 63.50 61.81 2cv4 n PRO 13 Cb 0.39 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 2cv4 n PRO 13 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2cv4 s GLU 14 N -0.72 3.36 -0.05 -0.52 2.12 -1.26 -4.40 118.70 117.23 2cv4 s GLU 14 Ca 0.67 1.47 0.06 0.00 0.36 0.00 0.00 54.97 57.53 2cv4 s GLU 14 Cb -0.72 -2.02 -0.02 0.00 0.26 0.00 0.00 34.13 31.64 2cv4 s GLU 14 CO 0.53 -0.81 -0.23 -1.21 -0.54 0.00 0.00 175.26 173.00 2cv4 s GLU 16 N -3.49 2.51 0.11 4.30 2.02 -1.26 -5.00 118.70 117.87 2cv4 s GLU 16 Ca 0.69 -0.87 0.06 0.00 0.02 0.00 0.00 54.97 54.88 2cv4 s GLU 16 Cb -0.21 -2.20 -0.04 0.00 0.10 0.00 0.00 34.13 31.79 2cv4 s GLU 16 CO 0.29 0.44 -0.14 0.14 0.02 0.00 0.00 175.26 176.01 2cv4 s VAL 17 N -0.31 1.28 -0.23 2.63 -7.23 0.07 -4.98 120.40 111.63 2cv4 s VAL 17 Ca 0.01 -1.61 -0.14 0.00 -1.81 0.00 0.00 61.98 58.44 2cv4 s VAL 17 Cb -0.13 -1.42 -0.04 0.00 0.56 0.00 0.00 36.38 35.35 2cv4 s VAL 17 CO 0.02 -0.36 0.30 -0.89 -0.31 0.00 0.00 175.10 173.86 2cv4 s THR 18 N -1.90 5.25 0.39 5.32 2.01 -1.26 -1.46 115.64 123.99 2cv4 s THR 18 Ca 0.06 0.47 0.08 0.00 0.31 0.00 0.00 61.69 62.61 2cv4 s THR 18 Cb -0.06 -3.63 -0.07 0.00 0.01 0.00 0.00 72.50 68.74 2cv4 s THR 18 CO 0.03 0.26 -0.02 0.42 -0.69 0.00 0.00 174.62 174.61 2cv4 s THR 19 N 1.43 2.09 -1.76 -0.82 -4.23 0.60 -0.33 115.64 112.61 2cv4 s THR 19 Ca 0.13 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 2cv4 s THR 19 Cb -0.15 -2.88 0.00 0.00 1.34 0.00 0.00 72.50 70.81 2cv4 s THR 19 CO 0.07 -0.07 0.57 -0.90 -0.54 0.00 0.00 174.62 173.76 2cv4 n ASP 20 N -0.91 0.16 0.00 3.99 5.68 -0.43 -0.91 116.55 124.13 2cv4 n ASP 20 Ca -0.05 -1.31 0.00 0.00 -0.50 0.00 0.00 54.79 52.93 2cv4 n ASP 20 Cb 0.66 -0.08 0.00 0.00 -1.14 0.00 0.00 41.12 40.56 2cv4 n ASP 20 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2cv4 n HIS 21 N -0.34 0.00 0.00 2.11 8.25 -1.26 -4.95 115.22 119.03 2cv4 n HIS 21 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2cv4 n HIS 21 Cb 0.04 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.15 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 0.60 0.89 3.78 -1.41 0.00 -0.09 -5.06 105.19 103.90 2cv4 n GLY 22 Ca 0.00 -2.06 -0.37 0.00 0.00 0.00 0.00 46.02 43.59 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 -1.14 4.27 0.02 1.61 1.01 -1.26 -0.29 120.40 124.62 2cv4 s VAL 23 Ca 0.00 1.75 -0.01 0.00 0.00 0.00 0.00 61.98 63.73 2cv4 s VAL 23 Cb 0.00 -4.03 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 2cv4 s VAL 23 CO 0.00 0.22 -0.02 -0.63 0.00 0.00 0.00 175.10 174.67 2cv4 s ILE 24 N -1.52 0.11 -0.13 2.22 1.01 -0.53 -4.93 121.20 117.42 2cv4 s ILE 24 Ca 0.47 -0.95 -0.02 0.00 0.00 0.00 0.00 60.65 60.16 2cv4 s ILE 24 Cb -0.19 -0.35 -0.02 0.00 0.01 0.00 0.00 42.46 41.90 2cv4 s ILE 24 CO 0.24 -0.52 -0.08 -0.75 0.00 0.00 0.00 174.94 173.84 2cv4 s LYS 25 N -1.60 3.46 0.04 2.79 2.20 -1.26 -0.75 119.74 124.61 2cv4 s LYS 25 Ca -0.15 -0.59 0.06 0.00 -0.36 0.00 0.00 55.97 54.94 2cv4 s LYS 25 Cb -0.09 -2.77 -0.03 0.00 -1.51 0.00 0.00 37.83 33.43 2cv4 s LYS 25 CO -0.01 0.28 -0.13 -0.51 -0.36 0.00 0.00 175.35 174.62 2cv4 s LEU 26 N 0.22 2.87 0.00 5.43 1.43 -1.26 -0.01 118.68 127.35 2cv4 s LEU 26 Ca -0.05 -0.32 0.26 0.00 -1.03 0.00 0.00 54.13 52.99 2cv4 s LEU 26 Cb -0.14 -1.67 0.76 0.00 0.03 0.00 0.00 46.19 45.16 2cv4 s LEU 26 CO 0.04 0.25 1.57 -0.81 0.23 0.00 0.00 176.35 177.63 2cv4 n PRO 27 N 1.42 0.55 -0.27 1.29 -0.04 -1.26 -4.25 135.00 132.43 2cv4 n PRO 27 Ca -0.15 -0.30 0.11 0.00 -0.04 0.00 0.00 63.50 63.11 2cv4 n PRO 27 Cb 0.52 -1.49 0.21 0.00 -0.04 0.00 0.00 33.50 32.70 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 -0.97 -0.11 -0.10 3.54 9.92 -1.23 -0.13 116.55 127.48 2cv4 n ASP 28 Ca 0.10 1.32 0.16 0.00 -0.53 0.00 0.00 54.79 55.84 2cv4 n ASP 28 Cb 0.33 -0.47 0.55 0.00 -0.64 0.00 0.00 41.12 40.89 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 0.34 0.07 1.24 2.76 -0.77 -1.35 115.15 117.44 2cv4 h HIS 29 Ca 0.46 0.01 -0.36 0.00 -2.20 0.00 0.00 60.37 58.28 2cv4 h HIS 29 Cb 0.92 -0.11 -0.04 0.00 1.55 0.00 0.00 27.41 29.74 2cv4 h HIS 29 CO -0.42 0.14 -2.06 0.66 -1.30 0.00 0.00 177.93 174.95 2cv4 n TYR 30 N -4.45 0.83 -0.02 5.26 4.01 0.82 -4.14 117.16 119.47 2cv4 n TYR 30 Ca 0.12 0.21 -0.09 0.00 -0.16 0.00 0.00 57.90 57.98 2cv4 n TYR 30 Cb 0.50 -1.10 -0.03 0.00 -0.31 0.00 0.00 39.34 38.40 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 -0.17 0.71 0.00 -0.72 2.07 -1.15 -0.61 116.25 116.39 2cv4 h VAL 31 Ca -0.47 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.05 2cv4 h VAL 31 Cb 1.87 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 32.36 2cv4 h VAL 31 CO -0.03 0.00 0.04 -1.54 0.02 0.00 0.00 177.57 176.06 2cv4 n SER 32 N -5.24 0.49 -0.85 0.57 3.41 -0.53 0.48 113.62 111.95 2cv4 n SER 32 Ca -0.03 0.71 0.08 0.00 -0.26 0.00 0.00 58.87 59.37 2cv4 n SER 32 Cb 0.16 -0.76 0.19 0.00 -0.26 0.00 0.00 64.21 63.55 2cv4 n SER 32 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cv4 n GLN 33 N -2.17 2.64 -2.14 4.33 6.02 -0.42 -4.95 117.38 120.70 2cv4 n GLN 33 Ca -0.01 -2.16 -0.20 0.00 -0.01 0.00 0.00 57.00 54.62 2cv4 n GLN 33 Cb 0.07 -1.36 -0.03 0.00 1.02 0.00 0.00 30.24 29.94 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 0.88 0.24 3.77 1.08 0.00 0.18 -4.99 105.19 106.36 2cv4 n GLY 34 Ca 0.15 -0.07 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 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 -4.59 2.81 0.41 1.61 1.02 -0.37 -4.85 119.74 115.76 2cv4 s LYS 35 Ca 0.00 -0.92 -0.01 0.00 0.02 0.00 0.00 55.97 55.06 2cv4 s LYS 35 Cb 0.00 -2.59 -0.03 0.00 -0.52 0.00 0.00 37.83 34.69 2cv4 s LYS 35 CO 0.00 0.48 0.64 -1.58 -0.92 0.00 0.00 175.35 173.97 2cv4 s TRP 36 N -1.76 3.47 -0.03 3.18 0.52 -0.75 -4.04 118.94 119.53 2cv4 s TRP 36 Ca 0.30 0.47 -0.06 0.00 0.02 0.00 0.00 56.10 56.84 2cv4 s TRP 36 Cb -0.10 -2.09 0.01 0.00 -1.15 0.00 0.00 33.47 30.14 2cv4 s TRP 36 CO 0.22 -0.08 0.13 -0.59 0.02 0.00 0.00 176.95 176.65 2cv4 s PHE 37 N -2.49 -0.06 -0.25 -1.98 -0.71 -0.35 0.21 117.98 112.35 2cv4 s PHE 37 Ca 0.44 0.14 -0.07 0.00 -1.04 0.00 0.00 56.93 56.40 2cv4 s PHE 37 Cb -0.10 0.00 -0.02 0.00 -1.21 0.00 0.00 43.02 41.69 2cv4 s PHE 37 CO 0.39 -0.16 0.06 0.08 -1.34 0.00 0.00 175.22 174.25 2cv4 s VAL 38 N -0.55 4.18 -0.26 -2.49 1.01 0.38 -0.94 120.40 121.73 2cv4 s VAL 38 Ca -0.06 -0.26 -0.07 0.00 0.00 0.00 0.00 61.98 61.59 2cv4 s VAL 38 Cb -0.04 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 2cv4 s VAL 38 CO 0.01 0.32 0.05 -0.22 0.00 0.00 0.00 175.10 175.26 2cv4 s LEU 39 N 1.59 3.45 -0.07 3.92 0.20 -0.54 -1.64 118.68 125.58 2cv4 s LEU 39 Ca 0.06 -0.38 0.05 0.00 0.69 0.00 0.00 54.13 54.54 2cv4 s LEU 39 Cb -0.15 -1.88 -0.01 0.00 -0.43 0.00 0.00 46.19 43.72 2cv4 s LEU 39 CO 0.03 -0.08 -0.22 0.72 -0.29 0.00 0.00 176.35 176.51 2cv4 s PHE 40 N 1.56 2.54 0.09 5.38 -0.12 -0.46 -1.21 117.98 125.76 2cv4 s PHE 40 Ca 0.05 -0.71 0.03 0.00 -0.05 0.00 0.00 56.93 56.25 2cv4 s PHE 40 Cb -0.15 -1.66 -0.04 0.00 -0.63 0.00 0.00 43.02 40.54 2cv4 s PHE 40 CO 0.02 -0.21 0.12 -1.54 -0.05 0.00 0.00 175.22 173.56 2cv4 s SER 41 N -0.07 5.73 0.06 1.98 1.04 -0.38 -0.54 113.70 121.52 2cv4 s SER 41 Ca -0.06 0.04 0.03 0.00 0.48 0.00 0.00 55.95 56.45 2cv4 s SER 41 Cb -0.14 -1.59 -0.03 0.00 0.10 0.00 0.00 66.02 64.36 2cv4 s SER 41 CO 0.05 0.16 -0.09 -1.00 0.98 0.00 0.00 173.24 173.33 2cv4 s HIS 42 N -1.46 0.82 0.03 5.02 3.76 0.12 -3.75 115.29 119.83 2cv4 s HIS 42 Ca 0.31 -0.54 -0.19 0.00 -0.15 0.00 0.00 55.06 54.49 2cv4 s HIS 42 Cb -0.12 -0.48 -0.21 0.00 1.11 0.00 0.00 32.58 32.88 2cv4 s HIS 42 CO 0.24 -0.06 1.17 -1.00 -0.85 0.00 0.00 174.74 174.24 2cv4 h PRO 43 N 4.24 0.47 -2.75 8.40 0.13 -1.77 -3.37 132.00 137.35 2cv4 h PRO 43 Ca -0.37 -0.44 -0.11 0.00 -0.87 0.00 0.00 66.00 64.22 2cv4 h PRO 43 Cb 1.20 0.11 -0.21 0.00 0.13 0.00 0.00 31.00 32.23 2cv4 h PRO 43 CO 0.44 1.08 -0.17 0.00 -0.23 0.00 0.00 178.00 179.12 2cv4 s ALA 44 N -3.45 -1.04 0.75 -0.56 0.00 -1.26 -4.19 121.76 112.00 2cv4 s ALA 44 Ca -0.13 0.74 -0.12 0.00 0.00 0.00 0.00 51.96 52.44 2cv4 s ALA 44 Cb 0.05 -0.14 0.05 0.00 0.00 0.00 0.00 23.12 23.08 2cv4 s ALA 44 CO 0.83 -0.27 1.12 -0.51 0.00 0.00 0.00 175.76 176.92 2cv4 s ASP 45 N -0.91 4.48 -1.31 0.00 1.01 -1.26 -3.82 116.67 114.85 2cv4 s ASP 45 Ca -0.10 1.98 -0.05 0.00 0.71 0.00 0.00 52.55 55.09 2cv4 s ASP 45 Cb -0.04 -2.54 0.01 0.00 1.01 0.00 0.00 42.92 41.36 2cv4 s ASP 45 CO 0.04 -2.06 1.04 0.49 0.21 0.00 0.00 175.17 174.90 2cv4 n PHE 46 N -3.17 -2.46 -4.72 4.23 3.01 -1.26 -5.02 117.46 108.06 2cv4 n PHE 46 Ca 0.10 0.96 -0.23 0.00 1.01 0.00 0.00 57.45 59.29 2cv4 n PHE 46 Cb 0.52 -4.89 -0.15 0.00 -0.01 0.00 0.00 39.48 34.95 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 -3.37 1.24 0.09 4.37 -4.23 -1.25 -5.09 115.64 107.39 2cv4 s THR 47 Ca 0.31 -0.69 -0.35 0.00 -1.18 0.00 0.00 61.69 59.79 2cv4 s THR 47 Cb -0.14 -1.03 -0.16 0.00 1.34 0.00 0.00 72.50 72.50 2cv4 s THR 47 CO 0.75 0.34 1.58 -0.65 -0.54 0.00 0.00 174.62 176.10 2cv4 h PRO 48 N 5.71 -0.92 -0.45 3.99 0.11 -1.95 -2.44 132.00 136.06 2cv4 h PRO 48 Ca -0.36 0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2cv4 h PRO 48 Cb 1.16 0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.48 2cv4 h PRO 48 CO 0.48 -0.61 0.00 0.28 -0.21 0.00 0.00 178.00 177.94 2cv4 n VAL 49 N -5.54 0.00 0.00 3.15 0.31 -1.26 -1.28 118.33 113.70 2cv4 n VAL 49 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2cv4 n VAL 49 Cb 0.44 -0.10 0.00 0.00 -0.91 0.00 0.00 33.84 33.27 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 0.51 0.00 0.16 2.52 -1.04 -0.92 -1.37 114.28 114.14 2cv4 n THR 51 Ca 0.00 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.05 2cv4 n THR 51 Cb 0.00 0.00 0.45 0.00 -1.82 0.00 0.00 70.33 68.96 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 1.14 -0.12 12.58 1.35 -1.47 -1.63 112.91 124.76 2cv4 h THR 52 Ca 0.00 -0.64 -0.04 0.00 -0.55 0.00 0.00 66.41 65.18 2cv4 h THR 52 Cb 0.00 1.21 -0.00 0.00 -1.73 0.00 0.00 68.15 67.63 2cv4 h THR 52 CO 0.00 0.20 -0.07 -0.33 -0.25 0.00 0.00 175.52 175.07 2cv4 h GLU 53 N 0.14 0.27 -0.89 4.72 5.08 -1.50 -0.61 114.58 121.79 2cv4 h GLU 53 Ca 0.03 -0.12 0.06 0.00 -1.00 0.00 0.00 59.36 58.33 2cv4 h GLU 53 Cb 0.31 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.49 2cv4 h GLU 53 CO 0.02 0.62 0.56 0.74 -1.00 0.00 0.00 179.01 179.94 2cv4 h PHE 54 N -0.09 1.03 -0.38 4.33 -1.00 -1.72 0.24 116.94 119.35 2cv4 h PHE 54 Ca 0.03 0.03 -0.06 0.00 2.81 0.00 0.00 57.97 60.78 2cv4 h PHE 54 Cb 0.54 -0.33 -0.01 0.00 3.61 0.00 0.00 35.95 39.76 2cv4 h PHE 54 CO 0.07 0.52 0.00 0.28 -1.61 0.00 0.00 178.31 177.58 2cv4 h VAL 55 N 1.01 1.26 -0.12 -0.55 2.07 -1.24 0.58 116.25 119.26 2cv4 h VAL 55 Ca 0.39 -0.99 0.03 0.00 0.82 0.00 0.00 66.70 66.95 2cv4 h VAL 55 Cb 0.17 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 2cv4 h VAL 55 CO -0.17 0.33 -0.09 -1.28 0.02 0.00 0.00 177.57 176.38 2cv4 h SER 56 N 0.49 -0.29 -0.90 0.57 0.87 0.15 0.05 113.55 114.49 2cv4 h SER 56 Ca 0.11 0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.72 2cv4 h SER 56 Cb 0.46 0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 62.53 2cv4 h SER 56 CO 0.02 -0.12 0.54 -0.26 -0.53 0.00 0.00 176.83 176.47 2cv4 h PHE 57 N -0.10 1.20 -0.31 2.24 0.04 -0.41 -2.69 116.94 116.91 2cv4 h PHE 57 Ca 0.08 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.86 2cv4 h PHE 57 Cb 0.21 -0.39 -0.02 0.00 2.20 0.00 0.00 35.95 37.95 2cv4 h PHE 57 CO -0.21 0.80 0.16 0.00 -0.60 0.00 0.00 178.31 178.46 2cv4 h ALA 58 N 1.34 0.37 -0.18 2.45 0.00 -0.03 -1.83 119.26 121.39 2cv4 h ALA 58 Ca 0.32 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 2cv4 h ALA 58 Cb -0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2cv4 h ALA 58 CO -0.06 -0.22 -0.02 0.00 0.00 0.00 0.00 179.25 178.96 2cv4 h ARG 59 N 0.33 0.26 -0.64 0.00 2.47 -0.75 -2.32 114.38 113.74 2cv4 h ARG 59 Ca 0.12 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 2cv4 h ARG 59 Cb 0.03 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.30 2cv4 h ARG 59 CO -0.08 0.31 0.00 0.54 0.56 0.00 0.00 179.97 181.30 2cv4 n ARG 60 N -4.37 3.73 -0.26 0.04 1.74 -0.79 -4.45 116.66 112.29 2cv4 n ARG 60 Ca -0.00 -2.50 -0.06 0.00 -0.77 0.00 0.00 57.85 54.52 2cv4 n ARG 60 Cb 0.19 -1.95 0.07 0.00 -1.02 0.00 0.00 32.46 29.75 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 3.39 1.18 -0.31 -1.55 5.03 -0.77 -2.22 116.97 121.73 2cv4 h TYR 61 Ca 0.00 -0.12 -0.00 0.00 2.58 0.00 0.00 58.73 61.19 2cv4 h TYR 61 Cb 1.47 -0.34 -0.01 0.00 1.55 0.00 0.00 36.73 39.40 2cv4 h TYR 61 CO 0.77 0.93 0.18 1.49 -1.32 0.00 0.00 178.16 180.21 2cv4 h GLU 62 N 1.10 0.43 -0.77 1.82 4.81 -1.82 -1.33 114.58 118.81 2cv4 h GLU 62 Ca 0.24 -0.05 0.10 0.00 -0.13 0.00 0.00 59.36 59.52 2cv4 h GLU 62 Cb 0.31 -0.09 -0.07 0.00 0.63 0.00 0.00 28.75 29.53 2cv4 h GLU 62 CO -0.01 0.35 0.42 -0.44 -0.73 0.00 0.00 179.01 178.60 2cv4 h ASP 63 N 0.39 0.57 0.13 1.04 3.32 -1.79 -0.06 116.42 120.02 2cv4 h ASP 63 Ca 0.11 0.06 -0.11 0.00 0.02 0.00 0.00 57.03 57.10 2cv4 h ASP 63 Cb 0.04 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 2cv4 h ASP 63 CO -0.02 0.32 -0.39 -0.26 -1.72 0.00 0.00 179.24 177.17 2cv4 h PHE 64 N 0.70 0.40 -0.16 4.55 0.04 -1.05 -3.04 116.94 118.38 2cv4 h PHE 64 Ca 0.38 -0.11 -0.01 0.00 2.80 0.00 0.00 57.97 61.03 2cv4 h PHE 64 Cb 0.38 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.43 2cv4 h PHE 64 CO -0.08 0.69 0.06 1.96 -0.60 0.00 0.00 178.31 180.34 2cv4 h GLN 65 N 0.29 0.24 -0.27 1.51 1.08 0.03 0.22 115.11 118.21 2cv4 h GLN 65 Ca 0.03 -0.05 0.08 0.00 -1.45 0.00 0.00 58.65 57.26 2cv4 h GLN 65 Cb 0.82 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.20 2cv4 h GLN 65 CO 0.07 0.33 0.28 0.00 -0.95 0.00 0.00 178.83 178.56 2cv4 h ARG 66 N 0.10 0.00 -0.29 1.46 3.08 -1.02 0.61 114.38 118.31 2cv4 h ARG 66 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2cv4 h ARG 66 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 2cv4 h ARG 66 CO -0.00 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.18 2cv4 n LEU 67 N -3.82 2.11 -1.49 3.04 4.77 -0.80 -4.91 117.00 115.91 2cv4 n LEU 67 Ca 0.04 -0.96 -0.14 0.00 -0.03 0.00 0.00 56.01 54.92 2cv4 n LEU 67 Cb 0.43 -0.19 -0.01 0.00 -2.33 0.00 0.00 43.42 41.31 2cv4 n LEU 67 CO 0.28 0.48 -0.17 0.61 -1.33 0.00 0.00 177.39 177.26 2cv4 n GLY 68 N 1.19 -0.02 3.51 -0.72 0.00 0.21 -4.86 105.19 104.50 2cv4 n GLY 68 Ca 0.16 -0.32 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.66 3.40 0.26 1.61 1.01 0.71 -1.82 120.40 122.92 2cv4 s VAL 69 Ca 0.00 -0.58 0.07 0.00 0.00 0.00 0.00 61.98 61.47 2cv4 s VAL 69 Cb 0.00 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 33.96 2cv4 s VAL 69 CO 0.00 0.58 0.24 -1.81 0.00 0.00 0.00 175.10 174.10 2cv4 s ASP 70 N -0.50 5.63 0.07 3.32 1.01 0.13 -3.94 116.67 122.39 2cv4 s ASP 70 Ca 0.07 -0.23 0.09 0.00 0.71 0.00 0.00 52.55 53.19 2cv4 s ASP 70 Cb -0.12 -1.42 -0.03 0.00 1.01 0.00 0.00 42.92 42.36 2cv4 s ASP 70 CO 0.02 -0.09 -0.24 -0.76 0.21 0.00 0.00 175.17 174.31 2cv4 s LEU 71 N -3.89 2.35 -0.23 1.23 1.43 -1.26 -0.47 118.68 117.85 2cv4 s LEU 71 Ca 0.34 -0.58 -0.10 0.00 -1.03 0.00 0.00 54.13 52.76 2cv4 s LEU 71 Cb -0.08 -1.35 0.09 0.00 0.03 0.00 0.00 46.19 44.88 2cv4 s LEU 71 CO 0.26 0.24 0.52 -0.51 0.23 0.00 0.00 176.35 177.08 2cv4 s ILE 72 N -0.91 -0.39 0.60 -0.59 2.07 -0.65 -4.29 121.20 117.03 2cv4 s ILE 72 Ca 0.13 0.08 -0.00 0.00 -1.41 0.00 0.00 60.65 59.45 2cv4 s ILE 72 Cb -0.10 -0.78 0.05 0.00 0.13 0.00 0.00 42.46 41.76 2cv4 s ILE 72 CO 0.04 0.03 0.84 -0.83 -1.91 0.00 0.00 174.94 173.12 2cv4 s GLY 73 N 2.11 1.80 -0.19 1.50 0.00 -0.14 -1.35 107.32 111.05 2cv4 s GLY 73 Ca -0.07 -1.34 -0.14 0.00 0.00 0.00 0.00 44.72 43.17 2cv4 s GLY 73 CO -0.15 -0.99 0.48 -2.27 0.00 0.00 0.00 173.10 170.17 2cv4 s LEU 74 N -4.89 -0.05 0.08 0.66 0.20 0.30 -0.03 118.68 114.95 2cv4 s LEU 74 Ca 0.59 1.01 -0.13 0.00 0.69 0.00 0.00 54.13 56.29 2cv4 s LEU 74 Cb -0.10 1.65 0.02 0.00 -0.43 0.00 0.00 46.19 47.33 2cv4 s LEU 74 CO 0.40 -0.18 0.30 -0.55 -0.29 0.00 0.00 176.35 176.02 2cv4 s SER 75 N 0.75 -0.08 0.11 3.68 0.15 -1.04 0.12 113.70 117.39 2cv4 s SER 75 Ca -0.04 -0.35 0.25 0.00 0.70 0.00 0.00 55.95 56.51 2cv4 s SER 75 Cb -0.05 0.38 0.95 0.00 -1.71 0.00 0.00 66.02 65.59 2cv4 s SER 75 CO -0.06 -0.71 1.76 0.52 1.20 0.00 0.00 173.24 175.96 2cv4 n VAL 76 N 0.20 0.50 -1.62 4.45 0.31 -1.26 -1.54 118.33 119.37 2cv4 n VAL 76 Ca -0.17 -0.01 -0.30 0.00 -0.01 0.00 0.00 64.34 63.86 2cv4 n VAL 76 Cb 0.61 -0.72 0.18 0.00 -0.91 0.00 0.00 33.84 33.00 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 -3.69 2.81 0.78 4.52 1.01 -1.26 -2.61 116.67 118.23 2cv4 s ASP 77 Ca 0.10 0.59 -0.12 0.00 0.71 0.00 0.00 52.55 53.83 2cv4 s ASP 77 Cb 0.14 -0.86 0.06 0.00 1.01 0.00 0.00 42.92 43.26 2cv4 s ASP 77 CO 0.48 -2.95 1.15 -0.94 0.21 0.00 0.00 175.17 173.12 2cv4 s SER 78 N -4.39 4.79 0.43 0.27 1.04 -1.26 -2.96 113.70 111.62 2cv4 s SER 78 Ca 0.69 0.88 0.20 0.00 0.48 0.00 0.00 55.95 58.20 2cv4 s SER 78 Cb -0.09 -1.46 0.97 0.00 0.10 0.00 0.00 66.02 65.54 2cv4 s SER 78 CO 0.53 -1.73 1.89 -0.37 0.98 0.00 0.00 173.24 174.54 2cv4 h VAL 79 N -0.92 0.88 -0.31 5.02 -1.51 -1.96 -2.09 116.25 115.35 2cv4 h VAL 79 Ca -0.46 -1.06 -0.07 0.00 -1.23 0.00 0.00 66.70 63.88 2cv4 h VAL 79 Cb 1.31 1.63 -0.01 0.00 -2.13 0.00 0.00 31.29 32.09 2cv4 h VAL 79 CO 0.65 0.27 -0.07 -0.26 -1.23 0.00 0.00 177.57 176.93 2cv4 h PHE 80 N 0.00 0.67 -0.38 5.19 0.04 -1.99 -0.65 116.94 119.82 2cv4 h PHE 80 Ca -0.00 -0.14 -0.02 0.00 2.80 0.00 0.00 57.97 60.61 2cv4 h PHE 80 Cb 0.61 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.58 2cv4 h PHE 80 CO 0.00 0.77 0.16 0.77 -0.60 0.00 0.00 178.31 179.41 2cv4 h SER 81 N 0.37 0.52 -0.23 2.17 0.02 -1.87 -1.60 113.55 112.94 2cv4 h SER 81 Ca 0.08 -0.16 0.06 0.00 -0.84 0.00 0.00 61.79 60.92 2cv4 h SER 81 Cb 0.55 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.90 2cv4 h SER 81 CO 0.03 0.54 -0.14 0.45 -1.14 0.00 0.00 176.83 176.58 2cv4 h HIS 82 N 0.47 -0.33 -0.48 3.45 3.86 -1.25 0.44 115.15 121.31 2cv4 h HIS 82 Ca 0.13 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.32 2cv4 h HIS 82 Cb 0.18 0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.81 2cv4 h HIS 82 CO -0.00 -0.20 0.12 0.82 0.86 0.00 0.00 177.93 179.52 2cv4 h ILE 83 N -0.12 1.24 -0.73 2.45 2.04 -0.94 0.17 117.51 121.62 2cv4 h ILE 83 Ca 0.13 -0.83 -0.00 0.00 1.00 0.00 0.00 64.86 65.15 2cv4 h ILE 83 Cb 0.31 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 2cv4 h ILE 83 CO -0.31 0.30 0.45 0.11 0.00 0.00 0.00 178.15 178.71 2cv4 h LYS 84 N 0.66 0.99 -0.01 2.37 1.79 -0.75 0.15 116.57 121.77 2cv4 h LYS 84 Ca 0.15 -0.08 -0.00 0.00 -2.18 0.00 0.00 60.65 58.54 2cv4 h LYS 84 Cb 0.33 -0.21 -0.00 0.00 -1.58 0.00 0.00 32.23 30.77 2cv4 h LYS 84 CO 0.00 0.69 0.00 2.35 -1.08 0.00 0.00 179.45 181.42 2cv4 h TRP 85 N 1.00 0.01 -1.00 -1.35 7.01 0.31 0.25 115.95 122.18 2cv4 h TRP 85 Ca 0.26 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.28 2cv4 h TRP 85 Cb -0.05 -0.00 -0.05 0.00 -2.10 0.00 0.00 29.16 26.95 2cv4 h TRP 85 CO -0.01 0.06 0.66 0.87 -2.79 0.00 0.00 178.44 177.23 2cv4 h LYS 86 N -0.04 1.30 -0.85 2.65 1.57 -0.39 -1.12 116.57 119.69 2cv4 h LYS 86 Ca 0.00 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2cv4 h LYS 86 Cb 0.05 -0.29 -0.04 0.00 0.08 0.00 0.00 32.23 32.02 2cv4 h LYS 86 CO -0.00 0.86 0.55 1.49 -0.57 0.00 0.00 179.45 181.78 2cv4 h GLU 87 N 1.34 1.12 -0.48 3.15 4.81 -0.07 -1.50 114.58 122.95 2cv4 h GLU 87 Ca 0.37 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.48 2cv4 h GLU 87 Cb -0.12 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 28.99 2cv4 h GLU 87 CO -0.09 0.75 0.11 2.35 -0.73 0.00 0.00 179.01 181.41 2cv4 h TRP 88 N 1.15 0.75 -0.10 0.92 7.01 0.67 -1.31 115.95 125.04 2cv4 h TRP 88 Ca 0.31 -0.06 -0.04 0.00 2.11 0.00 0.00 58.89 61.20 2cv4 h TRP 88 Cb -0.11 -0.22 -0.00 0.00 -2.10 0.00 0.00 29.16 26.73 2cv4 h TRP 88 CO -0.01 0.64 -0.10 0.82 -2.79 0.00 0.00 178.44 177.00 2cv4 h ILE 89 N 0.71 1.36 -0.59 2.65 2.04 -0.90 0.17 117.51 122.95 2cv4 h ILE 89 Ca 0.16 -1.27 0.04 0.00 1.00 0.00 0.00 64.86 64.79 2cv4 h ILE 89 Cb 0.27 1.99 -0.04 0.00 -0.74 0.00 0.00 36.82 38.30 2cv4 h ILE 89 CO -0.00 0.36 0.34 -0.08 0.00 0.00 0.00 178.15 178.76 2cv4 h GLU 90 N -0.18 0.63 -0.08 2.37 4.81 -1.19 0.28 114.58 121.23 2cv4 h GLU 90 Ca 0.01 -0.04 -0.23 0.00 -0.13 0.00 0.00 59.36 58.98 2cv4 h GLU 90 Cb 0.62 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 29.87 2cv4 h GLU 90 CO 0.02 0.42 -0.86 -0.09 -0.73 0.00 0.00 179.01 177.77 2cv4 h ARG 91 N 0.65 0.64 0.00 1.92 2.43 -1.17 -1.55 114.38 117.30 2cv4 h ARG 91 Ca 0.25 -0.59 -0.00 0.00 -0.81 0.00 0.00 59.98 58.83 2cv4 h ARG 91 Cb 0.09 0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.78 2cv4 h ARG 91 CO -0.13 1.20 -1.59 0.72 -1.51 0.00 0.00 179.97 178.66 2cv4 n HIS 92 N -3.87 0.40 0.16 2.20 8.25 0.58 -4.38 115.22 118.57 2cv4 n HIS 92 Ca -0.08 0.12 0.03 0.00 -0.26 0.00 0.00 57.72 57.53 2cv4 n HIS 92 Cb 0.79 -0.69 -0.04 0.00 1.12 0.00 0.00 29.99 31.17 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 -2.43 0.00 -1.06 1.59 5.41 0.96 -5.03 119.36 118.80 2cv4 n ILE 93 Ca -0.02 -0.28 -0.02 0.00 1.00 0.00 0.00 62.75 63.43 2cv4 n ILE 93 Cb 0.56 0.76 -0.01 0.00 -0.71 0.00 0.00 39.64 40.25 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 1.53 0.55 2.91 7.39 0.00 -0.58 -4.99 105.19 111.99 2cv4 n GLY 94 Ca 0.00 -0.88 -0.20 0.00 0.00 0.00 0.00 46.02 44.94 2cv4 n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cv4 s VAL 95 N -2.07 0.57 -0.11 1.61 0.11 -1.25 -5.00 120.40 114.26 2cv4 s VAL 95 Ca 0.00 -0.16 -0.20 0.00 -2.93 0.00 0.00 61.98 58.69 2cv4 s VAL 95 Cb 0.00 -0.58 -0.04 0.00 -1.53 0.00 0.00 36.38 34.23 2cv4 s VAL 95 CO 0.00 0.23 0.58 -0.60 -3.33 0.00 0.00 175.10 171.97 2cv4 s ARG 96 N 0.81 4.36 -0.45 1.54 3.52 -1.26 -3.11 118.95 124.36 2cv4 s ARG 96 Ca -0.11 0.62 -0.29 0.00 -0.13 0.00 0.00 55.73 55.83 2cv4 s ARG 96 Cb -0.14 -3.46 0.03 0.00 -1.56 0.00 0.00 34.95 29.82 2cv4 s ARG 96 CO 0.01 0.08 1.10 0.42 -0.81 0.00 0.00 175.30 176.10 2cv4 s ILE 97 N 0.84 4.29 -0.49 4.11 1.09 -1.26 -4.93 121.20 124.85 2cv4 s ILE 97 Ca 0.30 1.26 0.24 0.00 -1.10 0.00 0.00 60.65 61.35 2cv4 s ILE 97 Cb -0.16 -4.55 0.29 0.00 -1.06 0.00 0.00 42.46 36.98 2cv4 s ILE 97 CO 0.13 -0.90 1.59 1.55 -0.10 0.00 0.00 174.94 177.21 2cv4 h PRO 98 N 9.02 0.00 -6.82 2.79 0.13 -1.95 -3.47 132.00 131.70 2cv4 h PRO 98 Ca -0.23 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.46 2cv4 h PRO 98 Cb 1.06 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.23 2cv4 h PRO 98 CO 1.10 0.00 -0.04 -0.59 -0.23 0.00 0.00 178.00 178.24 2cv4 s PHE 99 N -3.20 3.01 0.48 1.56 -0.71 -1.26 -5.08 117.98 112.79 2cv4 s PHE 99 Ca 0.07 0.13 -0.10 0.00 -1.04 0.00 0.00 56.93 55.99 2cv4 s PHE 99 Cb 0.07 -2.61 -0.05 0.00 -1.21 0.00 0.00 43.02 39.22 2cv4 s PHE 99 CO 0.67 -0.70 0.85 -1.25 -1.34 0.00 0.00 175.22 173.44 2cv4 s PRO 100 N -4.72 3.69 -0.08 1.99 0.04 -1.26 -4.93 135.00 129.74 2cv4 s PRO 100 Ca 0.54 0.49 0.03 0.00 0.04 0.00 0.00 61.00 62.11 2cv4 s PRO 100 Cb -0.10 -2.30 0.01 0.00 0.04 0.00 0.00 34.50 32.15 2cv4 s PRO 100 CO 0.39 -0.22 -0.18 0.42 0.04 0.00 0.00 177.00 177.45 2cv4 s ILE 101 N -2.67 1.58 0.20 0.56 1.01 -1.26 -0.97 121.20 119.66 2cv4 s ILE 101 Ca 0.52 -0.75 -0.30 0.00 0.00 0.00 0.00 60.65 60.12 2cv4 s ILE 101 Cb -0.10 -1.40 -0.08 0.00 0.01 0.00 0.00 42.46 40.89 2cv4 s ILE 101 CO 0.40 0.45 1.15 -0.63 0.00 0.00 0.00 174.94 176.32 2cv4 s ILE 102 N 0.47 3.62 -0.33 2.92 1.01 0.96 -1.31 121.20 128.54 2cv4 s ILE 102 Ca -0.16 1.42 -0.11 0.00 0.00 0.00 0.00 60.65 61.80 2cv4 s ILE 102 Cb -0.17 -3.91 -0.01 0.00 0.01 0.00 0.00 42.46 38.39 2cv4 s ILE 102 CO 0.06 0.26 0.19 0.00 0.00 0.00 0.00 174.94 175.45 2cv4 s ALA 103 N -0.34 3.35 -0.59 9.38 0.00 0.55 -2.48 121.76 131.64 2cv4 s ALA 103 Ca 0.50 -1.44 0.06 0.00 0.00 0.00 0.00 51.96 51.08 2cv4 s ALA 103 Cb -0.32 -2.51 0.30 0.00 0.00 0.00 0.00 23.12 20.59 2cv4 s ALA 103 CO 0.37 -1.00 0.85 -3.47 0.00 0.00 0.00 175.76 172.51 2cv4 n ASP 104 N 5.03 3.89 -0.35 0.00 2.03 -0.59 -4.56 116.55 122.00 2cv4 n ASP 104 Ca -0.13 -3.53 0.23 0.00 0.52 0.00 0.00 54.79 51.88 2cv4 n ASP 104 Cb 0.49 -0.61 0.48 0.00 -0.72 0.00 0.00 41.12 40.76 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 3.47 0.39 -6.22 -0.67 0.11 -1.62 -3.36 132.00 124.10 2cv4 h PRO 105 Ca 0.15 -0.02 -0.67 0.00 0.11 0.00 0.00 66.00 65.57 2cv4 h PRO 105 Cb 0.60 -0.09 -0.15 0.00 0.11 0.00 0.00 31.00 31.47 2cv4 h PRO 105 CO 0.80 0.26 -0.67 -0.65 -0.21 0.00 0.00 178.00 177.53 2cv4 s GLN 106 N -5.61 2.68 0.00 1.05 -1.52 -1.26 -4.94 119.66 110.07 2cv4 s GLN 106 Ca -0.10 -0.67 0.00 0.00 -1.95 0.00 0.00 55.36 52.65 2cv4 s GLN 106 Cb 0.28 -2.60 0.00 0.00 -0.22 0.00 0.00 33.01 30.47 2cv4 s GLN 106 CO 0.80 0.61 0.46 0.41 -0.25 0.00 0.00 175.29 177.32 2cv4 n GLY 107 N 1.42 0.88 0.50 3.09 0.00 -1.26 -4.20 105.19 105.62 2cv4 n GLY 107 Ca -0.15 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 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 1.38 0.00 -0.15 2.61 2.02 -1.93 1.04 112.91 117.88 2cv4 h THR 108 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2cv4 h THR 108 Cb 0.28 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.68 2cv4 h THR 108 CO 0.00 0.00 0.04 0.58 0.37 0.00 0.00 175.52 176.51 2cv4 h VAL 109 N -1.00 1.19 -0.59 3.16 2.07 -1.92 -1.60 116.25 117.56 2cv4 h VAL 109 Ca -0.06 -0.58 0.08 0.00 0.82 0.00 0.00 66.70 66.95 2cv4 h VAL 109 Cb 0.87 1.30 -0.06 0.00 -1.52 0.00 0.00 31.29 31.87 2cv4 h VAL 109 CO -0.06 0.18 0.26 0.00 0.02 0.00 0.00 177.57 177.96 2cv4 h ALA 110 N 0.85 0.77 -0.44 1.67 0.00 -1.81 -0.45 119.26 119.87 2cv4 h ALA 110 Ca 0.05 0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 2cv4 h ALA 110 Cb 0.23 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2cv4 h ALA 110 CO -0.00 -0.14 -0.26 0.00 0.00 0.00 0.00 179.25 178.86 2cv4 h ARG 111 N 0.47 0.95 0.00 0.00 3.08 0.12 0.57 114.38 119.56 2cv4 h ARG 111 Ca 0.29 -0.43 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 2cv4 h ARG 111 Cb 0.30 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.33 2cv4 h ARG 111 CO -0.26 1.10 -0.03 -0.09 -1.07 0.00 0.00 179.97 179.62 2cv4 h ARG 112 N 0.78 0.00 -0.59 0.04 9.65 -0.48 0.15 114.38 123.93 2cv4 h ARG 112 Ca 0.09 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 2cv4 h ARG 112 Cb 0.84 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.42 2cv4 h ARG 112 CO 0.07 0.03 0.00 1.28 2.80 0.00 0.00 179.97 184.15 2cv4 n LEU 113 N -4.49 3.74 -1.46 3.80 4.77 -0.25 -4.78 117.00 118.33 2cv4 n LEU 113 Ca -0.03 -1.80 -0.18 0.00 -0.03 0.00 0.00 56.01 53.97 2cv4 n LEU 113 Cb 0.12 -0.39 -0.07 0.00 -2.33 0.00 0.00 43.42 40.75 2cv4 n LEU 113 CO 0.34 0.89 -0.18 0.61 -1.33 0.00 0.00 177.39 177.72 2cv4 n GLY 114 N 1.56 1.55 0.04 -0.72 0.00 0.51 -4.33 105.19 103.80 2cv4 n GLY 114 Ca 0.22 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.12 0.07 -4.25 0.99 4.77 0.18 -4.49 117.00 112.15 2cv4 n LEU 115 Ca -0.19 -0.03 -0.43 0.00 -0.03 0.00 0.00 56.01 55.34 2cv4 n LEU 115 Cb 0.60 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.62 2cv4 n LEU 115 CO 0.27 0.02 0.44 -0.22 -1.33 0.00 0.00 177.39 176.57 2cv4 s LEU 116 N -0.92 6.16 0.00 2.23 2.96 -1.25 -2.12 118.68 125.73 2cv4 s LEU 116 Ca 0.00 -3.15 -0.03 0.00 -0.22 0.00 0.00 54.13 50.73 2cv4 s LEU 116 Cb 0.00 -2.09 0.05 0.00 0.50 0.00 0.00 46.19 44.65 2cv4 s LEU 116 CO 0.00 -0.39 0.30 1.41 -1.32 0.00 0.00 176.35 176.36 2cv4 n HIS 117 N 3.25 -3.92 -0.70 5.38 8.25 -1.26 -4.97 115.22 121.24 2cv4 n HIS 117 Ca 0.17 -0.29 -0.19 0.00 -0.26 0.00 0.00 57.72 57.15 2cv4 n HIS 117 Cb 0.41 -0.23 0.09 0.00 1.12 0.00 0.00 29.99 31.38 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 -3.18 4.95 0.52 -1.41 0.00 -1.26 -4.20 120.51 115.94 2cv4 n ALA 118 Ca -0.05 -2.04 0.08 0.00 0.00 0.00 0.00 53.44 51.43 2cv4 n ALA 118 Cb 0.14 -1.38 -0.11 0.00 0.00 0.00 0.00 19.45 18.10 2cv4 n ALA 118 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2cv4 n GLU 119 N -0.35 1.24 -3.15 0.00 1.02 -1.26 -4.91 120.64 113.22 2cv4 n GLU 119 Ca 0.40 -0.05 0.06 0.00 -0.02 0.00 0.00 57.16 57.54 2cv4 n GLU 119 Cb 0.98 -1.31 -0.02 0.00 -0.02 0.00 0.00 31.44 31.06 2cv4 n GLU 119 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2cv4 s SER 120 N -3.00 -0.05 0.50 1.62 0.15 -1.26 -5.02 113.70 106.63 2cv4 s SER 120 Ca 0.02 0.04 0.28 0.00 0.70 0.00 0.00 55.95 56.99 2cv4 s SER 120 Cb 0.12 1.05 1.37 0.00 -1.71 0.00 0.00 66.02 66.85 2cv4 s SER 120 CO 0.68 -0.01 1.87 0.00 1.20 0.00 0.00 173.24 176.98 2cv4 h ALA 121 N 7.92 2.67 -1.82 5.45 0.00 -1.91 -3.37 119.26 128.19 2cv4 h ALA 121 Ca -0.10 -0.01 -0.44 0.00 0.00 0.00 0.00 54.91 54.36 2cv4 h ALA 121 Cb 1.18 0.04 0.02 0.00 0.00 0.00 0.00 17.79 19.03 2cv4 h ALA 121 CO -0.22 -0.94 -0.22 0.95 0.00 0.00 0.00 179.25 178.81 2cv4 s THR 122 N -5.11 3.72 0.06 0.00 -4.23 -1.26 -4.94 115.64 103.88 2cv4 s THR 122 Ca -0.06 -0.82 0.00 0.00 -1.18 0.00 0.00 61.69 59.63 2cv4 s THR 122 Cb 0.22 -3.32 0.00 0.00 1.34 0.00 0.00 72.50 70.74 2cv4 s THR 122 CO 0.78 -0.16 0.00 1.41 -0.54 0.00 0.00 174.62 176.11 2cv4 n HIS 123 N -1.88 -3.63 -1.89 3.99 -0.00 -1.26 -4.98 115.22 105.56 2cv4 n HIS 123 Ca 0.03 2.17 -0.38 0.00 -0.00 0.00 0.00 57.72 59.53 2cv4 n HIS 123 Cb 0.58 -3.34 0.03 0.00 -0.00 0.00 0.00 29.99 27.26 2cv4 n HIS 123 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 2cv4 s THR 124 N -0.43 2.31 1.02 1.59 2.01 -1.26 -4.60 115.64 116.28 2cv4 s THR 124 Ca 0.00 0.23 -0.12 0.00 0.31 0.00 0.00 61.69 62.11 2cv4 s THR 124 Cb 0.00 -3.12 0.20 0.00 0.01 0.00 0.00 72.50 69.59 2cv4 s THR 124 CO 0.00 0.00 1.08 0.68 -0.69 0.00 0.00 174.62 175.69 2cv4 s VAL 125 N -1.35 2.19 -1.47 3.82 -7.23 -0.90 -2.99 120.40 112.47 2cv4 s VAL 125 Ca 0.69 0.06 -0.11 0.00 -1.81 0.00 0.00 61.98 60.82 2cv4 s VAL 125 Cb -0.38 -2.41 -0.06 0.00 0.56 0.00 0.00 36.38 34.09 2cv4 s VAL 125 CO 0.45 -0.08 2.69 0.54 -0.31 0.00 0.00 175.10 178.39 2cv4 n ARG 126 N -4.33 3.26 -3.34 4.82 1.74 -1.25 -4.12 116.66 113.44 2cv4 n ARG 126 Ca 0.05 -2.16 -0.33 0.00 -0.77 0.00 0.00 57.85 54.64 2cv4 n ARG 126 Cb 0.56 -2.85 -0.06 0.00 -1.02 0.00 0.00 32.46 29.10 2cv4 n ARG 126 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2cv4 s GLY 127 N 2.62 2.35 -0.06 -0.13 0.00 -1.25 -2.59 107.32 108.27 2cv4 s GLY 127 Ca 0.61 -0.17 0.02 0.00 0.00 0.00 0.00 44.72 45.18 2cv4 s GLY 127 CO -0.06 0.03 -0.08 0.14 0.00 0.00 0.00 173.10 173.13 2cv4 s VAL 128 N -1.74 0.83 -0.14 1.40 1.01 0.07 -1.24 120.40 120.59 2cv4 s VAL 128 Ca 0.46 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 62.17 2cv4 s VAL 128 Cb -0.12 -0.80 0.01 0.00 0.00 0.00 0.00 36.38 35.47 2cv4 s VAL 128 CO 0.20 0.29 -0.21 -0.36 0.00 0.00 0.00 175.10 175.02 2cv4 s PHE 129 N 0.82 2.67 -0.29 5.22 0.40 -0.35 -1.59 117.98 124.86 2cv4 s PHE 129 Ca -0.12 -1.26 -0.11 0.00 -0.60 0.00 0.00 56.93 54.83 2cv4 s PHE 129 Cb -0.15 -1.81 -0.04 0.00 0.51 0.00 0.00 43.02 41.52 2cv4 s PHE 129 CO 0.02 -0.57 0.19 0.42 0.70 0.00 0.00 175.22 175.98 2cv4 s ILE 130 N 0.75 5.25 -0.11 0.64 1.01 -0.41 -1.46 121.20 126.87 2cv4 s ILE 130 Ca -0.08 0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.67 2cv4 s ILE 130 Cb -0.16 -3.54 -0.01 0.00 0.01 0.00 0.00 42.46 38.77 2cv4 s ILE 130 CO -0.00 0.20 -0.20 -0.69 0.00 0.00 0.00 174.94 174.25 2cv4 s VAL 131 N 1.74 2.45 0.77 2.92 1.01 -0.11 -0.92 120.40 128.26 2cv4 s VAL 131 Ca 0.07 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 61.05 2cv4 s VAL 131 Cb -0.16 -1.98 0.17 0.00 0.00 0.00 0.00 36.38 34.42 2cv4 s VAL 131 CO 0.10 0.55 1.05 -0.90 0.00 0.00 0.00 175.10 175.90 2cv4 n ASP 132 N 3.52 0.25 0.00 3.32 5.68 -0.49 -1.21 116.55 127.61 2cv4 n ASP 132 Ca -0.19 -1.48 0.07 0.00 -0.50 0.00 0.00 54.79 52.69 2cv4 n ASP 132 Cb 0.53 -0.79 0.38 0.00 -1.14 0.00 0.00 41.12 40.11 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 -3.58 1.89 -0.64 2.12 0.00 -1.26 -1.35 120.51 117.69 2cv4 n ALA 133 Ca -0.17 -0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.27 2cv4 n ALA 133 Cb 0.48 -1.23 0.20 0.00 0.00 0.00 0.00 19.45 18.89 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 -1.18 2.82 -1.07 0.00 1.85 -1.26 -4.60 116.66 113.22 2cv4 n ARG 134 Ca 0.08 -2.46 -0.02 0.00 -1.00 0.00 0.00 57.85 54.45 2cv4 n ARG 134 Cb 0.09 -1.57 -0.01 0.00 -1.05 0.00 0.00 32.46 29.92 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 -0.18 0.58 3.71 2.89 0.00 -0.46 -4.97 105.19 106.77 2cv4 n GLY 135 Ca 0.16 -0.79 -0.36 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.07 5.38 -0.06 1.61 1.01 -1.26 0.68 120.40 125.70 2cv4 s VAL 136 Ca 0.00 0.25 -0.30 0.00 0.00 0.00 0.00 61.98 61.94 2cv4 s VAL 136 Cb 0.00 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.82 2cv4 s VAL 136 CO 0.00 0.41 1.63 -0.63 0.00 0.00 0.00 175.10 176.51 2cv4 s ILE 137 N 0.53 3.62 -0.18 2.22 1.01 -0.62 -1.40 121.20 126.38 2cv4 s ILE 137 Ca 0.09 0.75 0.16 0.00 0.00 0.00 0.00 60.65 61.65 2cv4 s ILE 137 Cb -0.12 -3.49 -0.22 0.00 0.01 0.00 0.00 42.46 38.64 2cv4 s ILE 137 CO 0.00 -0.07 0.41 0.54 0.00 0.00 0.00 174.94 175.82 2cv4 n ARG 138 N 7.12 0.84 -1.19 2.79 5.12 -0.10 -0.69 116.66 130.55 2cv4 n ARG 138 Ca 0.17 -0.11 0.00 0.00 -1.93 0.00 0.00 57.85 55.98 2cv4 n ARG 138 Cb 0.43 -1.33 0.00 0.00 -1.16 0.00 0.00 32.46 30.40 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 -1.88 0.00 -3.64 0.55 -1.04 -1.23 -4.95 114.28 102.09 2cv4 n THR 139 Ca -0.02 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 61.96 2cv4 n THR 139 Cb 0.37 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.81 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 -0.37 -0.45 -4.42 1.43 -0.62 -1.28 118.68 112.96 2cv4 s LEU 141 Ca 0.00 0.64 0.03 0.00 -1.03 0.00 0.00 54.13 53.76 2cv4 s LEU 141 Cb 0.00 1.61 0.13 0.00 0.03 0.00 0.00 46.19 47.95 2cv4 s LEU 141 CO 0.00 -0.10 0.22 -0.31 0.23 0.00 0.00 176.35 176.39 2cv4 s TYR 142 N 0.86 2.50 0.49 0.29 2.02 -1.26 -0.75 117.35 121.51 2cv4 s TYR 142 Ca -0.04 -2.68 -0.09 0.00 -0.37 0.00 0.00 57.07 53.89 2cv4 s TYR 142 Cb -0.04 -2.27 -0.05 0.00 -0.40 0.00 0.00 41.96 39.20 2cv4 s TYR 142 CO -0.12 -0.79 0.85 0.71 -1.57 0.00 0.00 175.55 174.63 2cv4 s TYR 143 N 0.26 3.54 0.00 2.71 2.02 -1.07 -5.01 117.35 119.80 2cv4 s TYR 143 Ca 0.16 1.05 0.00 0.00 -0.37 0.00 0.00 57.07 57.91 2cv4 s TYR 143 Cb -0.24 -2.48 0.00 0.00 -0.40 0.00 0.00 41.96 38.84 2cv4 s TYR 143 CO -0.02 -0.32 0.00 -0.35 -1.57 0.00 0.00 175.55 173.29 2cv4 n PRO 144 N -2.01 0.00 0.00 -1.71 -0.04 -1.26 -3.74 135.00 126.24 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 0.54 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 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 -3.95 0.54 0.00 -1.26 -4.69 120.64 111.28 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 2.66 0.55 -1.84 1.98 -1.26 -5.07 118.68 115.70 2cv4 s LEU 147 Ca 0.00 -1.19 -0.21 0.00 -2.89 0.00 0.00 54.13 49.84 2cv4 s LEU 147 Cb 0.00 -1.22 -0.04 0.00 0.66 0.00 0.00 46.19 45.59 2cv4 s LEU 147 CO 0.00 -0.23 1.28 -0.83 -1.89 0.00 0.00 176.35 174.68 2cv4 s GLY 148 N 1.36 2.83 0.95 7.98 0.00 -1.26 -4.94 107.32 114.25 2cv4 s GLY 148 Ca -0.06 1.18 -0.12 0.00 0.00 0.00 0.00 44.72 45.72 2cv4 s GLY 148 CO -0.06 1.65 1.09 0.50 0.00 0.00 0.00 173.10 176.28 2cv4 s ARG 149 N -3.02 0.82 -0.57 2.90 0.52 -1.26 -5.01 118.95 113.33 2cv4 s ARG 149 Ca 0.73 0.63 -0.05 0.00 -0.52 0.00 0.00 55.73 56.53 2cv4 s ARG 149 Cb -0.36 -1.77 0.15 0.00 0.52 0.00 0.00 34.95 33.49 2cv4 s ARG 149 CO 0.41 -2.49 0.39 -1.17 0.02 0.00 0.00 175.30 172.46 2cv4 s LEU 150 N -6.33 5.42 0.46 2.53 0.20 -1.26 -4.98 118.68 114.72 2cv4 s LEU 150 Ca 0.64 -2.52 0.14 0.00 0.69 0.00 0.00 54.13 53.09 2cv4 s LEU 150 Cb -0.18 -1.90 1.05 0.00 -0.43 0.00 0.00 46.19 44.73 2cv4 s LEU 150 CO 0.57 -0.47 2.03 0.58 -0.29 0.00 0.00 176.35 178.77 2cv4 h VAL 151 N 5.62 1.09 0.00 1.68 2.07 -1.97 -2.12 116.25 122.63 2cv4 h VAL 151 Ca -0.06 -0.43 -0.04 0.00 0.82 0.00 0.00 66.70 67.00 2cv4 h VAL 151 Cb 1.00 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 2cv4 h VAL 151 CO 0.73 0.13 -0.17 0.44 0.02 0.00 0.00 177.57 178.72 2cv4 h ASP 152 N 0.06 0.00 0.21 0.57 3.32 -1.93 -1.44 116.42 117.20 2cv4 h ASP 152 Ca 0.01 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.96 2cv4 h ASP 152 Cb 0.21 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2cv4 h ASP 152 CO 0.01 0.17 -0.40 -0.08 -1.72 0.00 0.00 179.24 177.23 2cv4 h GLU 153 N 0.00 0.25 -0.02 3.56 4.57 -1.74 -1.11 114.58 120.10 2cv4 h GLU 153 Ca -0.00 -0.12 -0.11 0.00 -1.18 0.00 0.00 59.36 57.95 2cv4 h GLU 153 Cb 0.39 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.96 2cv4 h GLU 153 CO 0.02 0.62 -0.53 0.82 -1.18 0.00 0.00 179.01 178.76 2cv4 h ILE 154 N 0.22 1.38 -0.28 2.32 2.04 -1.33 -0.82 117.51 121.03 2cv4 h ILE 154 Ca 0.02 -1.81 -0.07 0.00 1.00 0.00 0.00 64.86 64.00 2cv4 h ILE 154 Cb 0.80 1.96 -0.01 0.00 -0.74 0.00 0.00 36.82 38.83 2cv4 h ILE 154 CO 0.06 0.52 -0.10 -0.07 0.00 0.00 0.00 178.15 178.56 2cv4 h LEU 155 N 0.04 0.57 0.15 1.44 3.38 -1.19 -2.64 115.31 117.06 2cv4 h LEU 155 Ca -0.00 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.58 2cv4 h LEU 155 Cb 0.95 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 2cv4 h LEU 155 CO 0.07 0.83 -0.15 -0.09 0.09 0.00 0.00 178.44 179.19 2cv4 h ARG 156 N 0.30 -0.32 -0.61 1.13 2.43 -0.71 -0.02 114.38 116.58 2cv4 h ARG 156 Ca 0.07 0.02 0.11 0.00 -0.81 0.00 0.00 59.98 59.37 2cv4 h ARG 156 Cb 0.60 0.07 -0.09 0.00 -0.42 0.00 0.00 29.97 30.14 2cv4 h ARG 156 CO 0.03 -0.22 0.14 0.82 -1.51 0.00 0.00 179.97 179.24 2cv4 h ILE 157 N -0.34 0.65 -0.12 1.20 2.04 -1.17 0.52 117.51 120.30 2cv4 h ILE 157 Ca 0.00 -0.09 -0.15 0.00 1.00 0.00 0.00 64.86 65.62 2cv4 h ILE 157 Cb 0.32 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 2cv4 h ILE 157 CO -0.04 0.05 -0.56 0.58 0.00 0.00 0.00 178.15 178.18 2cv4 h VAL 158 N 0.28 1.35 -0.19 1.67 2.07 -1.18 -0.23 116.25 120.02 2cv4 h VAL 158 Ca 0.32 -1.86 -0.07 0.00 0.82 0.00 0.00 66.70 65.91 2cv4 h VAL 158 Cb 0.47 1.88 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 2cv4 h VAL 158 CO -0.40 0.56 -0.16 0.50 0.02 0.00 0.00 177.57 178.09 2cv4 h LYS 159 N 0.28 0.44 0.11 1.57 1.63 -0.26 -1.82 116.57 118.52 2cv4 h LYS 159 Ca 0.00 -0.23 -0.01 0.00 -0.85 0.00 0.00 60.65 59.57 2cv4 h LYS 159 Cb 1.07 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.71 2cv4 h LYS 159 CO 0.10 0.79 -0.05 0.00 -3.45 0.00 0.00 179.45 176.83 2cv4 h ALA 160 N 0.65 -0.15 -0.84 5.00 0.00 0.11 -1.65 119.26 122.39 2cv4 h ALA 160 Ca 0.03 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.94 2cv4 h ALA 160 Cb 0.69 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 2cv4 h ALA 160 CO 0.04 -0.56 0.52 -0.07 0.00 0.00 0.00 179.25 179.18 2cv4 h LEU 161 N -0.20 0.83 -0.08 0.00 4.07 -1.07 0.30 115.31 119.16 2cv4 h LEU 161 Ca -0.02 0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 2cv4 h LEU 161 Cb 0.16 -0.16 -0.00 0.00 1.08 0.00 0.00 40.66 41.73 2cv4 h LEU 161 CO 0.03 0.54 -0.02 0.11 -1.08 0.00 0.00 178.44 178.01 2cv4 h LYS 162 N 0.97 0.16 -0.10 1.13 1.57 -1.13 -0.32 116.57 118.85 2cv4 h LYS 162 Ca 0.36 -0.06 0.04 0.00 -1.87 0.00 0.00 60.65 59.12 2cv4 h LYS 162 Cb 0.13 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.38 2cv4 h LYS 162 CO -0.16 0.50 -0.24 -0.07 -0.57 0.00 0.00 179.45 178.90 2cv4 h LEU 163 N -0.18 -0.75 -1.35 2.94 3.38 -0.99 -0.48 115.31 117.88 2cv4 h LEU 163 Ca 0.02 0.12 0.14 0.00 0.09 0.00 0.00 57.88 58.25 2cv4 h LEU 163 Cb 0.44 0.33 -0.06 0.00 0.09 0.00 0.00 40.66 41.45 2cv4 h LEU 163 CO 0.01 -0.30 0.56 1.23 0.09 0.00 0.00 178.44 180.03 2cv4 h GLY 164 N -0.32 1.09 0.62 0.83 0.00 -0.30 0.24 103.07 105.22 2cv4 h GLY 164 Ca 0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 2cv4 h GLY 164 CO -0.29 0.09 -0.14 -0.55 0.00 0.00 0.00 176.54 175.65 2cv4 h ASP 165 N 0.64 -0.33 -0.41 0.19 5.19 0.21 -1.49 116.42 120.43 2cv4 h ASP 165 Ca 0.42 -0.20 -0.12 0.00 -0.62 0.00 0.00 57.03 56.52 2cv4 h ASP 165 Cb 0.72 0.08 -0.02 0.00 0.18 0.00 0.00 39.33 40.30 2cv4 h ASP 165 CO -0.18 0.06 -0.18 0.77 -3.12 0.00 0.00 179.24 176.59 2cv4 h SER 166 N -0.77 0.91 -0.51 6.45 4.64 -0.80 -2.84 113.55 120.63 2cv4 h SER 166 Ca -0.04 -0.32 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2cv4 h SER 166 Cb 0.50 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2cv4 h SER 166 CO 0.07 1.07 0.00 0.18 -0.87 0.00 0.00 176.83 177.28 2cv4 n LEU 167 N -4.12 3.13 -3.94 5.97 4.77 0.04 -4.96 117.00 117.89 2cv4 n LEU 167 Ca 0.01 -1.57 -0.37 0.00 -0.03 0.00 0.00 56.01 54.05 2cv4 n LEU 167 Cb 0.43 -0.41 0.01 0.00 -2.33 0.00 0.00 43.42 41.12 2cv4 n LEU 167 CO 0.45 0.67 -0.19 0.29 -1.33 0.00 0.00 177.39 177.28 2cv4 n LYS 168 N 0.93 -0.81 -3.96 3.23 5.02 -0.83 -4.97 118.16 116.77 2cv4 n LYS 168 Ca 0.18 0.38 -0.09 0.00 -2.02 0.00 0.00 58.31 56.76 2cv4 n LYS 168 Cb 0.54 -2.48 -0.08 0.00 -0.02 0.00 0.00 35.03 32.99 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 -6.34 0.89 0.16 1.97 1.81 -0.62 -4.66 118.95 112.17 2cv4 s ARG 169 Ca 0.29 -1.12 0.03 0.00 -1.72 0.00 0.00 55.73 53.21 2cv4 s ARG 169 Cb -0.16 0.32 -0.04 0.00 -0.45 0.00 0.00 34.95 34.62 2cv4 s ARG 169 CO 0.94 -0.28 0.24 0.00 -0.68 0.00 0.00 175.30 175.52 2cv4 s ALA 170 N -3.92 3.84 -0.21 2.13 0.00 0.30 -4.48 121.76 119.42 2cv4 s ALA 170 Ca 0.11 -1.10 -0.05 0.00 0.00 0.00 0.00 51.96 50.92 2cv4 s ALA 170 Cb 0.05 -1.64 -0.02 0.00 0.00 0.00 0.00 23.12 21.50 2cv4 s ALA 170 CO -0.06 0.52 0.01 0.08 0.00 0.00 0.00 175.76 176.30 2cv4 s VAL 171 N -1.76 3.98 0.64 0.00 1.01 -1.26 0.31 120.40 123.32 2cv4 s VAL 171 Ca 0.33 -0.30 -0.16 0.00 0.00 0.00 0.00 61.98 61.86 2cv4 s VAL 171 Cb -0.11 -2.81 -0.01 0.00 0.00 0.00 0.00 36.38 33.45 2cv4 s VAL 171 CO 0.27 0.41 1.11 -2.16 0.00 0.00 0.00 175.10 174.73 2cv4 s PRO 172 N 1.16 2.90 0.25 2.72 0.04 -1.26 -4.94 135.00 135.88 2cv4 s PRO 172 Ca 0.03 1.41 -0.29 0.00 0.04 0.00 0.00 61.00 62.20 2cv4 s PRO 172 Cb -0.14 -1.96 -0.15 0.00 0.04 0.00 0.00 34.50 32.28 2cv4 s PRO 172 CO 0.02 -1.17 0.94 0.00 0.04 0.00 0.00 177.00 176.82 2cv4 n ALA 173 N -2.24 -0.82 -1.30 8.56 0.00 -1.26 -1.90 120.51 121.56 2cv4 n ALA 173 Ca 0.10 0.41 -0.10 0.00 0.00 0.00 0.00 53.44 53.85 2cv4 n ALA 173 Cb 0.52 -1.94 -0.04 0.00 0.00 0.00 0.00 19.45 17.98 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 1.48 -4.92 -4.69 0.00 8.00 -1.26 -3.96 116.55 111.20 2cv4 n ASP 174 Ca 0.12 0.25 -0.41 0.00 0.71 0.00 0.00 54.79 55.46 2cv4 n ASP 174 Cb 0.29 -3.32 0.01 0.00 -0.02 0.00 0.00 41.12 38.08 2cv4 n ASP 174 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 2cv4 n TRP 175 N -2.47 2.00 0.54 1.24 -0.00 -0.80 -0.11 117.44 117.84 2cv4 n TRP 175 Ca -0.10 0.51 0.02 0.00 -0.00 0.00 0.00 57.50 57.93 2cv4 n TRP 175 Cb 0.45 -2.36 0.11 0.00 -0.00 0.00 0.00 31.31 29.52 2cv4 n TRP 175 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2cv4 n PRO 176 N 0.07 2.03 -1.57 5.87 -0.04 -1.26 -4.89 135.00 135.21 2cv4 n PRO 176 Ca 0.07 -0.85 -0.19 0.00 -0.04 0.00 0.00 63.50 62.48 2cv4 n PRO 176 Cb 0.39 -1.67 0.08 0.00 -0.04 0.00 0.00 33.50 32.26 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 0.17 4.60 -4.69 3.54 3.02 0.85 -2.98 115.26 119.76 2cv4 n ASN 177 Ca 0.08 -3.78 -0.44 0.00 -0.03 0.00 0.00 54.58 50.40 2cv4 n ASN 177 Cb 0.49 -0.51 -0.04 0.00 -0.61 0.00 0.00 39.78 39.11 2cv4 n ASN 177 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2cv4 n ASN 178 N -0.85 3.45 0.30 6.41 5.15 -0.44 -4.81 115.26 124.46 2cv4 n ASN 178 Ca 0.42 1.08 0.17 0.00 -0.60 0.00 0.00 54.58 55.65 2cv4 n ASN 178 Cb 0.90 -1.49 0.95 0.00 -0.53 0.00 0.00 39.78 39.61 2cv4 n ASN 178 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 2cv4 h GLU 179 N 6.20 0.00 0.08 1.20 5.08 -1.88 0.49 114.58 125.76 2cv4 h GLU 179 Ca -0.44 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 57.54 2cv4 h GLU 179 Cb 1.23 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.45 2cv4 h GLU 179 CO 0.91 0.03 -2.16 -0.89 -1.00 0.00 0.00 179.01 175.91 2cv4 n ILE 180 N -3.52 1.69 -1.15 3.13 5.41 -1.26 -4.67 119.36 119.00 2cv4 n ILE 180 Ca -0.02 -0.63 0.04 0.00 1.00 0.00 0.00 62.75 63.13 2cv4 n ILE 180 Cb 0.13 -1.63 0.05 0.00 -0.71 0.00 0.00 39.64 37.48 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 -3.41 0.85 0.00 1.39 -5.35 -1.21 -5.09 119.36 106.55 2cv4 n ILE 181 Ca -0.37 -0.99 0.00 0.00 -0.27 0.00 0.00 62.75 61.12 2cv4 n ILE 181 Cb 1.03 0.31 0.00 0.00 -1.74 0.00 0.00 39.64 39.24 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 -0.60 1.40 0.98 3.28 0.00 0.17 -0.48 105.19 109.94 2cv4 n GLY 182 Ca 0.06 0.51 0.12 0.00 0.00 0.00 0.00 46.02 46.71 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 0.00 2.29 -1.81 1.61 0.28 -1.16 -1.33 120.64 120.53 2cv4 n GLU 183 Ca 0.00 -1.93 -0.38 0.00 -0.16 0.00 0.00 57.16 54.69 2cv4 n GLU 183 Cb 0.00 -1.48 0.04 0.00 1.43 0.00 0.00 31.44 31.43 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 -1.61 2.88 0.07 -1.84 0.00 0.37 -4.85 107.32 102.33 2cv4 s GLY 184 Ca 0.36 1.29 0.03 0.00 0.00 0.00 0.00 44.72 46.40 2cv4 s GLY 184 CO 0.30 1.79 0.04 1.08 0.00 0.00 0.00 173.10 176.32 2cv4 s LEU 185 N -3.62 3.64 -0.05 0.66 1.43 -0.24 -4.50 118.68 116.00 2cv4 s LEU 185 Ca 0.73 -0.06 -0.17 0.00 -1.03 0.00 0.00 54.13 53.59 2cv4 s LEU 185 Cb -0.39 -2.30 -0.05 0.00 0.03 0.00 0.00 46.19 43.48 2cv4 s LEU 185 CO 0.46 0.19 0.48 -0.63 0.23 0.00 0.00 176.35 177.08 2cv4 s ILE 186 N -1.30 5.05 -0.05 -0.59 1.01 0.15 -1.72 121.20 123.74 2cv4 s ILE 186 Ca 0.26 0.98 -0.27 0.00 0.00 0.00 0.00 60.65 61.62 2cv4 s ILE 186 Cb -0.12 -3.81 -0.03 0.00 0.01 0.00 0.00 42.46 38.52 2cv4 s ILE 186 CO 0.18 0.44 0.87 -0.69 0.00 0.00 0.00 174.94 175.75 2cv4 s VAL 187 N -0.20 4.92 0.12 2.92 1.01 -0.14 -0.54 120.40 128.50 2cv4 s VAL 187 Ca 0.26 1.81 -0.35 0.00 0.00 0.00 0.00 61.98 63.70 2cv4 s VAL 187 Cb -0.16 -4.21 -0.16 0.00 0.00 0.00 0.00 36.38 31.85 2cv4 s VAL 187 CO 0.13 0.16 1.28 -2.65 0.00 0.00 0.00 175.10 174.03 2cv4 n PRO 188 N 4.11 1.21 -1.70 2.72 -0.02 -1.26 -4.54 135.00 135.52 2cv4 n PRO 188 Ca 0.04 0.43 -0.39 0.00 -2.02 0.00 0.00 63.50 61.56 2cv4 n PRO 188 Cb 0.51 -2.03 0.03 0.00 -0.02 0.00 0.00 33.50 31.99 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 2.26 1.58 -2.43 0.52 -0.02 -1.26 -4.97 135.00 130.68 2cv4 n PRO 189 Ca 0.17 0.58 -0.36 0.00 -2.02 0.00 0.00 63.50 61.86 2cv4 n PRO 189 Cb 0.22 -2.40 -0.03 0.00 -0.02 0.00 0.00 33.50 31.27 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 -2.60 3.94 0.00 0.52 0.02 -1.26 -4.96 135.00 130.66 2cv4 s PRO 190 Ca 0.69 1.60 0.09 0.00 0.02 0.00 0.00 61.00 63.39 2cv4 s PRO 190 Cb -0.45 -2.42 0.18 0.00 0.02 0.00 0.00 34.50 31.83 2cv4 s PRO 190 CO 0.52 -0.36 1.05 0.25 -0.33 0.00 0.00 177.00 178.13 2cv4 n THR 191 N -0.38 0.63 -4.13 0.99 -2.24 -1.26 -4.88 114.28 103.01 2cv4 n THR 191 Ca 0.07 -0.82 -0.09 0.00 -2.27 0.00 0.00 64.05 60.94 2cv4 n THR 191 Cb 0.49 0.75 -0.10 0.00 -2.10 0.00 0.00 70.33 69.38 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 -0.91 0.20 0.10 4.28 -4.23 -1.26 -5.05 115.64 108.77 2cv4 s THR 192 Ca 0.16 -1.87 -0.19 0.00 -1.18 0.00 0.00 61.69 58.60 2cv4 s THR 192 Cb 0.09 -1.80 -0.07 0.00 1.34 0.00 0.00 72.50 72.06 2cv4 s THR 192 CO 0.12 -0.72 1.66 -0.33 -0.54 0.00 0.00 174.62 174.81 2cv4 h GLU 193 N 2.99 0.34 -0.23 3.99 5.08 -1.99 -1.35 114.58 123.41 2cv4 h GLU 193 Ca -0.35 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 2cv4 h GLU 193 Cb 1.17 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 2cv4 h GLU 193 CO 0.62 0.37 0.15 -0.44 -1.00 0.00 0.00 179.01 178.71 2cv4 h ASP 194 N 0.23 0.27 -0.74 1.42 3.32 -2.00 -2.17 116.42 116.76 2cv4 h ASP 194 Ca 0.08 -0.02 0.06 0.00 0.02 0.00 0.00 57.03 57.17 2cv4 h ASP 194 Cb 0.15 -0.07 -0.06 0.00 0.22 0.00 0.00 39.33 39.57 2cv4 h ASP 194 CO -0.01 0.22 0.43 1.56 -1.72 0.00 0.00 179.24 179.71 2cv4 h GLN 195 N 0.30 0.75 -0.36 3.56 4.20 -1.94 -1.01 115.11 120.61 2cv4 h GLN 195 Ca 0.08 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 2cv4 h GLN 195 Cb -0.01 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.58 2cv4 h GLN 195 CO -0.02 0.50 0.21 0.00 -0.67 0.00 0.00 178.83 178.85 2cv4 h ALA 196 N 1.37 1.70 0.02 3.87 0.00 -0.86 -2.27 119.26 123.09 2cv4 h ALA 196 Ca 0.33 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2cv4 h ALA 196 Cb 0.20 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2cv4 h ALA 196 CO -0.19 0.27 -0.01 0.00 0.00 0.00 0.00 179.25 179.32 2cv4 h ARG 197 N 0.49 -0.03 0.00 0.00 3.08 -0.74 -3.15 114.38 114.03 2cv4 h ARG 197 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 2cv4 h ARG 197 Cb -0.01 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2cv4 h ARG 197 CO -0.02 0.64 0.23 0.00 -1.07 0.00 0.00 179.97 179.74 2cv4 h ALA 198 N 0.16 1.17 -2.86 0.04 0.00 -0.99 -3.50 119.26 113.28 2cv4 h ALA 198 Ca -0.00 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 2cv4 h ALA 198 Cb 0.68 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.40 2cv4 h ALA 198 CO 0.01 -0.17 -0.29 0.50 0.00 0.00 0.00 179.25 179.29 2cv4 s ARG 199 N -3.53 4.01 0.00 0.00 3.52 -0.88 -5.09 118.95 116.98 2cv4 s ARG 199 Ca -0.02 0.20 0.00 0.00 -0.13 0.00 0.00 55.73 55.78 2cv4 s ARG 199 Cb 0.05 -3.31 0.00 0.00 -1.56 0.00 0.00 34.95 30.13 2cv4 s ARG 199 CO 0.17 0.48 0.00 0.39 -0.81 0.00 0.00 175.30 175.54 2cv4 n GLU 201 N 2.69 0.00 -0.22 5.12 4.71 -1.26 -4.89 120.64 126.80 2cv4 n GLU 201 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.01 2cv4 n GLU 201 Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.96 2cv4 n GLU 201 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2cv4 n SER 202 N 0.00 0.00 0.00 1.62 2.88 -1.26 -2.76 113.62 114.10 2cv4 n SER 202 Ca 0.00 -0.44 0.00 0.00 -1.33 0.00 0.00 58.87 57.10 2cv4 n SER 202 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2cv4 n SER 202 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cv4 n GLY 203 N 5.00 0.61 0.00 0.46 0.00 -1.26 -4.44 105.19 105.56 2cv4 n GLY 203 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2cv4 n GLY 203 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2cv4 n GLN 204 N -1.96 0.00 0.00 1.61 1.13 -1.26 -5.05 117.38 111.84 2cv4 n GLN 204 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2cv4 n GLN 204 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 2cv4 n GLN 204 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2cv4 n TYR 205 N 0.00 0.00 -1.33 1.08 4.02 -1.11 -4.91 117.16 114.91 2cv4 n TYR 205 Ca 0.00 0.00 -0.45 0.00 -0.01 0.00 0.00 57.90 57.44 2cv4 n TYR 205 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.29 2cv4 n TYR 205 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2cv4 n ARG 206 N -0.16 0.00 -3.86 -0.72 5.12 -1.13 -4.45 116.66 111.46 2cv4 n ARG 206 Ca 0.00 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.80 2cv4 n ARG 206 Cb 0.00 -0.96 -0.12 0.00 -1.16 0.00 0.00 32.46 30.22 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 2.46 0.31 -3.64 0.00 4.77 -0.32 -5.00 117.00 115.57 2cv4 n LEU 208 Ca -0.16 -0.20 -0.01 0.00 -0.03 0.00 0.00 56.01 55.61 2cv4 n LEU 208 Cb 0.58 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.66 2cv4 n LEU 208 CO 0.22 0.08 0.96 -0.62 -1.33 0.00 0.00 177.39 176.70 2cv4 s ASP 209 N -3.37 -0.10 0.50 -1.43 -1.08 -1.24 -4.96 116.67 104.98 2cv4 s ASP 209 Ca -0.01 -0.18 0.34 0.00 -0.52 0.00 0.00 52.55 52.18 2cv4 s ASP 209 Cb 0.11 0.24 1.75 0.00 -1.46 0.00 0.00 42.92 43.57 2cv4 s ASP 209 CO 0.69 -0.45 2.03 4.11 0.52 0.00 0.00 175.17 182.07 2cv4 h TRP 210 N 2.00 0.00 -0.30 -5.34 5.08 -1.90 -1.57 115.95 113.93 2cv4 h TRP 210 Ca -0.27 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.70 2cv4 h TRP 210 Cb 1.21 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.37 2cv4 h TRP 210 CO 0.33 0.00 0.00 -2.67 -1.28 0.00 0.00 178.44 174.82 2cv4 n TRP 211 N -2.74 0.37 -3.58 0.12 4.27 -1.26 -4.55 117.44 110.08 2cv4 n TRP 211 Ca -0.01 -0.19 -0.28 0.00 -3.89 0.00 0.00 57.50 53.13 2cv4 n TRP 211 Cb 0.11 -0.00 -0.11 0.00 -1.36 0.00 0.00 31.31 29.95 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 -1.60 1.78 0.18 -2.67 2.19 -0.59 -4.67 117.98 112.60 2cv4 s PHE 212 Ca 0.36 -2.50 0.10 0.00 0.33 0.00 0.00 56.93 55.22 2cv4 s PHE 212 Cb 0.22 -1.51 -0.04 0.00 -1.31 0.00 0.00 43.02 40.38 2cv4 s PHE 212 CO 0.31 -0.76 -0.22 0.00 1.83 0.00 0.00 175.22 176.39 2cv4 s TRP 214 N -1.77 -0.47 0.06 0.00 1.48 -0.57 -0.97 118.94 116.70 2cv4 s TRP 214 Ca 0.18 0.23 0.01 0.00 -1.06 0.00 0.00 56.10 55.46 2cv4 s TRP 214 Cb -0.07 0.55 -0.00 0.00 -1.16 0.00 0.00 33.47 32.78 2cv4 s TRP 214 CO 0.08 -0.88 0.07 -0.40 -4.06 0.00 0.00 176.95 171.76 2cv4 n ASP 215 N -0.38 -0.17 -3.41 -2.66 5.75 -0.70 -2.86 116.55 112.12 2cv4 n ASP 215 Ca -0.16 -1.40 -0.26 0.00 -0.01 0.00 0.00 54.79 52.96 2cv4 n ASP 215 Cb 0.64 0.37 -0.08 0.00 -1.03 0.00 0.00 41.12 41.02 2cv4 n ASP 215 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2cv4 n THR 216 N -0.12 0.92 0.88 2.12 -2.24 -1.26 -1.08 114.28 113.51 2cv4 n THR 216 Ca 0.01 -4.60 0.13 0.00 -2.27 0.00 0.00 64.05 57.32 2cv4 n THR 216 Cb 0.11 -2.02 0.41 0.00 -2.10 0.00 0.00 70.33 66.73 2cv4 n THR 216 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2cv4 n PRO 217 N 1.38 0.08 -2.61 -0.78 -0.04 -1.26 -4.91 135.00 126.86 2cv4 n PRO 217 Ca 0.26 0.04 -0.41 0.00 -0.04 0.00 0.00 63.50 63.35 2cv4 n PRO 217 Cb 0.45 -1.57 -0.04 0.00 -0.04 0.00 0.00 33.50 32.29 2cv4 n PRO 217 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cv4 s ALA 218 N -3.04 3.33 0.95 0.55 0.00 -1.26 -5.03 121.76 117.26 2cv4 s ALA 218 Ca 0.11 0.72 -0.11 0.00 0.00 0.00 0.00 51.96 52.68 2cv4 s ALA 218 Cb 0.17 -3.31 0.16 0.00 0.00 0.00 0.00 23.12 20.14 2cv4 s ALA 218 CO 0.62 -0.09 1.09 -1.54 0.00 0.00 0.00 175.76 175.84 2cv4 s SER 219 N -0.27 2.82 0.45 0.00 1.04 -1.26 -4.83 113.70 111.65 2cv4 s SER 219 Ca 0.47 1.75 0.22 0.00 0.48 0.00 0.00 55.95 58.87 2cv4 s SER 219 Cb -0.27 -2.37 1.08 0.00 0.10 0.00 0.00 66.02 64.56 2cv4 s SER 219 CO 0.33 -3.09 1.93 -0.09 0.98 0.00 0.00 173.24 173.30 2cv4 h ARG 220 N -1.86 0.00 -0.00 4.02 2.43 -1.99 -2.31 114.38 114.67 2cv4 h ARG 220 Ca -0.50 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.43 2cv4 h ARG 220 Cb 1.28 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.85 2cv4 h ARG 220 CO 0.49 0.23 -0.99 -0.44 -1.51 0.00 0.00 179.97 177.76 2cv4 h ASP 221 N 0.00 0.70 -0.22 -3.80 3.32 -1.98 -0.49 116.42 113.95 2cv4 h ASP 221 Ca -0.00 -0.56 -0.02 0.00 0.02 0.00 0.00 57.03 56.47 2cv4 h ASP 221 Cb 0.55 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 2cv4 h ASP 221 CO 0.03 1.36 0.06 0.44 -1.72 0.00 0.00 179.24 179.41 2cv4 h ASP 222 N 0.30 0.34 -0.35 6.45 3.32 -1.88 0.35 116.42 124.95 2cv4 h ASP 222 Ca -0.10 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 56.71 2cv4 h ASP 222 Cb 1.63 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 41.07 2cv4 h ASP 222 CO 0.18 0.47 0.18 0.58 -1.72 0.00 0.00 179.24 178.93 2cv4 h VAL 223 N 0.18 1.15 -0.29 -1.35 2.07 -1.43 0.10 116.25 116.68 2cv4 h VAL 223 Ca 0.07 -0.43 -0.07 0.00 0.82 0.00 0.00 66.70 67.09 2cv4 h VAL 223 Cb 0.27 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 2cv4 h VAL 223 CO 0.00 0.16 -0.12 -0.08 0.02 0.00 0.00 177.57 177.55 2cv4 h GLU 224 N 0.44 0.49 -0.30 1.57 4.57 -0.92 0.38 114.58 120.82 2cv4 h GLU 224 Ca 0.12 -0.14 -0.06 0.00 -1.18 0.00 0.00 59.36 58.10 2cv4 h GLU 224 Cb 0.09 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.62 2cv4 h GLU 224 CO -0.02 0.61 -0.03 1.49 -1.18 0.00 0.00 179.01 179.88 2cv4 h GLU 225 N 0.46 0.55 -0.61 1.92 4.81 0.19 -0.34 114.58 121.56 2cv4 h GLU 225 Ca 0.08 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.11 2cv4 h GLU 225 Cb 0.49 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 2cv4 h GLU 225 CO 0.03 0.72 0.33 0.00 -0.73 0.00 0.00 179.01 179.36 2cv4 h ALA 226 N 0.81 0.78 -0.07 2.92 0.00 -0.41 -2.54 119.26 120.76 2cv4 h ALA 226 Ca 0.08 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2cv4 h ALA 226 Cb 0.49 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2cv4 h ALA 226 CO 0.02 0.30 -0.35 -0.09 0.00 0.00 0.00 179.25 179.13 2cv4 h ARG 227 N 0.83 0.13 -0.05 0.00 2.43 -0.74 -2.60 114.38 114.37 2cv4 h ARG 227 Ca 0.21 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.23 2cv4 h ARG 227 Cb 0.04 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 2cv4 h ARG 227 CO -0.03 0.47 -0.42 0.07 -1.51 0.00 0.00 179.97 178.55 2cv4 h ARG 228 N 0.12 0.12 -0.44 0.20 0.11 -0.63 -1.35 114.38 112.50 2cv4 h ARG 228 Ca 0.01 -0.05 0.05 0.00 0.10 0.00 0.00 59.98 60.09 2cv4 h ARG 228 Cb 0.68 -0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.71 2cv4 h ARG 228 CO 0.05 0.52 0.17 1.88 0.10 0.00 0.00 179.97 182.69 2cv4 h TYR 229 N 0.10 0.30 -0.64 4.08 0.05 -1.28 -0.75 116.97 118.83 2cv4 h TYR 229 Ca 0.01 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.72 2cv4 h TYR 229 Cb 0.79 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 38.44 2cv4 h TYR 229 CO 0.01 0.12 0.07 -0.07 -1.05 0.00 0.00 178.16 177.24 2cv4 h LEU 230 N 0.35 1.05 -0.69 3.88 4.07 -1.41 -1.45 115.31 121.11 2cv4 h LEU 230 Ca 0.20 -0.28 -0.07 0.00 0.08 0.00 0.00 57.88 57.81 2cv4 h LEU 230 Cb 0.17 -0.28 -0.03 0.00 1.08 0.00 0.00 40.66 41.61 2cv4 h LEU 230 CO -0.19 1.06 0.16 0.03 -1.08 0.00 0.00 178.44 178.42 2cv4 h ARG 231 N 1.00 1.11 -0.74 1.13 3.08 -0.73 -1.58 114.38 117.65 2cv4 h ARG 231 Ca 0.19 -0.27 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 2cv4 h ARG 231 Cb 0.48 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 2cv4 h ARG 231 CO 0.02 0.99 0.32 -0.09 -1.07 0.00 0.00 179.97 180.14 2cv4 h ARG 232 N 1.04 1.08 -0.37 0.04 2.43 -0.96 0.10 114.38 117.75 2cv4 h ARG 232 Ca 0.21 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 2cv4 h ARG 232 Cb 0.39 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 2cv4 h ARG 232 CO 0.00 0.87 0.16 0.00 -1.51 0.00 0.00 179.97 179.50 2cv4 h ALA 233 N 1.16 1.59 0.05 2.80 0.00 -0.88 -3.02 119.26 120.96 2cv4 h ALA 233 Ca 0.25 -0.09 -0.25 0.00 0.00 0.00 0.00 54.91 54.82 2cv4 h ALA 233 Cb 0.17 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2cv4 h ALA 233 CO -0.03 0.33 -1.22 0.00 0.00 0.00 0.00 179.25 178.33 2cv4 h ALA 234 N 1.66 0.33 -2.60 0.00 0.00 -0.22 -3.47 119.26 114.96 2cv4 h ALA 234 Ca 0.13 -1.00 -0.49 0.00 0.00 0.00 0.00 54.91 53.54 2cv4 h ALA 234 Cb 0.09 0.02 0.04 0.00 0.00 0.00 0.00 17.79 17.94 2cv4 h ALA 234 CO -0.02 1.21 0.45 -1.21 0.00 0.00 0.00 179.25 179.68 2cv4 s GLU 235 N -2.67 4.00 0.03 0.00 2.02 0.24 -5.01 118.70 117.31 2cv4 s GLU 235 Ca -0.02 1.65 -0.28 0.00 0.02 0.00 0.00 54.97 56.33 2cv4 s GLU 235 Cb 0.09 -2.50 -0.04 0.00 0.10 0.00 0.00 34.13 31.77 2cv4 s GLU 235 CO 0.84 -0.32 0.91 0.21 0.02 0.00 0.00 175.26 176.92 2cv4 s LYS 236 N -2.55 4.58 0.26 1.61 2.20 -1.26 -4.98 119.74 119.59 2cv4 s LYS 236 Ca 0.60 1.31 -0.30 0.00 -0.36 0.00 0.00 55.97 57.22 2cv4 s LYS 236 Cb -0.25 -3.42 -0.11 0.00 -1.51 0.00 0.00 37.83 32.54 2cv4 s LYS 236 CO 0.31 0.09 1.52 -2.14 -0.36 0.00 0.00 175.35 174.77 2cv4 s PRO 237 N 0.55 4.20 -0.06 4.03 0.02 -1.26 -4.89 135.00 137.59 2cv4 s PRO 237 Ca 0.47 2.43 0.03 0.00 0.02 0.00 0.00 61.00 63.95 2cv4 s PRO 237 Cb -0.21 -3.08 0.21 0.00 0.02 0.00 0.00 34.50 31.44 2cv4 s PRO 237 CO 0.27 -0.53 0.84 0.00 -0.33 0.00 0.00 177.00 177.25 2cv4 n ALA 238 N 2.49 2.88 0.04 -1.55 0.00 -1.26 -4.54 120.51 118.58 2cv4 n ALA 238 Ca 0.08 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.02 2cv4 n ALA 238 Cb 0.39 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.80 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 0.16 0.00 -0.93 0.00 4.81 -1.26 -5.16 118.16 115.78 2cv4 n LYS 239 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.52 2cv4 n LYS 239 Cb 0.51 -0.01 0.00 0.00 0.02 0.00 0.00 35.03 35.56 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 -2.79 -2.44 0.00 3.14 4.77 -1.26 -5.31 117.00 113.10 2cv4 n LEU 240 Ca 0.00 0.30 0.10 0.00 -0.03 0.00 0.00 56.01 56.38 2cv4 n LEU 240 Cb 0.00 -1.22 0.59 0.00 -2.33 0.00 0.00 43.42 40.46 2cv4 n LEU 240 CO 0.00 -0.24 0.78 0.18 -1.33 0.00 0.00 177.39 176.78