#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 0.12 -0.06 0.55 0.00 -1.26 -5.11 107.32 101.57 2cv4 s GLY 3 Ca 0.00 -0.60 -0.27 0.00 0.00 0.00 0.00 44.72 43.85 2cv4 s GLY 3 CO 0.00 -0.74 0.87 -0.45 0.00 0.00 0.00 173.10 172.79 2cv4 s SER 4 N -2.88 7.18 0.22 1.64 0.15 -1.26 -5.09 113.70 113.66 2cv4 s SER 4 Ca 0.07 1.43 0.02 0.00 0.70 0.00 0.00 55.95 58.18 2cv4 s SER 4 Cb 0.04 -2.50 -0.05 0.00 -1.71 0.00 0.00 66.02 61.80 2cv4 s SER 4 CO -0.09 -0.25 0.03 0.27 1.20 0.00 0.00 173.24 174.39 2cv4 s ILE 5 N 1.21 0.79 0.95 6.45 -4.36 -1.26 -3.95 121.20 121.03 2cv4 s ILE 5 Ca 0.45 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.71 2cv4 s ILE 5 Cb -0.19 -2.35 0.16 0.00 1.25 0.00 0.00 42.46 41.33 2cv4 s ILE 5 CO 0.22 -0.29 1.12 -2.84 0.24 0.00 0.00 174.94 173.38 2cv4 s PRO 6 N -3.93 0.86 0.09 0.37 0.02 -1.26 -5.01 135.00 126.14 2cv4 s PRO 6 Ca 0.29 0.40 0.05 0.00 0.02 0.00 0.00 61.00 61.77 2cv4 s PRO 6 Cb 0.06 -1.80 -0.03 0.00 0.02 0.00 0.00 34.50 32.76 2cv4 s PRO 6 CO 0.08 -2.42 -0.14 -0.51 -0.33 0.00 0.00 177.00 173.69 2cv4 s LEU 7 N -6.21 2.32 0.13 -5.54 1.43 -1.26 -5.08 118.68 104.47 2cv4 s LEU 7 Ca 0.64 -0.69 -0.35 0.00 -1.03 0.00 0.00 54.13 52.71 2cv4 s LEU 7 Cb -0.16 -0.52 -0.16 0.00 0.03 0.00 0.00 46.19 45.38 2cv4 s LEU 7 CO 0.55 -0.11 1.30 -0.38 0.23 0.00 0.00 176.35 177.95 2cv4 n ILE 8 N 1.01 0.35 0.00 -0.59 5.41 -1.26 -0.95 119.36 123.33 2cv4 n ILE 8 Ca -0.19 -0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.47 2cv4 n ILE 8 Cb 0.55 -0.92 0.00 0.00 -0.71 0.00 0.00 39.64 38.56 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 2.41 2.83 3.90 7.39 0.00 -0.31 -5.02 105.19 116.40 2cv4 n GLY 9 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.93 3.57 0.35 1.61 2.02 -0.13 -4.80 118.70 120.39 2cv4 s GLU 10 Ca 0.00 0.21 -0.26 0.00 0.02 0.00 0.00 54.97 54.95 2cv4 s GLU 10 Cb 0.00 -2.39 -0.09 0.00 0.10 0.00 0.00 34.13 31.74 2cv4 s GLU 10 CO 0.00 -0.16 1.00 0.50 0.02 0.00 0.00 175.26 176.62 2cv4 s ARG 11 N -4.58 4.41 0.07 1.61 3.52 -1.26 -1.63 118.95 121.09 2cv4 s ARG 11 Ca 0.47 1.45 -0.31 0.00 -0.13 0.00 0.00 55.73 57.22 2cv4 s ARG 11 Cb -0.10 -2.73 -0.08 0.00 -1.56 0.00 0.00 34.95 30.47 2cv4 s ARG 11 CO 0.42 0.10 1.66 0.12 -0.81 0.00 0.00 175.30 176.79 2cv4 s PHE 12 N -1.59 2.40 0.17 5.12 2.19 0.34 -4.84 117.98 121.77 2cv4 s PHE 12 Ca 0.53 0.30 -0.31 0.00 0.33 0.00 0.00 56.93 57.77 2cv4 s PHE 12 Cb -0.21 -3.98 -0.17 0.00 -1.31 0.00 0.00 43.02 37.35 2cv4 s PHE 12 CO 0.27 -3.93 0.86 -2.30 1.83 0.00 0.00 175.22 171.95 2cv4 n PRO 13 N 5.61 0.49 -2.43 10.12 -0.02 -1.26 -4.49 135.00 143.02 2cv4 n PRO 13 Ca 0.16 0.17 -0.34 0.00 -2.02 0.00 0.00 63.50 61.47 2cv4 n PRO 13 Cb 0.40 -1.45 -0.02 0.00 -0.02 0.00 0.00 33.50 32.41 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 -0.74 3.66 -0.04 -0.52 2.12 -1.26 -4.39 118.70 117.54 2cv4 s GLU 14 Ca 0.71 1.38 0.04 0.00 0.36 0.00 0.00 54.97 57.46 2cv4 s GLU 14 Cb -0.94 -2.07 -0.00 0.00 0.26 0.00 0.00 34.13 31.37 2cv4 s GLU 14 CO 0.56 -0.55 -0.16 -1.21 -0.54 0.00 0.00 175.26 173.35 2cv4 s GLU 16 N -3.36 1.61 0.08 4.30 2.02 -1.26 -4.99 118.70 117.10 2cv4 s GLU 16 Ca 0.68 -0.57 0.04 0.00 0.02 0.00 0.00 54.97 55.13 2cv4 s GLU 16 Cb -0.18 -1.44 -0.03 0.00 0.10 0.00 0.00 34.13 32.59 2cv4 s GLU 16 CO 0.23 0.25 -0.12 0.14 0.02 0.00 0.00 175.26 175.79 2cv4 s VAL 17 N -0.03 0.97 -0.18 2.63 -7.23 0.46 -4.96 120.40 112.06 2cv4 s VAL 17 Ca -0.02 -1.45 -0.12 0.00 -1.81 0.00 0.00 61.98 58.58 2cv4 s VAL 17 Cb -0.10 -1.16 -0.05 0.00 0.56 0.00 0.00 36.38 35.63 2cv4 s VAL 17 CO 0.01 -0.40 0.24 -0.89 -0.31 0.00 0.00 175.10 173.75 2cv4 s THR 18 N -1.85 5.34 0.34 5.32 2.01 -1.26 -1.27 115.64 124.26 2cv4 s THR 18 Ca 0.01 0.41 0.03 0.00 0.31 0.00 0.00 61.69 62.45 2cv4 s THR 18 Cb -0.07 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 2cv4 s THR 18 CO 0.01 0.39 0.11 0.42 -0.69 0.00 0.00 174.62 174.86 2cv4 s THR 19 N 0.56 0.72 0.46 -0.82 -4.23 -0.65 -0.98 115.64 110.71 2cv4 s THR 19 Ca 0.13 -2.00 0.36 0.00 -1.18 0.00 0.00 61.69 59.00 2cv4 s THR 19 Cb -0.12 -2.57 0.55 0.00 1.34 0.00 0.00 72.50 71.69 2cv4 s THR 19 CO 0.02 0.00 1.58 0.44 -0.54 0.00 0.00 174.62 176.12 2cv4 h ASP 20 N 2.08 0.16 -0.14 3.99 5.19 -1.45 0.52 116.42 126.77 2cv4 h ASP 20 Ca -0.37 0.13 0.00 0.00 -0.62 0.00 0.00 57.03 56.17 2cv4 h ASP 20 Cb 1.26 0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.90 2cv4 h ASP 20 CO 0.61 -0.22 0.00 1.41 -3.12 0.00 0.00 179.24 177.92 2cv4 n HIS 21 N -4.60 0.17 0.00 4.55 8.25 -1.26 -4.95 115.22 117.39 2cv4 n HIS 21 Ca 0.41 -0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.69 2cv4 n HIS 21 Cb 1.65 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 32.75 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 0.62 0.86 3.77 -1.41 0.00 0.17 -5.04 105.19 104.16 2cv4 n GLY 22 Ca 0.09 -2.33 -0.38 0.00 0.00 0.00 0.00 46.02 43.40 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 -0.96 3.62 -0.03 1.61 1.01 -1.26 -1.64 120.40 122.75 2cv4 s VAL 23 Ca 0.00 1.39 -0.09 0.00 0.00 0.00 0.00 61.98 63.28 2cv4 s VAL 23 Cb 0.00 -3.80 0.01 0.00 0.00 0.00 0.00 36.38 32.60 2cv4 s VAL 23 CO 0.00 0.16 0.20 -0.63 0.00 0.00 0.00 175.10 174.82 2cv4 s ILE 24 N -1.45 0.05 -0.15 2.22 1.01 -0.40 -4.94 121.20 117.54 2cv4 s ILE 24 Ca 0.52 -0.45 -0.05 0.00 0.00 0.00 0.00 60.65 60.68 2cv4 s ILE 24 Cb -0.26 -0.44 -0.03 0.00 0.01 0.00 0.00 42.46 41.74 2cv4 s ILE 24 CO 0.33 -0.25 0.01 -0.75 0.00 0.00 0.00 174.94 174.28 2cv4 s LYS 25 N -0.95 3.65 -0.06 2.79 2.20 -1.26 -0.40 119.74 125.70 2cv4 s LYS 25 Ca -0.10 -0.43 -0.00 0.00 -0.36 0.00 0.00 55.97 55.08 2cv4 s LYS 25 Cb -0.05 -3.00 -0.03 0.00 -1.51 0.00 0.00 37.83 33.23 2cv4 s LYS 25 CO 0.02 0.35 -0.03 -0.51 -0.36 0.00 0.00 175.35 174.82 2cv4 s LEU 26 N 0.10 3.37 0.00 5.43 1.43 -1.26 -0.83 118.68 126.91 2cv4 s LEU 26 Ca 0.02 0.04 0.23 0.00 -1.03 0.00 0.00 54.13 53.39 2cv4 s LEU 26 Cb -0.13 -1.79 0.54 0.00 0.03 0.00 0.00 46.19 44.84 2cv4 s LEU 26 CO 0.02 0.35 1.45 -0.81 0.23 0.00 0.00 176.35 177.59 2cv4 n PRO 27 N 2.05 2.16 -0.30 1.29 -0.04 -1.26 -4.15 135.00 134.74 2cv4 n PRO 27 Ca -0.18 -1.73 0.13 0.00 -0.04 0.00 0.00 63.50 61.69 2cv4 n PRO 27 Cb 0.53 -1.47 0.29 0.00 -0.04 0.00 0.00 33.50 32.82 2cv4 n PRO 27 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2cv4 h ASP 28 N 3.66 -0.06 -0.76 3.54 5.19 -1.95 -0.51 116.42 125.52 2cv4 h ASP 28 Ca 0.00 0.21 0.17 0.00 -0.62 0.00 0.00 57.03 56.79 2cv4 h ASP 28 Cb 0.80 0.30 -0.05 0.00 0.18 0.00 0.00 39.33 40.55 2cv4 h ASP 28 CO 0.00 -0.19 0.51 -0.74 -3.12 0.00 0.00 179.24 175.70 2cv4 h HIS 29 N 0.17 0.39 0.04 4.55 2.76 -1.34 0.12 115.15 121.84 2cv4 h HIS 29 Ca 0.56 0.01 -0.37 0.00 -2.20 0.00 0.00 60.37 58.37 2cv4 h HIS 29 Cb 1.14 -0.12 -0.05 0.00 1.55 0.00 0.00 27.41 29.93 2cv4 h HIS 29 CO -0.29 0.14 -2.24 0.66 -1.30 0.00 0.00 177.93 174.90 2cv4 n TYR 30 N -4.45 0.49 -0.02 5.26 4.01 -0.31 -4.24 117.16 117.89 2cv4 n TYR 30 Ca 0.15 0.12 -0.09 0.00 -0.16 0.00 0.00 57.90 57.92 2cv4 n TYR 30 Cb 0.60 -1.07 -0.02 0.00 -0.31 0.00 0.00 39.34 38.54 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 0.02 0.62 0.00 -0.72 2.07 -0.98 -0.11 116.25 117.16 2cv4 h VAL 31 Ca -0.50 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.02 2cv4 h VAL 31 Cb 2.01 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.40 2cv4 h VAL 31 CO 0.00 0.00 0.09 -1.54 0.02 0.00 0.00 177.57 176.14 2cv4 n SER 32 N -5.29 0.15 -0.57 0.57 3.41 0.39 0.86 113.62 113.16 2cv4 n SER 32 Ca -0.02 0.51 0.07 0.00 -0.26 0.00 0.00 58.87 59.16 2cv4 n SER 32 Cb 0.20 -0.51 0.07 0.00 -0.26 0.00 0.00 64.21 63.71 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 -1.67 1.05 -2.20 4.33 6.02 -0.38 -4.94 117.38 119.60 2cv4 n GLN 33 Ca -0.00 -1.38 -0.12 0.00 -0.01 0.00 0.00 57.00 55.48 2cv4 n GLN 33 Cb 0.10 -1.27 -0.01 0.00 1.02 0.00 0.00 30.24 30.08 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 0.77 -0.08 3.64 1.08 0.00 0.25 -5.01 105.19 105.84 2cv4 n GLY 34 Ca 0.08 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 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 -4.54 2.48 0.51 1.61 1.02 -0.19 -4.83 119.74 115.80 2cv4 s LYS 35 Ca 0.00 -0.82 -0.05 0.00 0.02 0.00 0.00 55.97 55.12 2cv4 s LYS 35 Cb 0.00 -2.49 -0.02 0.00 -0.52 0.00 0.00 37.83 34.80 2cv4 s LYS 35 CO 0.00 0.56 0.81 -1.58 -0.92 0.00 0.00 175.35 174.22 2cv4 s TRP 36 N -1.18 3.43 -0.04 3.18 0.52 -1.02 -4.05 118.94 119.78 2cv4 s TRP 36 Ca 0.22 0.70 -0.10 0.00 0.02 0.00 0.00 56.10 56.94 2cv4 s TRP 36 Cb -0.11 -2.44 0.02 0.00 -1.15 0.00 0.00 33.47 29.78 2cv4 s TRP 36 CO 0.13 -0.46 0.23 -0.59 0.02 0.00 0.00 176.95 176.28 2cv4 s PHE 37 N -2.80 -0.14 -0.25 -1.98 -0.71 -0.69 -0.91 117.98 110.50 2cv4 s PHE 37 Ca 0.49 0.28 -0.05 0.00 -1.04 0.00 0.00 56.93 56.61 2cv4 s PHE 37 Cb -0.10 0.05 -0.01 0.00 -1.21 0.00 0.00 43.02 41.75 2cv4 s PHE 37 CO 0.44 -0.26 0.02 0.08 -1.34 0.00 0.00 175.22 174.16 2cv4 s VAL 38 N -0.81 3.73 -0.21 -2.49 1.01 -0.08 -0.97 120.40 120.58 2cv4 s VAL 38 Ca -0.09 -0.50 -0.04 0.00 0.00 0.00 0.00 61.98 61.35 2cv4 s VAL 38 Cb -0.05 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.53 2cv4 s VAL 38 CO 0.02 0.30 -0.02 -0.22 0.00 0.00 0.00 175.10 175.17 2cv4 s LEU 39 N 1.51 3.08 0.06 3.92 0.20 -0.29 -1.87 118.68 125.29 2cv4 s LEU 39 Ca 0.05 -0.29 0.09 0.00 0.69 0.00 0.00 54.13 54.67 2cv4 s LEU 39 Cb -0.15 -1.78 -0.03 0.00 -0.43 0.00 0.00 46.19 43.80 2cv4 s LEU 39 CO -0.00 0.03 -0.24 0.72 -0.29 0.00 0.00 176.35 176.56 2cv4 s PHE 40 N 1.20 2.13 0.31 5.38 -0.12 -0.72 -0.72 117.98 125.44 2cv4 s PHE 40 Ca 0.03 -0.40 0.09 0.00 -0.05 0.00 0.00 56.93 56.60 2cv4 s PHE 40 Cb -0.14 -1.25 -0.04 0.00 -0.63 0.00 0.00 43.02 40.95 2cv4 s PHE 40 CO 0.00 0.15 0.08 -1.54 -0.05 0.00 0.00 175.22 173.86 2cv4 s SER 41 N -1.36 4.63 -0.11 1.98 1.04 -0.33 -0.89 113.70 118.67 2cv4 s SER 41 Ca 0.10 -0.72 -0.14 0.00 0.48 0.00 0.00 55.95 55.67 2cv4 s SER 41 Cb -0.10 -0.79 0.03 0.00 0.10 0.00 0.00 66.02 65.27 2cv4 s SER 41 CO 0.03 -0.18 0.37 -1.38 0.98 0.00 0.00 173.24 173.06 2cv4 s HIS 42 N -2.38 -0.36 0.25 5.02 -3.43 0.95 -4.02 115.29 111.31 2cv4 s HIS 42 Ca 0.35 0.83 -0.04 0.00 -0.80 0.00 0.00 55.06 55.40 2cv4 s HIS 42 Cb -0.04 0.14 0.36 0.00 -1.43 0.00 0.00 32.58 31.62 2cv4 s HIS 42 CO 0.22 -0.27 1.87 -1.00 -2.00 0.00 0.00 174.74 173.55 2cv4 h PRO 43 N 5.00 1.04 -1.77 -0.38 0.13 -1.69 -3.38 132.00 130.96 2cv4 h PRO 43 Ca -0.27 -0.06 0.02 0.00 -0.87 0.00 0.00 66.00 64.81 2cv4 h PRO 43 Cb 1.18 -0.23 -0.24 0.00 0.13 0.00 0.00 31.00 31.84 2cv4 h PRO 43 CO 0.31 0.69 0.33 0.00 -0.23 0.00 0.00 178.00 179.09 2cv4 s ALA 44 N -6.05 -1.89 0.72 -0.56 0.00 -1.26 -4.33 121.76 108.39 2cv4 s ALA 44 Ca -0.13 1.88 -0.16 0.00 0.00 0.00 0.00 51.96 53.56 2cv4 s ALA 44 Cb 0.19 -1.22 0.03 0.00 0.00 0.00 0.00 23.12 22.12 2cv4 s ALA 44 CO 0.80 -0.29 1.25 -0.51 0.00 0.00 0.00 175.76 177.02 2cv4 s ASP 45 N 0.12 4.16 -1.11 0.00 1.11 -1.26 -3.35 116.67 116.34 2cv4 s ASP 45 Ca 0.01 2.50 -0.06 0.00 0.18 0.00 0.00 52.55 55.18 2cv4 s ASP 45 Cb -0.04 -2.60 0.01 0.00 1.07 0.00 0.00 42.92 41.35 2cv4 s ASP 45 CO -0.02 -2.29 0.96 0.49 1.18 0.00 0.00 175.17 175.49 2cv4 n PHE 46 N -2.53 -2.30 -4.80 4.23 3.01 -1.26 -5.01 117.46 108.80 2cv4 n PHE 46 Ca 0.15 0.84 -0.24 0.00 1.01 0.00 0.00 57.45 59.21 2cv4 n PHE 46 Cb 0.49 -4.45 -0.15 0.00 -0.01 0.00 0.00 39.48 35.36 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 1.35 0.11 4.37 -4.23 -1.21 -5.08 115.64 107.67 2cv4 s THR 47 Ca 0.38 -0.75 -0.34 0.00 -1.18 0.00 0.00 61.69 59.80 2cv4 s THR 47 Cb -0.17 -1.13 -0.13 0.00 1.34 0.00 0.00 72.50 72.41 2cv4 s THR 47 CO 0.61 0.37 1.56 1.55 -0.54 0.00 0.00 174.62 178.17 2cv4 h PRO 48 N 5.68 -0.62 -0.70 3.99 0.13 -1.94 -0.87 132.00 137.66 2cv4 h PRO 48 Ca -0.37 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2cv4 h PRO 48 Cb 1.15 0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2cv4 h PRO 48 CO 0.48 -0.42 0.00 0.28 -0.23 0.00 0.00 178.00 178.12 2cv4 n VAL 49 N -5.45 0.00 0.00 1.56 0.31 -1.26 -1.24 118.33 112.25 2cv4 n VAL 49 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 2cv4 n VAL 49 Cb 0.39 -0.18 0.00 0.00 -0.91 0.00 0.00 33.84 33.14 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 0.67 0.00 -0.10 2.52 -1.04 -0.33 -1.46 114.28 114.54 2cv4 n THR 51 Ca 0.00 0.00 0.08 0.00 -2.04 0.00 0.00 64.05 62.09 2cv4 n THR 51 Cb 0.00 0.00 0.43 0.00 -1.82 0.00 0.00 70.33 68.95 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 0.99 -0.09 12.58 1.35 -1.45 -2.30 112.91 123.98 2cv4 h THR 52 Ca 0.00 -0.19 -0.02 0.00 -0.55 0.00 0.00 66.41 65.65 2cv4 h THR 52 Cb 0.00 0.38 -0.00 0.00 -1.73 0.00 0.00 68.15 66.80 2cv4 h THR 52 CO 0.00 0.10 -0.03 -0.33 -0.25 0.00 0.00 175.52 175.01 2cv4 h GLU 53 N 0.56 0.19 -0.70 4.72 5.08 -1.53 -1.92 114.58 120.99 2cv4 h GLU 53 Ca 0.26 -0.07 0.08 0.00 -1.00 0.00 0.00 59.36 58.62 2cv4 h GLU 53 Cb 0.30 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.48 2cv4 h GLU 53 CO -0.08 0.52 0.36 0.74 -1.00 0.00 0.00 179.01 179.55 2cv4 h PHE 54 N -0.16 0.65 -0.67 4.33 -1.00 -1.75 0.25 116.94 118.60 2cv4 h PHE 54 Ca 0.02 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.82 2cv4 h PHE 54 Cb 0.45 -0.19 -0.03 0.00 3.61 0.00 0.00 35.95 39.79 2cv4 h PHE 54 CO 0.06 0.26 0.40 0.28 -1.61 0.00 0.00 178.31 177.70 2cv4 h VAL 55 N 0.63 1.20 -0.77 -0.55 2.07 -1.41 0.16 116.25 117.58 2cv4 h VAL 55 Ca 0.33 -0.45 -0.04 0.00 0.82 0.00 0.00 66.70 67.36 2cv4 h VAL 55 Cb 0.30 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 2cv4 h VAL 55 CO -0.24 0.21 0.31 -1.28 0.02 0.00 0.00 177.57 176.59 2cv4 h SER 56 N 0.92 1.06 -0.37 0.57 0.87 -0.42 0.23 113.55 116.41 2cv4 h SER 56 Ca 0.24 -0.17 -0.08 0.00 -1.23 0.00 0.00 61.79 60.55 2cv4 h SER 56 Cb -0.01 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.66 2cv4 h SER 56 CO -0.04 0.94 -0.07 -0.26 -0.53 0.00 0.00 176.83 176.87 2cv4 h PHE 57 N 1.11 0.77 -0.69 2.24 0.04 -0.40 -1.56 116.94 118.44 2cv4 h PHE 57 Ca 0.26 -0.16 -0.01 0.00 2.80 0.00 0.00 57.97 60.86 2cv4 h PHE 57 Cb 0.21 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 38.14 2cv4 h PHE 57 CO 0.02 0.83 0.41 0.00 -0.60 0.00 0.00 178.31 178.97 2cv4 h ALA 58 N 0.83 0.88 -0.41 2.45 0.00 -0.36 -0.29 119.26 122.37 2cv4 h ALA 58 Ca 0.10 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2cv4 h ALA 58 Cb 0.57 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2cv4 h ALA 58 CO 0.03 0.37 0.10 0.00 0.00 0.00 0.00 179.25 179.75 2cv4 h ARG 59 N 0.94 0.60 -0.44 0.00 2.47 -0.37 -2.36 114.38 115.23 2cv4 h ARG 59 Ca 0.25 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 58.87 2cv4 h ARG 59 Cb -0.01 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.21 2cv4 h ARG 59 CO -0.04 0.55 0.00 0.54 0.56 0.00 0.00 179.97 181.57 2cv4 n ARG 60 N -4.33 2.04 -0.25 0.04 1.74 -0.60 -4.54 116.66 110.77 2cv4 n ARG 60 Ca 0.03 -1.61 0.04 0.00 -0.77 0.00 0.00 57.85 55.53 2cv4 n ARG 60 Cb 0.19 -1.36 0.28 0.00 -1.02 0.00 0.00 32.46 30.55 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 2.66 0.94 -0.62 -1.55 5.03 -0.51 -1.25 116.97 121.67 2cv4 h TYR 61 Ca 0.00 0.02 -0.07 0.00 2.58 0.00 0.00 58.73 61.26 2cv4 h TYR 61 Cb 0.61 -0.31 -0.02 0.00 1.55 0.00 0.00 36.73 38.55 2cv4 h TYR 61 CO 0.29 0.51 0.11 0.93 -1.32 0.00 0.00 178.16 178.69 2cv4 h GLU 62 N 0.94 1.01 -0.65 1.82 4.39 -1.82 -1.50 114.58 118.78 2cv4 h GLU 62 Ca 0.34 -0.26 0.04 0.00 0.34 0.00 0.00 59.36 59.81 2cv4 h GLU 62 Cb 0.15 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 28.64 2cv4 h GLU 62 CO -0.11 0.94 0.43 -0.44 -1.16 0.00 0.00 179.01 178.67 2cv4 h ASP 63 N 0.92 0.66 -0.12 1.42 3.32 -1.57 0.24 116.42 121.29 2cv4 h ASP 63 Ca 0.19 -0.01 -0.22 0.00 0.02 0.00 0.00 57.03 57.01 2cv4 h ASP 63 Cb 0.41 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 39.82 2cv4 h ASP 63 CO 0.01 0.45 -0.78 -0.26 -1.72 0.00 0.00 179.24 176.94 2cv4 h PHE 64 N 0.76 1.01 -0.47 4.55 0.04 -0.92 -3.18 116.94 118.73 2cv4 h PHE 64 Ca 0.26 -0.47 -0.10 0.00 2.80 0.00 0.00 57.97 60.47 2cv4 h PHE 64 Cb 0.09 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.07 2cv4 h PHE 64 CO -0.00 1.29 -0.09 1.96 -0.60 0.00 0.00 178.31 180.87 2cv4 h GLN 65 N 0.44 0.85 -0.90 1.51 1.08 -0.83 0.79 115.11 118.05 2cv4 h GLN 65 Ca -0.06 -0.28 0.19 0.00 -1.45 0.00 0.00 58.65 57.05 2cv4 h GLN 65 Cb 1.42 -0.07 -0.07 0.00 -0.05 0.00 0.00 27.48 28.71 2cv4 h GLN 65 CO 0.16 0.91 0.59 0.00 -0.95 0.00 0.00 178.83 179.54 2cv4 h ARG 66 N 0.77 0.46 -0.02 1.46 3.08 -0.52 0.64 114.38 120.26 2cv4 h ARG 66 Ca 0.13 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2cv4 h ARG 66 Cb 0.59 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.54 2cv4 h ARG 66 CO 0.04 0.30 0.00 1.28 -1.07 0.00 0.00 179.97 180.52 2cv4 n LEU 67 N -4.54 1.25 -0.50 3.04 4.77 -0.87 -4.92 117.00 115.23 2cv4 n LEU 67 Ca 0.19 -0.42 -0.04 0.00 -0.03 0.00 0.00 56.01 55.71 2cv4 n LEU 67 Cb 0.65 -0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.74 2cv4 n LEU 67 CO 0.30 0.21 -0.04 0.61 -1.33 0.00 0.00 177.39 177.14 2cv4 n GLY 68 N 1.14 0.25 3.16 -0.72 0.00 0.22 -4.95 105.19 104.30 2cv4 n GLY 68 Ca 0.20 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.27 1.96 0.44 1.61 1.01 0.22 -2.45 120.40 120.91 2cv4 s VAL 69 Ca 0.01 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 2cv4 s VAL 69 Cb -0.00 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.62 2cv4 s VAL 69 CO 0.01 0.53 0.69 -1.81 0.00 0.00 0.00 175.10 174.52 2cv4 s ASP 70 N 0.73 6.10 0.03 3.32 1.01 -0.09 -3.75 116.67 124.03 2cv4 s ASP 70 Ca -0.10 0.58 0.09 0.00 0.71 0.00 0.00 52.55 53.83 2cv4 s ASP 70 Cb -0.16 -1.94 -0.03 0.00 1.01 0.00 0.00 42.92 41.80 2cv4 s ASP 70 CO 0.01 -0.56 -0.26 -0.76 0.21 0.00 0.00 175.17 173.81 2cv4 s LEU 71 N -4.57 2.18 -0.18 1.23 1.43 -1.26 -0.91 118.68 116.60 2cv4 s LEU 71 Ca 0.46 -0.56 -0.11 0.00 -1.03 0.00 0.00 54.13 52.89 2cv4 s LEU 71 Cb -0.10 -1.31 0.06 0.00 0.03 0.00 0.00 46.19 44.87 2cv4 s LEU 71 CO 0.40 0.27 0.45 -0.51 0.23 0.00 0.00 176.35 177.19 2cv4 s ILE 72 N -0.78 -0.02 0.56 -0.59 2.07 -0.78 -4.28 121.20 117.38 2cv4 s ILE 72 Ca 0.12 0.07 0.08 0.00 -1.41 0.00 0.00 60.65 59.51 2cv4 s ILE 72 Cb -0.10 -0.66 0.08 0.00 0.13 0.00 0.00 42.46 41.91 2cv4 s ILE 72 CO 0.02 0.03 0.77 -0.83 -1.91 0.00 0.00 174.94 173.02 2cv4 s GLY 73 N 1.33 1.77 -0.22 1.50 0.00 -0.46 -1.76 107.32 109.49 2cv4 s GLY 73 Ca -0.09 -2.01 -0.12 0.00 0.00 0.00 0.00 44.72 42.50 2cv4 s GLY 73 CO -0.13 -1.59 0.53 -2.27 0.00 0.00 0.00 173.10 169.65 2cv4 s LEU 74 N -4.66 -0.48 0.11 0.66 0.20 -0.07 0.27 118.68 114.70 2cv4 s LEU 74 Ca 0.61 1.17 -0.06 0.00 0.69 0.00 0.00 54.13 56.54 2cv4 s LEU 74 Cb -0.06 1.80 -0.01 0.00 -0.43 0.00 0.00 46.19 47.48 2cv4 s LEU 74 CO 0.38 -0.21 0.16 -0.55 -0.29 0.00 0.00 176.35 175.84 2cv4 s SER 75 N 1.53 0.19 0.36 3.68 0.15 -1.03 -0.04 113.70 118.54 2cv4 s SER 75 Ca -0.10 -0.84 0.19 0.00 0.70 0.00 0.00 55.95 55.91 2cv4 s SER 75 Cb -0.07 0.34 0.38 0.00 -1.71 0.00 0.00 66.02 64.95 2cv4 s SER 75 CO -0.16 -0.75 1.59 0.58 1.20 0.00 0.00 173.24 175.70 2cv4 h VAL 76 N 2.78 0.62 -3.97 4.45 2.07 -1.75 -0.86 116.25 119.60 2cv4 h VAL 76 Ca -0.34 -1.67 -0.48 0.00 0.82 0.00 0.00 66.70 65.03 2cv4 h VAL 76 Cb 1.20 2.15 0.16 0.00 -1.52 0.00 0.00 31.29 33.28 2cv4 h VAL 76 CO 0.56 0.33 0.21 -1.81 0.02 0.00 0.00 177.57 176.87 2cv4 s ASP 77 N -6.33 2.99 0.93 0.57 1.01 -1.26 -2.26 116.67 112.31 2cv4 s ASP 77 Ca 0.03 1.57 -0.12 0.00 0.71 0.00 0.00 52.55 54.74 2cv4 s ASP 77 Cb 0.08 -2.23 0.15 0.00 1.01 0.00 0.00 42.92 41.93 2cv4 s ASP 77 CO 0.70 -2.96 1.10 -0.94 0.21 0.00 0.00 175.17 173.29 2cv4 s SER 78 N -3.19 3.28 0.46 0.27 1.04 -1.26 -3.39 113.70 110.91 2cv4 s SER 78 Ca 0.65 1.21 0.24 0.00 0.48 0.00 0.00 55.95 58.53 2cv4 s SER 78 Cb -0.20 -1.86 1.10 0.00 0.10 0.00 0.00 66.02 65.16 2cv4 s SER 78 CO 0.58 -2.72 1.92 -0.37 0.98 0.00 0.00 173.24 173.63 2cv4 h VAL 79 N -1.61 0.63 -0.34 5.02 -1.51 -1.95 -2.00 116.25 114.49 2cv4 h VAL 79 Ca -0.51 -0.94 -0.08 0.00 -1.23 0.00 0.00 66.70 63.93 2cv4 h VAL 79 Cb 1.31 1.61 -0.01 0.00 -2.13 0.00 0.00 31.29 32.07 2cv4 h VAL 79 CO 0.58 0.20 -0.12 -0.26 -1.23 0.00 0.00 177.57 176.75 2cv4 h PHE 80 N 0.00 0.77 -0.33 5.19 0.04 -1.99 -1.31 116.94 119.30 2cv4 h PHE 80 Ca -0.00 -0.18 -0.11 0.00 2.80 0.00 0.00 57.97 60.48 2cv4 h PHE 80 Cb 0.59 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.55 2cv4 h PHE 80 CO 0.00 0.86 -0.26 0.77 -0.60 0.00 0.00 178.31 179.08 2cv4 h SER 81 N 0.45 0.69 0.01 2.17 0.02 -1.91 -0.85 113.55 114.13 2cv4 h SER 81 Ca 0.08 -0.26 0.01 0.00 -0.84 0.00 0.00 61.79 60.78 2cv4 h SER 81 Cb 0.63 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 2cv4 h SER 81 CO 0.04 0.93 -0.08 0.45 -1.14 0.00 0.00 176.83 177.03 2cv4 h HIS 82 N 0.59 -0.19 -0.29 3.45 3.86 -1.02 0.23 115.15 121.77 2cv4 h HIS 82 Ca 0.08 0.01 -0.11 0.00 -1.16 0.00 0.00 60.37 59.19 2cv4 h HIS 82 Cb 0.76 0.08 -0.01 0.00 1.06 0.00 0.00 27.41 29.30 2cv4 h HIS 82 CO 0.03 -0.12 -0.27 0.82 0.86 0.00 0.00 177.93 179.26 2cv4 h ILE 83 N -0.14 1.27 -0.49 2.45 2.04 -1.16 0.30 117.51 121.78 2cv4 h ILE 83 Ca 0.03 -1.34 -0.13 0.00 1.00 0.00 0.00 64.86 64.42 2cv4 h ILE 83 Cb 0.17 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 2cv4 h ILE 83 CO -0.07 0.43 -0.21 0.11 0.00 0.00 0.00 178.15 178.41 2cv4 h LYS 84 N 0.50 0.99 -0.17 2.37 1.79 -0.78 0.20 116.57 121.47 2cv4 h LYS 84 Ca 0.07 -0.42 -0.03 0.00 -2.18 0.00 0.00 60.65 58.09 2cv4 h LYS 84 Cb 0.72 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.33 2cv4 h LYS 84 CO 0.06 1.10 -0.03 2.35 -1.08 0.00 0.00 179.45 181.85 2cv4 h TRP 85 N 0.86 0.35 -0.82 -1.35 7.01 -0.36 0.66 115.95 122.29 2cv4 h TRP 85 Ca 0.11 -0.07 0.04 0.00 2.11 0.00 0.00 58.89 61.08 2cv4 h TRP 85 Cb 0.79 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 27.71 2cv4 h TRP 85 CO 0.05 0.56 0.52 0.87 -2.79 0.00 0.00 178.44 177.65 2cv4 h LYS 86 N 0.03 0.96 -0.54 2.65 1.57 -0.19 -1.33 116.57 119.73 2cv4 h LYS 86 Ca 0.04 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2cv4 h LYS 86 Cb 0.44 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.51 2cv4 h LYS 86 CO 0.01 0.64 0.29 1.49 -0.57 0.00 0.00 179.45 181.31 2cv4 h GLU 87 N 0.99 0.75 -0.64 3.15 4.81 -0.12 -2.04 114.58 121.48 2cv4 h GLU 87 Ca 0.34 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.50 2cv4 h GLU 87 Cb 0.06 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.25 2cv4 h GLU 87 CO -0.13 0.59 0.41 2.35 -0.73 0.00 0.00 179.01 181.49 2cv4 h TRP 88 N 0.72 0.76 -0.83 0.92 7.01 -0.07 -1.17 115.95 123.29 2cv4 h TRP 88 Ca 0.19 0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.18 2cv4 h TRP 88 Cb 0.06 -0.25 -0.04 0.00 -2.10 0.00 0.00 29.16 26.83 2cv4 h TRP 88 CO -0.01 0.45 0.40 0.82 -2.79 0.00 0.00 178.44 177.30 2cv4 h ILE 89 N 0.80 1.26 -0.63 2.65 2.04 -0.89 0.15 117.51 122.88 2cv4 h ILE 89 Ca 0.25 -0.72 -0.08 0.00 1.00 0.00 0.00 64.86 65.31 2cv4 h ILE 89 Cb -0.01 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.24 2cv4 h ILE 89 CO -0.09 0.31 0.09 -0.08 0.00 0.00 0.00 178.15 178.38 2cv4 h GLU 90 N 1.19 1.05 0.07 2.37 4.81 -0.94 -0.56 114.58 122.56 2cv4 h GLU 90 Ca 0.29 -0.28 -0.29 0.00 -0.13 0.00 0.00 59.36 58.95 2cv4 h GLU 90 Cb 0.12 -0.12 0.03 0.00 0.63 0.00 0.00 28.75 29.40 2cv4 h GLU 90 CO -0.04 0.97 -1.17 -0.09 -0.73 0.00 0.00 179.01 177.96 2cv4 h ARG 91 N 0.98 0.66 0.00 1.92 2.43 -0.87 -2.80 114.38 116.70 2cv4 h ARG 91 Ca 0.19 -0.81 -0.13 0.00 -0.81 0.00 0.00 59.98 58.42 2cv4 h ARG 91 Cb 0.44 0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 30.22 2cv4 h ARG 91 CO 0.01 1.36 -1.62 0.72 -1.51 0.00 0.00 179.97 178.94 2cv4 n HIS 92 N -3.82 0.62 0.18 2.20 8.25 0.49 -4.43 115.22 118.72 2cv4 n HIS 92 Ca -0.13 0.20 0.04 0.00 -0.26 0.00 0.00 57.72 57.58 2cv4 n HIS 92 Cb 0.95 -0.93 -0.06 0.00 1.12 0.00 0.00 29.99 31.07 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 -2.69 0.00 -0.74 1.59 5.41 -0.24 -5.01 119.36 117.67 2cv4 n ILE 93 Ca -0.10 -0.25 0.00 0.00 1.00 0.00 0.00 62.75 63.40 2cv4 n ILE 93 Cb 0.78 0.62 0.00 0.00 -0.71 0.00 0.00 39.64 40.32 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 1.63 0.67 3.09 7.39 0.00 -1.06 -5.01 105.19 111.91 2cv4 n GLY 94 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.26 1.68 0.09 1.61 0.11 -1.24 -4.97 120.40 115.42 2cv4 s VAL 95 Ca 0.00 -0.75 -0.27 0.00 -2.93 0.00 0.00 61.98 58.03 2cv4 s VAL 95 Cb 0.00 -1.51 -0.06 0.00 -1.53 0.00 0.00 36.38 33.28 2cv4 s VAL 95 CO 0.00 0.48 0.83 -0.60 -3.33 0.00 0.00 175.10 172.47 2cv4 s ARG 96 N 0.92 4.58 -0.34 1.54 3.52 -1.26 -3.31 118.95 124.60 2cv4 s ARG 96 Ca -0.07 1.20 -0.26 0.00 -0.13 0.00 0.00 55.73 56.47 2cv4 s ARG 96 Cb -0.15 -3.35 0.01 0.00 -1.56 0.00 0.00 34.95 29.90 2cv4 s ARG 96 CO -0.01 0.32 0.92 0.42 -0.81 0.00 0.00 175.30 176.14 2cv4 s ILE 97 N -0.27 4.63 -1.61 4.11 1.09 -1.26 -4.94 121.20 122.95 2cv4 s ILE 97 Ca 0.40 1.31 0.27 0.00 -1.10 0.00 0.00 60.65 61.53 2cv4 s ILE 97 Cb -0.22 -4.30 0.29 0.00 -1.06 0.00 0.00 42.46 37.17 2cv4 s ILE 97 CO 0.26 -0.44 1.65 -0.81 -0.10 0.00 0.00 174.94 175.49 2cv4 n PRO 98 N 6.63 0.66 -4.11 2.79 -0.04 -1.26 -4.91 135.00 134.77 2cv4 n PRO 98 Ca 0.07 -0.34 -0.22 0.00 -0.04 0.00 0.00 63.50 62.97 2cv4 n PRO 98 Cb 0.48 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 32.40 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 -2.57 3.13 0.84 0.54 -0.71 -1.26 -5.10 117.98 112.85 2cv4 s PHE 99 Ca 0.24 -0.10 -0.11 0.00 -1.04 0.00 0.00 56.93 55.92 2cv4 s PHE 99 Cb 0.19 -1.42 0.10 0.00 -1.21 0.00 0.00 43.02 40.68 2cv4 s PHE 99 CO 0.53 0.52 1.10 -1.25 -1.34 0.00 0.00 175.22 174.78 2cv4 s PRO 100 N -3.78 1.71 -0.06 1.99 0.04 -1.26 -4.87 135.00 128.76 2cv4 s PRO 100 Ca 0.33 1.13 0.01 0.00 0.04 0.00 0.00 61.00 62.51 2cv4 s PRO 100 Cb -0.08 -1.84 0.02 0.00 0.04 0.00 0.00 34.50 32.64 2cv4 s PRO 100 CO 0.25 -2.02 -0.07 0.42 0.04 0.00 0.00 177.00 175.62 2cv4 s ILE 101 N -2.86 0.77 0.19 0.56 1.01 -1.26 -1.36 121.20 118.25 2cv4 s ILE 101 Ca 0.63 -0.24 -0.30 0.00 0.00 0.00 0.00 60.65 60.74 2cv4 s ILE 101 Cb -0.18 -0.76 -0.08 0.00 0.01 0.00 0.00 42.46 41.44 2cv4 s ILE 101 CO 0.57 0.28 1.26 -0.63 0.00 0.00 0.00 174.94 176.42 2cv4 s ILE 102 N 0.99 3.39 -0.34 2.92 1.01 0.14 -1.05 121.20 128.27 2cv4 s ILE 102 Ca -0.09 1.15 -0.11 0.00 0.00 0.00 0.00 60.65 61.60 2cv4 s ILE 102 Cb -0.14 -3.74 -0.00 0.00 0.01 0.00 0.00 42.46 38.59 2cv4 s ILE 102 CO 0.00 0.18 0.19 0.00 0.00 0.00 0.00 174.94 175.31 2cv4 s ALA 103 N 0.04 3.35 -0.60 9.38 0.00 -0.15 -2.46 121.76 131.33 2cv4 s ALA 103 Ca 0.55 -1.47 0.06 0.00 0.00 0.00 0.00 51.96 51.10 2cv4 s ALA 103 Cb -0.35 -2.53 0.26 0.00 0.00 0.00 0.00 23.12 20.51 2cv4 s ALA 103 CO 0.37 -1.04 0.73 -3.47 0.00 0.00 0.00 175.76 172.35 2cv4 n ASP 104 N 5.03 3.28 -0.28 0.00 2.03 -0.33 -4.60 116.55 121.68 2cv4 n ASP 104 Ca -0.13 -3.35 0.22 0.00 0.52 0.00 0.00 54.79 52.05 2cv4 n ASP 104 Cb 0.49 -0.66 0.53 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 4.03 0.35 -5.94 -0.67 0.11 -1.63 -3.36 132.00 124.90 2cv4 h PRO 105 Ca 0.17 -0.02 -0.68 0.00 0.11 0.00 0.00 66.00 65.58 2cv4 h PRO 105 Cb 0.68 -0.08 -0.26 0.00 0.11 0.00 0.00 31.00 31.45 2cv4 h PRO 105 CO 0.78 0.23 -0.79 -0.65 -0.21 0.00 0.00 178.00 177.36 2cv4 s GLN 106 N -5.41 2.80 0.00 1.05 -0.21 -1.26 -4.94 119.66 111.69 2cv4 s GLN 106 Ca -0.08 -0.74 0.00 0.00 0.02 0.00 0.00 55.36 54.56 2cv4 s GLN 106 Cb 0.24 -2.41 0.00 0.00 1.00 0.00 0.00 33.01 31.83 2cv4 s GLN 106 CO 0.79 0.44 0.00 0.41 -2.12 0.00 0.00 175.29 174.81 2cv4 n GLY 107 N 2.84 0.00 0.09 3.09 0.00 -1.26 -4.16 105.19 105.79 2cv4 n GLY 107 Ca -0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.82 2cv4 n GLY 107 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2cv4 n THR 108 N -0.01 -0.14 -0.24 2.61 -1.04 -1.26 0.39 114.28 114.59 2cv4 n THR 108 Ca 0.00 1.43 -0.06 0.00 -2.04 0.00 0.00 64.05 63.38 2cv4 n THR 108 Cb 0.00 -1.86 0.05 0.00 -1.82 0.00 0.00 70.33 66.69 2cv4 n THR 108 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 2cv4 h VAL 109 N 0.00 1.21 0.02 12.58 2.07 -1.92 0.21 116.25 130.43 2cv4 h VAL 109 Ca 0.03 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 67.00 2cv4 h VAL 109 Cb 0.09 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.20 2cv4 h VAL 109 CO -0.20 0.24 -0.03 0.00 0.02 0.00 0.00 177.57 177.61 2cv4 h ALA 110 N 1.17 -0.05 -0.32 1.67 0.00 -0.35 -1.41 119.26 119.98 2cv4 h ALA 110 Ca 0.24 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2cv4 h ALA 110 Cb 0.06 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2cv4 h ALA 110 CO -0.04 -0.53 0.15 0.00 0.00 0.00 0.00 179.25 178.84 2cv4 h ARG 111 N -0.06 0.46 -0.93 0.00 3.08 0.78 0.88 114.38 118.59 2cv4 h ARG 111 Ca 0.00 -0.07 0.22 0.00 0.07 0.00 0.00 59.98 60.21 2cv4 h ARG 111 Cb 0.06 -0.08 -0.07 0.00 0.08 0.00 0.00 29.97 29.96 2cv4 h ARG 111 CO -0.01 0.43 0.62 -0.09 -1.07 0.00 0.00 179.97 179.85 2cv4 h ARG 112 N 0.38 0.33 -0.68 0.04 9.65 -0.25 0.15 114.38 124.00 2cv4 h ARG 112 Ca 0.11 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 2cv4 h ARG 112 Cb 0.12 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.63 2cv4 h ARG 112 CO -0.01 0.22 0.00 1.28 2.80 0.00 0.00 179.97 184.26 2cv4 n LEU 113 N -4.49 4.67 -2.15 3.80 4.77 -0.56 -4.82 117.00 118.23 2cv4 n LEU 113 Ca 0.20 -2.35 -0.13 0.00 -0.03 0.00 0.00 56.01 53.70 2cv4 n LEU 113 Cb 0.77 -0.57 -0.02 0.00 -2.33 0.00 0.00 43.42 41.27 2cv4 n LEU 113 CO 0.31 0.85 -0.16 0.61 -1.33 0.00 0.00 177.39 177.67 2cv4 n GLY 114 N 1.26 -0.01 0.05 -0.72 0.00 0.52 -4.51 105.19 101.78 2cv4 n GLY 114 Ca 0.26 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.43 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 -2.56 0.17 -4.38 0.99 4.77 0.23 -4.49 117.00 111.73 2cv4 n LEU 115 Ca -0.15 -0.06 -0.46 0.00 -0.03 0.00 0.00 56.01 55.32 2cv4 n LEU 115 Cb 0.57 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.63 2cv4 n LEU 115 CO 0.19 0.03 0.63 -0.22 -1.33 0.00 0.00 177.39 176.69 2cv4 s LEU 116 N -1.97 6.00 0.72 2.23 2.96 -1.25 -1.90 118.68 125.47 2cv4 s LEU 116 Ca 0.45 -2.33 0.01 0.00 -0.22 0.00 0.00 54.13 52.04 2cv4 s LEU 116 Cb 0.21 -2.29 0.14 0.00 0.50 0.00 0.00 46.19 44.75 2cv4 s LEU 116 CO 0.35 -0.81 0.99 -1.00 -1.32 0.00 0.00 176.35 174.57 2cv4 s HIS 117 N 1.34 1.32 -0.59 5.38 3.76 -1.26 -5.02 115.29 120.22 2cv4 s HIS 117 Ca 0.23 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 54.73 2cv4 s HIS 117 Cb -0.09 -2.88 0.50 0.00 1.11 0.00 0.00 32.58 31.21 2cv4 s HIS 117 CO -0.08 -1.75 1.96 0.00 -0.85 0.00 0.00 174.74 174.01 2cv4 n ALA 118 N -2.81 6.06 0.34 -1.40 0.00 -1.26 -4.11 120.51 117.33 2cv4 n ALA 118 Ca 0.16 -3.35 0.09 0.00 0.00 0.00 0.00 53.44 50.34 2cv4 n ALA 118 Cb 0.61 -1.61 -0.12 0.00 0.00 0.00 0.00 19.45 18.33 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 -0.97 0.81 -3.17 0.00 2.13 -1.26 -4.90 120.64 113.29 2cv4 n GLU 119 Ca 0.61 -0.10 0.05 0.00 0.66 0.00 0.00 57.16 58.38 2cv4 n GLU 119 Cb 0.92 -1.39 -0.02 0.00 0.27 0.00 0.00 31.44 31.22 2cv4 n GLU 119 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2cv4 s SER 120 N -3.50 -0.36 0.61 4.31 0.01 -1.26 -5.12 113.70 108.38 2cv4 s SER 120 Ca -0.01 0.26 -0.18 0.00 1.31 0.00 0.00 55.95 57.33 2cv4 s SER 120 Cb 0.12 1.32 -0.05 0.00 0.21 0.00 0.00 66.02 67.63 2cv4 s SER 120 CO 0.74 -0.07 0.95 0.00 0.41 0.00 0.00 173.24 175.28 2cv4 n ALA 121 N 5.37 0.14 -1.48 1.44 0.00 -1.26 -4.40 120.51 120.31 2cv4 n ALA 121 Ca -0.08 -0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.45 2cv4 n ALA 121 Cb 0.54 -2.10 -0.05 0.00 0.00 0.00 0.00 19.45 17.84 2cv4 n ALA 121 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2cv4 n THR 122 N -1.78 -1.78 -1.91 0.00 -2.24 -1.26 -5.00 114.28 100.31 2cv4 n THR 122 Ca 0.14 1.13 -0.00 0.00 -2.27 0.00 0.00 64.05 63.05 2cv4 n THR 122 Cb 0.48 -1.81 -0.00 0.00 -2.10 0.00 0.00 70.33 66.89 2cv4 n THR 122 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2cv4 n HIS 123 N -3.50 -3.15 -2.15 4.78 -0.00 -1.26 -4.97 115.22 104.96 2cv4 n HIS 123 Ca -0.05 1.87 -0.38 0.00 -0.00 0.00 0.00 57.72 59.17 2cv4 n HIS 123 Cb 0.56 -3.21 -0.00 0.00 -0.00 0.00 0.00 29.99 27.34 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 -0.40 2.86 1.11 1.59 2.01 -1.26 -4.79 115.64 116.77 2cv4 s THR 124 Ca -0.01 0.69 -0.13 0.00 0.31 0.00 0.00 61.69 62.55 2cv4 s THR 124 Cb 0.00 -3.37 0.23 0.00 0.01 0.00 0.00 72.50 69.37 2cv4 s THR 124 CO 0.03 0.03 0.87 0.52 -0.69 0.00 0.00 174.62 175.39 2cv4 n VAL 125 N -0.32 0.00 -2.04 3.82 0.31 -0.80 -2.35 118.33 116.95 2cv4 n VAL 125 Ca 0.06 -0.33 -0.42 0.00 -0.01 0.00 0.00 64.34 63.64 2cv4 n VAL 125 Cb 0.46 -0.92 0.00 0.00 -0.91 0.00 0.00 33.84 32.47 2cv4 n VAL 125 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2cv4 n ARG 126 N -4.27 3.20 -3.54 5.55 1.74 -1.24 -4.06 116.66 114.04 2cv4 n ARG 126 Ca 0.05 -3.04 -0.32 0.00 -0.77 0.00 0.00 57.85 53.76 2cv4 n ARG 126 Cb 0.55 -3.14 -0.05 0.00 -1.02 0.00 0.00 32.46 28.80 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 2.22 2.29 -0.07 -0.13 0.00 -1.26 -1.88 107.32 108.50 2cv4 s GLY 127 Ca 0.44 -0.39 0.01 0.00 0.00 0.00 0.00 44.72 44.78 2cv4 s GLY 127 CO -0.04 -0.25 -0.09 0.14 0.00 0.00 0.00 173.10 172.85 2cv4 s VAL 128 N -1.66 0.94 -0.12 1.40 1.01 0.16 -1.18 120.40 120.95 2cv4 s VAL 128 Ca 0.42 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 62.08 2cv4 s VAL 128 Cb -0.12 -0.90 0.00 0.00 0.00 0.00 0.00 36.38 35.36 2cv4 s VAL 128 CO 0.22 0.32 -0.22 -0.36 0.00 0.00 0.00 175.10 175.06 2cv4 s PHE 129 N 0.92 2.64 -0.22 5.22 0.40 0.10 -1.01 117.98 126.02 2cv4 s PHE 129 Ca -0.10 -1.12 -0.07 0.00 -0.60 0.00 0.00 56.93 55.04 2cv4 s PHE 129 Cb -0.15 -1.77 -0.03 0.00 0.51 0.00 0.00 43.02 41.58 2cv4 s PHE 129 CO 0.01 -0.48 0.05 0.42 0.70 0.00 0.00 175.22 175.92 2cv4 s ILE 130 N 0.55 4.33 -0.11 0.64 1.01 -0.17 -1.14 121.20 126.31 2cv4 s ILE 130 Ca -0.13 -0.18 0.03 0.00 0.00 0.00 0.00 60.65 60.37 2cv4 s ILE 130 Cb -0.17 -2.99 0.01 0.00 0.01 0.00 0.00 42.46 39.32 2cv4 s ILE 130 CO 0.04 0.39 -0.21 -0.69 0.00 0.00 0.00 174.94 174.47 2cv4 s VAL 131 N 1.16 1.89 0.91 2.92 1.01 -0.14 -0.94 120.40 127.21 2cv4 s VAL 131 Ca 0.04 -0.90 -0.15 0.00 0.00 0.00 0.00 61.98 60.97 2cv4 s VAL 131 Cb -0.14 -1.66 0.16 0.00 0.00 0.00 0.00 36.38 34.74 2cv4 s VAL 131 CO 0.03 0.52 1.28 1.51 0.00 0.00 0.00 175.10 178.43 2cv4 s ASP 132 N 0.62 3.56 0.00 3.32 1.47 -0.01 -1.71 116.67 123.92 2cv4 s ASP 132 Ca -0.13 0.42 0.02 0.00 1.18 0.00 0.00 52.55 54.05 2cv4 s ASP 132 Cb -0.17 -0.61 0.14 0.00 -0.34 0.00 0.00 42.92 41.95 2cv4 s ASP 132 CO 0.03 -2.47 0.65 0.00 0.68 0.00 0.00 175.17 174.06 2cv4 n ALA 133 N -3.62 1.57 0.16 2.11 0.00 -1.26 0.42 120.51 119.90 2cv4 n ALA 133 Ca 0.13 -0.01 0.09 0.00 0.00 0.00 0.00 53.44 53.64 2cv4 n ALA 133 Cb 0.60 -1.04 0.17 0.00 0.00 0.00 0.00 19.45 19.18 2cv4 n ALA 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2cv4 n ARG 134 N -1.02 2.19 -1.77 0.00 1.74 -1.26 -4.60 116.66 111.93 2cv4 n ARG 134 Ca 0.02 -1.99 -0.05 0.00 -0.77 0.00 0.00 57.85 55.05 2cv4 n ARG 134 Cb 0.01 -1.38 -0.01 0.00 -1.02 0.00 0.00 32.46 30.06 2cv4 n ARG 134 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cv4 n GLY 135 N 1.03 0.37 3.72 -0.13 0.00 0.17 -4.95 105.19 105.40 2cv4 n GLY 135 Ca 0.15 -0.72 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.24 4.69 -0.04 1.61 1.01 -1.25 -0.50 120.40 123.67 2cv4 s VAL 136 Ca 0.00 -0.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.58 2cv4 s VAL 136 Cb 0.00 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 2cv4 s VAL 136 CO 0.00 0.58 1.23 -0.63 0.00 0.00 0.00 175.10 176.28 2cv4 s ILE 137 N -0.64 4.16 -0.02 2.22 1.01 -0.65 -0.83 121.20 126.45 2cv4 s ILE 137 Ca 0.11 1.49 0.07 0.00 0.00 0.00 0.00 60.65 62.32 2cv4 s ILE 137 Cb -0.12 -3.96 -0.10 0.00 0.01 0.00 0.00 42.46 38.29 2cv4 s ILE 137 CO 0.02 0.00 0.12 0.54 0.00 0.00 0.00 174.94 175.62 2cv4 n ARG 138 N 5.21 0.92 -2.53 2.79 5.12 -0.12 -1.16 116.66 126.90 2cv4 n ARG 138 Ca 0.11 -0.05 -0.05 0.00 -1.93 0.00 0.00 57.85 55.94 2cv4 n ARG 138 Cb 0.46 -1.17 0.02 0.00 -1.16 0.00 0.00 32.46 30.60 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 -1.87 0.00 -3.65 0.55 -1.04 -1.21 -4.94 114.28 102.12 2cv4 n THR 139 Ca -0.04 -0.53 -0.01 0.00 -2.04 0.00 0.00 64.05 61.43 2cv4 n THR 139 Cb 0.32 0.54 -0.07 0.00 -1.82 0.00 0.00 70.33 69.30 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 -0.07 -0.38 -4.42 1.43 -0.18 -1.00 118.68 114.05 2cv4 s LEU 141 Ca 0.09 0.12 0.02 0.00 -1.03 0.00 0.00 54.13 53.33 2cv4 s LEU 141 Cb -0.03 1.12 0.11 0.00 0.03 0.00 0.00 46.19 47.43 2cv4 s LEU 141 CO 0.06 -0.02 0.15 -0.31 0.23 0.00 0.00 176.35 176.46 2cv4 s TYR 142 N 0.52 2.33 0.41 0.29 2.02 -1.26 0.36 117.35 122.02 2cv4 s TYR 142 Ca -0.00 -2.35 -0.05 0.00 -0.37 0.00 0.00 57.07 54.30 2cv4 s TYR 142 Cb -0.04 -2.11 -0.04 0.00 -0.40 0.00 0.00 41.96 39.37 2cv4 s TYR 142 CO -0.13 -0.85 0.70 0.71 -1.57 0.00 0.00 175.55 174.41 2cv4 s TYR 143 N 0.87 3.52 0.00 2.71 2.02 -0.79 -5.00 117.35 120.69 2cv4 s TYR 143 Ca 0.13 0.74 0.00 0.00 -0.37 0.00 0.00 57.07 57.57 2cv4 s TYR 143 Cb -0.21 -2.22 0.00 0.00 -0.40 0.00 0.00 41.96 39.14 2cv4 s TYR 143 CO -0.11 -0.09 0.00 -0.35 -1.57 0.00 0.00 175.55 173.43 2cv4 n PRO 144 N -1.77 0.00 0.00 -1.71 -0.04 -1.26 -3.71 135.00 126.50 2cv4 n PRO 144 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 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 -4.05 0.54 0.00 -1.26 -4.64 120.64 111.24 2cv4 n GLU 146 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 57.16 56.89 2cv4 n GLU 146 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 31.44 31.27 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 1.36 0.43 -1.84 1.98 -1.26 -5.10 118.68 114.25 2cv4 s LEU 147 Ca 0.00 -0.34 -0.22 0.00 -2.89 0.00 0.00 54.13 50.68 2cv4 s LEU 147 Cb 0.00 -0.91 -0.10 0.00 0.66 0.00 0.00 46.19 45.84 2cv4 s LEU 147 CO 0.00 -0.08 0.99 -0.83 -1.89 0.00 0.00 176.35 174.54 2cv4 s GLY 148 N 1.49 2.55 0.97 7.98 0.00 -1.26 -4.94 107.32 114.11 2cv4 s GLY 148 Ca 0.02 0.53 -0.12 0.00 0.00 0.00 0.00 44.72 45.15 2cv4 s GLY 148 CO -0.07 0.87 1.09 0.50 0.00 0.00 0.00 173.10 175.50 2cv4 s ARG 149 N -2.91 0.67 -0.67 2.90 0.52 -1.26 -5.00 118.95 113.20 2cv4 s ARG 149 Ca 0.61 0.65 -0.05 0.00 -0.52 0.00 0.00 55.73 56.42 2cv4 s ARG 149 Cb -0.15 -1.75 0.17 0.00 0.52 0.00 0.00 34.95 33.74 2cv4 s ARG 149 CO 0.19 -2.60 0.50 -1.17 0.02 0.00 0.00 175.30 172.24 2cv4 s LEU 150 N -6.41 5.48 0.41 2.53 0.20 -1.26 -4.96 118.68 114.67 2cv4 s LEU 150 Ca 0.65 -2.87 0.15 0.00 0.69 0.00 0.00 54.13 52.75 2cv4 s LEU 150 Cb -0.19 -1.91 1.02 0.00 -0.43 0.00 0.00 46.19 44.68 2cv4 s LEU 150 CO 0.58 -0.39 1.91 0.58 -0.29 0.00 0.00 176.35 178.73 2cv4 h VAL 151 N 5.15 0.80 0.00 1.68 2.07 -1.96 -0.28 116.25 123.71 2cv4 h VAL 151 Ca 0.01 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 2cv4 h VAL 151 Cb 0.96 0.30 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 2cv4 h VAL 151 CO 0.72 0.08 -0.11 0.44 0.02 0.00 0.00 177.57 178.73 2cv4 h ASP 152 N 0.46 0.00 0.10 0.57 3.32 -1.93 -1.47 116.42 117.47 2cv4 h ASP 152 Ca 0.39 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.28 2cv4 h ASP 152 Cb 0.84 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 2cv4 h ASP 152 CO -0.13 0.11 -0.56 -0.08 -1.72 0.00 0.00 179.24 176.85 2cv4 h GLU 153 N 0.00 0.48 -0.18 3.56 4.57 -1.39 -1.87 114.58 119.75 2cv4 h GLU 153 Ca -0.00 -0.31 -0.05 0.00 -1.18 0.00 0.00 59.36 57.82 2cv4 h GLU 153 Cb 0.22 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 2cv4 h GLU 153 CO 0.01 0.91 -0.13 0.82 -1.18 0.00 0.00 179.01 179.44 2cv4 h ILE 154 N 0.37 1.19 -0.27 2.32 2.04 -1.22 -0.80 117.51 121.13 2cv4 h ILE 154 Ca 0.00 -0.85 -0.16 0.00 1.00 0.00 0.00 64.86 64.85 2cv4 h ILE 154 Cb 1.09 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 38.37 2cv4 h ILE 154 CO 0.10 0.27 -0.47 -0.07 0.00 0.00 0.00 178.15 177.98 2cv4 h LEU 155 N 0.27 0.89 -0.48 1.44 3.38 -1.08 -2.48 115.31 117.26 2cv4 h LEU 155 Ca 0.05 -0.53 -0.00 0.00 0.09 0.00 0.00 57.88 57.50 2cv4 h LEU 155 Cb 0.41 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2cv4 h LEU 155 CO 0.02 1.25 0.29 -0.09 0.09 0.00 0.00 178.44 180.00 2cv4 h ARG 156 N 0.56 0.65 -0.01 1.13 2.43 -0.95 0.22 114.38 118.41 2cv4 h ARG 156 Ca 0.02 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2cv4 h ARG 156 Cb 1.07 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.47 2cv4 h ARG 156 CO 0.11 0.48 -0.10 0.82 -1.51 0.00 0.00 179.97 179.77 2cv4 h ILE 157 N 0.64 0.75 -0.61 1.20 2.04 -1.08 0.10 117.51 120.54 2cv4 h ILE 157 Ca 0.17 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.97 2cv4 h ILE 157 Cb -0.00 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 2cv4 h ILE 157 CO -0.03 0.00 0.14 0.58 0.00 0.00 0.00 178.15 178.84 2cv4 h VAL 158 N -0.16 1.25 0.57 1.67 2.07 -1.19 0.53 116.25 120.99 2cv4 h VAL 158 Ca 0.04 -0.93 -0.02 0.00 0.82 0.00 0.00 66.70 66.60 2cv4 h VAL 158 Cb 0.22 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 30.67 2cv4 h VAL 158 CO -0.11 0.35 -0.31 0.50 0.02 0.00 0.00 177.57 178.02 2cv4 h LYS 159 N 0.90 -0.79 -1.00 1.57 1.63 -0.23 -1.45 116.57 117.21 2cv4 h LYS 159 Ca 0.19 0.05 0.07 0.00 -0.85 0.00 0.00 60.65 60.12 2cv4 h LYS 159 Cb 0.37 0.18 -0.07 0.00 -0.60 0.00 0.00 32.23 32.11 2cv4 h LYS 159 CO 0.00 -0.53 0.64 0.00 -3.45 0.00 0.00 179.45 176.12 2cv4 h ALA 160 N -0.41 1.43 -0.45 5.00 0.00 -0.71 -0.65 119.26 123.47 2cv4 h ALA 160 Ca -0.07 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 2cv4 h ALA 160 Cb 0.65 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2cv4 h ALA 160 CO 0.10 0.40 -0.19 1.25 0.00 0.00 0.00 179.25 180.81 2cv4 h LEU 161 N 1.14 0.90 -0.57 0.00 5.85 -0.80 0.22 115.31 122.05 2cv4 h LEU 161 Ca 0.44 -0.32 -0.16 0.00 0.84 0.00 0.00 57.88 58.68 2cv4 h LEU 161 Cb 0.22 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 2cv4 h LEU 161 CO -0.18 1.07 -0.66 0.11 -0.34 0.00 0.00 178.44 178.43 2cv4 h LYS 162 N 0.78 0.22 0.08 1.25 1.57 -0.69 -1.96 116.57 117.82 2cv4 h LYS 162 Ca 0.11 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2cv4 h LYS 162 Cb 0.74 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.08 2cv4 h LYS 162 CO 0.06 0.80 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.63 2cv4 h LEU 163 N 0.16 -0.10 -0.14 2.94 3.38 -0.90 -1.42 115.31 119.23 2cv4 h LEU 163 Ca -0.01 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 57.83 2cv4 h LEU 163 Cb 1.19 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.93 2cv4 h LEU 163 CO 0.10 0.11 -0.12 1.23 0.09 0.00 0.00 178.44 179.86 2cv4 h GLY 164 N -0.30 -0.01 0.36 0.83 0.00 -0.42 -1.58 103.07 101.94 2cv4 h GLY 164 Ca -0.01 0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.51 2cv4 h GLY 164 CO 0.02 -0.13 -0.16 -0.55 0.00 0.00 0.00 176.54 175.72 2cv4 h ASP 165 N -0.13 -0.53 -0.08 0.19 5.19 -1.30 0.81 116.42 120.57 2cv4 h ASP 165 Ca 0.09 0.10 -0.15 0.00 -0.62 0.00 0.00 57.03 56.46 2cv4 h ASP 165 Cb 0.26 0.26 -0.01 0.00 0.18 0.00 0.00 39.33 40.03 2cv4 h ASP 165 CO -0.22 -0.21 -0.45 0.77 -3.12 0.00 0.00 179.24 176.02 2cv4 h SER 166 N -0.18 0.67 -0.14 6.45 4.64 -1.07 -3.02 113.55 120.90 2cv4 h SER 166 Ca 0.12 -0.32 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 2cv4 h SER 166 Cb 0.35 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2cv4 h SER 166 CO -0.29 1.02 0.00 0.18 -0.87 0.00 0.00 176.83 176.87 2cv4 n LEU 167 N -4.01 2.39 -3.73 5.97 4.77 -0.61 -4.97 117.00 116.81 2cv4 n LEU 167 Ca -0.02 -0.91 -0.24 0.00 -0.03 0.00 0.00 56.01 54.81 2cv4 n LEU 167 Cb 0.55 -0.08 0.02 0.00 -2.33 0.00 0.00 43.42 41.58 2cv4 n LEU 167 CO 0.46 0.45 -0.10 0.29 -1.33 0.00 0.00 177.39 177.16 2cv4 n LYS 168 N 0.83 -3.44 -4.24 3.23 5.02 0.27 -4.99 118.16 114.83 2cv4 n LYS 168 Ca 0.17 0.54 -0.14 0.00 -2.02 0.00 0.00 58.31 56.86 2cv4 n LYS 168 Cb 0.47 -4.80 -0.10 0.00 -0.02 0.00 0.00 35.03 30.58 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 -6.02 1.07 0.23 1.97 1.81 -0.31 -4.56 118.95 113.14 2cv4 s ARG 169 Ca 0.15 -1.48 0.05 0.00 -1.72 0.00 0.00 55.73 52.73 2cv4 s ARG 169 Cb -0.05 -0.46 -0.03 0.00 -0.45 0.00 0.00 34.95 33.97 2cv4 s ARG 169 CO 0.84 -0.02 0.30 0.00 -0.68 0.00 0.00 175.30 175.74 2cv4 s ALA 170 N -3.48 3.84 -0.19 2.13 0.00 0.20 -4.48 121.76 119.79 2cv4 s ALA 170 Ca 0.19 -1.25 -0.04 0.00 0.00 0.00 0.00 51.96 50.86 2cv4 s ALA 170 Cb 0.04 -1.62 -0.02 0.00 0.00 0.00 0.00 23.12 21.52 2cv4 s ALA 170 CO 0.01 0.29 -0.03 0.08 0.00 0.00 0.00 175.76 176.12 2cv4 s VAL 171 N -1.98 3.78 0.90 0.00 1.01 -1.26 -0.18 120.40 122.67 2cv4 s VAL 171 Ca 0.34 -0.38 -0.12 0.00 0.00 0.00 0.00 61.98 61.82 2cv4 s VAL 171 Cb -0.09 -2.69 0.13 0.00 0.00 0.00 0.00 36.38 33.73 2cv4 s VAL 171 CO 0.28 0.45 1.10 -2.16 0.00 0.00 0.00 175.10 174.77 2cv4 s PRO 172 N 0.87 1.27 0.37 2.72 0.04 -1.26 -4.94 135.00 134.06 2cv4 s PRO 172 Ca -0.00 0.68 -0.27 0.00 0.04 0.00 0.00 61.00 61.45 2cv4 s PRO 172 Cb -0.14 -1.82 -0.11 0.00 0.04 0.00 0.00 34.50 32.46 2cv4 s PRO 172 CO 0.02 -2.20 1.19 0.00 0.04 0.00 0.00 177.00 176.05 2cv4 n ALA 173 N -3.83 0.85 -1.60 8.56 0.00 -1.26 -2.23 120.51 121.00 2cv4 n ALA 173 Ca 0.07 0.31 -0.21 0.00 0.00 0.00 0.00 53.44 53.61 2cv4 n ALA 173 Cb 0.56 -2.19 -0.09 0.00 0.00 0.00 0.00 19.45 17.74 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 0.62 -5.49 -4.75 0.00 8.00 -1.26 -4.05 116.55 109.62 2cv4 n ASP 174 Ca 0.07 0.51 -0.39 0.00 0.71 0.00 0.00 54.79 55.69 2cv4 n ASP 174 Cb 0.37 -4.81 0.04 0.00 -0.02 0.00 0.00 41.12 36.70 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 -2.40 2.38 0.08 1.24 -0.00 -0.94 -0.76 117.44 117.04 2cv4 n TRP 175 Ca -0.21 0.43 -0.01 0.00 -0.00 0.00 0.00 57.50 57.71 2cv4 n TRP 175 Cb 0.68 -2.38 0.15 0.00 -0.00 0.00 0.00 31.31 29.76 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 -0.93 2.41 -2.00 5.87 -0.04 -1.26 -4.93 135.00 134.11 2cv4 n PRO 176 Ca 0.10 -1.43 -0.27 0.00 -0.04 0.00 0.00 63.50 61.86 2cv4 n PRO 176 Cb 0.44 -1.75 0.03 0.00 -0.04 0.00 0.00 33.50 32.17 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 0.11 5.41 -4.75 3.54 3.02 0.06 -3.26 115.26 119.40 2cv4 n ASN 177 Ca 0.18 -3.75 -0.41 0.00 -0.03 0.00 0.00 54.58 50.56 2cv4 n ASN 177 Cb 0.80 -0.49 -0.02 0.00 -0.61 0.00 0.00 39.78 39.46 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 -3.22 6.64 0.52 6.41 2.47 -0.78 -4.85 114.94 122.14 2cv4 s ASN 178 Ca 0.53 2.71 0.23 0.00 0.42 0.00 0.00 52.86 56.74 2cv4 s ASN 178 Cb 0.42 -2.63 1.40 0.00 -1.45 0.00 0.00 41.25 38.99 2cv4 s ASN 178 CO -0.03 -0.69 2.10 -0.33 -3.72 0.00 0.00 177.10 174.43 2cv4 h GLU 179 N 4.60 0.00 0.00 0.43 5.08 -1.89 0.97 114.58 123.77 2cv4 h GLU 179 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2cv4 h GLU 179 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 2cv4 h GLU 179 CO 0.75 0.10 -0.45 0.82 -1.00 0.00 0.00 179.01 179.22 2cv4 h ILE 180 N 0.00 0.00 -0.28 3.13 2.04 -1.94 -3.43 117.51 117.03 2cv4 h ILE 180 Ca -0.00 -0.92 0.00 0.00 1.00 0.00 0.00 64.86 64.93 2cv4 h ILE 180 Cb 0.21 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.29 2cv4 h ILE 180 CO 0.01 0.00 0.00 2.30 0.00 0.00 0.00 178.15 180.46 2cv4 n ILE 181 N -4.44 1.64 0.00 -0.67 -5.35 -1.25 -5.07 119.36 104.21 2cv4 n ILE 181 Ca -0.06 -1.45 0.00 0.00 -0.27 0.00 0.00 62.75 60.97 2cv4 n ILE 181 Cb 0.23 0.12 0.00 0.00 -1.74 0.00 0.00 39.64 38.25 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 -0.06 1.88 0.74 3.28 0.00 0.33 -0.99 105.19 110.37 2cv4 n GLY 182 Ca 0.16 0.42 0.12 0.00 0.00 0.00 0.00 46.02 46.73 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 2.52 2.01 -1.90 1.61 0.28 -1.20 -1.86 120.64 122.09 2cv4 n GLU 183 Ca 0.00 -1.48 -0.37 0.00 -0.16 0.00 0.00 57.16 55.15 2cv4 n GLU 183 Cb 0.00 -1.46 0.05 0.00 1.43 0.00 0.00 31.44 31.45 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 -1.82 2.80 -0.05 -1.84 0.00 -0.16 -4.83 107.32 101.42 2cv4 s GLY 184 Ca 0.34 1.11 0.00 0.00 0.00 0.00 0.00 44.72 46.18 2cv4 s GLY 184 CO 0.31 1.53 -0.02 1.08 0.00 0.00 0.00 173.10 176.00 2cv4 s LEU 185 N -4.09 3.44 0.17 0.66 1.43 0.01 -4.55 118.68 115.75 2cv4 s LEU 185 Ca 0.78 0.04 -0.23 0.00 -1.03 0.00 0.00 54.13 53.69 2cv4 s LEU 185 Cb -0.34 -1.85 -0.08 0.00 0.03 0.00 0.00 46.19 43.95 2cv4 s LEU 185 CO 0.37 0.34 0.74 -0.63 0.23 0.00 0.00 176.35 177.39 2cv4 s ILE 186 N -0.94 4.46 -0.05 -0.59 1.01 0.75 -2.24 121.20 123.60 2cv4 s ILE 186 Ca 0.15 1.53 -0.26 0.00 0.00 0.00 0.00 60.65 62.07 2cv4 s ILE 186 Cb -0.11 -4.03 -0.03 0.00 0.01 0.00 0.00 42.46 38.30 2cv4 s ILE 186 CO 0.05 0.43 0.81 -0.69 0.00 0.00 0.00 174.94 175.54 2cv4 s VAL 187 N -1.26 4.97 0.15 2.92 1.01 -0.32 0.62 120.40 128.49 2cv4 s VAL 187 Ca 0.37 1.68 -0.34 0.00 0.00 0.00 0.00 61.98 63.69 2cv4 s VAL 187 Cb -0.21 -4.15 -0.15 0.00 0.00 0.00 0.00 36.38 31.88 2cv4 s VAL 187 CO 0.24 0.20 1.49 -2.65 0.00 0.00 0.00 175.10 174.37 2cv4 n PRO 188 N 3.97 1.84 -1.77 2.72 -0.02 -1.26 -4.60 135.00 135.87 2cv4 n PRO 188 Ca 0.02 0.66 -0.38 0.00 -2.02 0.00 0.00 63.50 61.78 2cv4 n PRO 188 Cb 0.51 -2.38 0.04 0.00 -0.02 0.00 0.00 33.50 31.65 2cv4 n PRO 188 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2cv4 s PRO 189 N 0.67 3.08 0.52 0.52 0.05 -1.26 -4.97 135.00 133.62 2cv4 s PRO 189 Ca 0.80 2.23 -0.22 0.00 0.05 0.00 0.00 61.00 63.85 2cv4 s PRO 189 Cb -0.76 -2.22 -0.06 0.00 0.05 0.00 0.00 34.50 31.52 2cv4 s PRO 189 CO 0.41 -1.24 1.31 -2.14 0.05 0.00 0.00 177.00 175.40 2cv4 s PRO 190 N -2.96 3.31 0.00 0.56 0.02 -1.26 -4.95 135.00 129.71 2cv4 s PRO 190 Ca 0.73 2.12 0.08 0.00 0.02 0.00 0.00 61.00 63.94 2cv4 s PRO 190 Cb -0.40 -2.30 0.19 0.00 0.02 0.00 0.00 34.50 32.01 2cv4 s PRO 190 CO 0.47 -1.02 1.11 0.25 -0.33 0.00 0.00 177.00 177.48 2cv4 n THR 191 N -0.88 0.84 -4.03 0.99 -2.24 -1.26 -4.90 114.28 102.80 2cv4 n THR 191 Ca 0.09 -0.92 -0.10 0.00 -2.27 0.00 0.00 64.05 60.85 2cv4 n THR 191 Cb 0.46 0.60 -0.11 0.00 -2.10 0.00 0.00 70.33 69.18 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 -0.95 0.31 0.21 4.28 -4.23 -1.26 -5.05 115.64 108.95 2cv4 s THR 192 Ca 0.15 -1.15 -0.11 0.00 -1.18 0.00 0.00 61.69 59.40 2cv4 s THR 192 Cb 0.08 -0.63 0.17 0.00 1.34 0.00 0.00 72.50 73.46 2cv4 s THR 192 CO 0.11 -0.54 1.68 -0.33 -0.54 0.00 0.00 174.62 175.00 2cv4 h GLU 193 N 4.30 0.15 -0.74 3.99 5.08 -1.99 -1.78 114.58 123.60 2cv4 h GLU 193 Ca -0.34 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.00 2cv4 h GLU 193 Cb 1.20 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.38 2cv4 h GLU 193 CO 0.45 0.10 0.41 -0.44 -1.00 0.00 0.00 179.01 178.54 2cv4 h ASP 194 N 0.16 0.92 -0.64 1.42 3.32 -1.99 0.03 116.42 119.65 2cv4 h ASP 194 Ca 0.30 -0.09 -0.09 0.00 0.02 0.00 0.00 57.03 57.17 2cv4 h ASP 194 Cb 0.47 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 2cv4 h ASP 194 CO -0.46 0.75 0.06 1.56 -1.72 0.00 0.00 179.24 179.43 2cv4 h GLN 195 N 1.02 1.09 -0.21 3.56 4.20 -1.90 -1.75 115.11 121.13 2cv4 h GLN 195 Ca 0.26 -0.31 0.01 0.00 0.06 0.00 0.00 58.65 58.66 2cv4 h GLN 195 Cb 0.03 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 2cv4 h GLN 195 CO -0.04 1.02 0.12 0.00 -0.67 0.00 0.00 178.83 179.26 2cv4 h ALA 196 N 1.04 0.25 -0.77 3.87 0.00 -0.74 -1.57 119.26 121.34 2cv4 h ALA 196 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2cv4 h ALA 196 Cb 0.49 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 2cv4 h ALA 196 CO 0.02 -0.28 0.49 0.00 0.00 0.00 0.00 179.25 179.47 2cv4 h ARG 197 N 0.25 1.03 0.00 0.00 3.08 -0.65 -1.32 114.38 116.77 2cv4 h ARG 197 Ca 0.08 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2cv4 h ARG 197 Cb -0.01 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 29.81 2cv4 h ARG 197 CO -0.03 0.70 -0.16 0.00 -1.07 0.00 0.00 179.97 179.41 2cv4 h ALA 198 N 1.48 1.02 -2.35 0.04 0.00 -1.00 -3.52 119.26 114.94 2cv4 h ALA 198 Ca 0.28 -0.14 -0.50 0.00 0.00 0.00 0.00 54.91 54.55 2cv4 h ALA 198 Cb -0.08 -0.03 0.07 0.00 0.00 0.00 0.00 17.79 17.75 2cv4 h ALA 198 CO -0.06 0.20 0.38 0.50 0.00 0.00 0.00 179.25 180.27 2cv4 s ARG 199 N -3.66 3.23 -0.55 0.00 3.52 -0.50 -5.10 118.95 115.89 2cv4 s ARG 199 Ca 0.01 1.19 0.04 0.00 -0.13 0.00 0.00 55.73 56.84 2cv4 s ARG 199 Cb 0.10 -2.02 0.14 0.00 -1.56 0.00 0.00 34.95 31.61 2cv4 s ARG 199 CO 0.61 -0.88 0.31 -2.00 -0.81 0.00 0.00 175.30 172.53 2cv4 s GLU 201 N -4.19 1.99 -0.15 5.12 2.12 -1.25 -4.93 118.70 117.40 2cv4 s GLU 201 Ca 0.63 -2.70 0.00 0.00 0.36 0.00 0.00 54.97 53.26 2cv4 s GLU 201 Cb -0.16 -3.21 0.03 0.00 0.26 0.00 0.00 34.13 31.05 2cv4 s GLU 201 CO 0.39 -1.16 -0.10 0.45 -0.54 0.00 0.00 175.26 174.31 2cv4 s SER 202 N -0.46 2.65 0.00 -1.70 0.15 -1.21 -4.92 113.70 108.21 2cv4 s SER 202 Ca 0.19 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.33 2cv4 s SER 202 Cb -0.21 -1.04 0.00 0.00 -1.71 0.00 0.00 66.02 63.06 2cv4 s SER 202 CO -0.04 -0.11 0.00 0.61 1.20 0.00 0.00 173.24 174.90 2cv4 n GLY 203 N 4.83 0.47 0.13 9.45 0.00 -1.26 -3.51 105.19 115.30 2cv4 n GLY 203 Ca -0.14 -0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 0.65 -2.71 1.61 6.02 -1.26 -4.86 117.38 116.83 2cv4 n GLN 204 Ca 0.00 0.32 -0.42 0.00 -0.01 0.00 0.00 57.00 56.89 2cv4 n GLN 204 Cb 0.00 -1.63 -0.03 0.00 1.02 0.00 0.00 30.24 29.60 2cv4 n GLN 204 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2cv4 s TYR 205 N -2.49 2.61 0.15 1.08 1.51 -1.23 -4.45 117.35 114.53 2cv4 s TYR 205 Ca -0.30 -0.65 -0.30 0.00 -1.01 0.00 0.00 57.07 54.81 2cv4 s TYR 205 Cb 0.09 -4.49 -0.07 0.00 -0.11 0.00 0.00 41.96 37.38 2cv4 s TYR 205 CO 0.62 -1.82 1.01 1.03 -1.11 0.00 0.00 175.55 175.28 2cv4 s ARG 206 N 4.51 4.68 -0.02 -0.62 1.81 -0.99 -3.31 118.95 125.02 2cv4 s ARG 206 Ca 0.34 1.55 0.01 0.00 -1.72 0.00 0.00 55.73 55.90 2cv4 s ARG 206 Cb -0.08 -3.33 0.02 0.00 -0.45 0.00 0.00 34.95 31.11 2cv4 s ARG 206 CO 0.02 0.20 -0.01 0.00 -0.68 0.00 0.00 175.30 174.84 2cv4 n LEU 208 N 3.72 0.28 -3.77 0.00 4.77 0.26 -4.98 117.00 117.28 2cv4 n LEU 208 Ca -0.22 0.11 -0.03 0.00 -0.03 0.00 0.00 56.01 55.84 2cv4 n LEU 208 Cb 0.54 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.60 2cv4 n LEU 208 CO 0.24 -0.06 0.74 -0.62 -1.33 0.00 0.00 177.39 176.35 2cv4 s ASP 209 N -4.80 -0.14 0.59 -1.43 -1.08 -1.24 -4.96 116.67 103.60 2cv4 s ASP 209 Ca -0.06 -0.46 0.34 0.00 -0.52 0.00 0.00 52.55 51.86 2cv4 s ASP 209 Cb 0.12 0.49 1.84 0.00 -1.46 0.00 0.00 42.92 43.92 2cv4 s ASP 209 CO 0.87 -0.92 2.20 4.11 0.52 0.00 0.00 175.17 181.94 2cv4 h TRP 210 N 2.00 0.00 -0.22 -5.34 5.08 -1.91 -1.26 115.95 114.29 2cv4 h TRP 210 Ca -0.25 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.72 2cv4 h TRP 210 Cb 1.23 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.39 2cv4 h TRP 210 CO 0.54 0.04 0.00 -2.67 -1.28 0.00 0.00 178.44 175.07 2cv4 n TRP 211 N -3.42 0.27 -3.59 0.12 4.27 -1.26 -4.53 117.44 109.31 2cv4 n TRP 211 Ca -0.02 -0.13 -0.28 0.00 -3.89 0.00 0.00 57.50 53.18 2cv4 n TRP 211 Cb 0.16 0.00 -0.11 0.00 -1.36 0.00 0.00 31.31 30.00 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 -1.73 1.98 0.20 -2.67 2.19 -0.48 -4.63 117.98 112.84 2cv4 s PHE 212 Ca 0.35 -2.66 0.11 0.00 0.33 0.00 0.00 56.93 55.06 2cv4 s PHE 212 Cb 0.21 -1.58 -0.04 0.00 -1.31 0.00 0.00 43.02 40.29 2cv4 s PHE 212 CO 0.31 -0.73 -0.22 0.00 1.83 0.00 0.00 175.22 176.41 2cv4 s TRP 214 N -1.75 -0.43 0.00 0.00 1.48 0.06 -1.17 118.94 117.13 2cv4 s TRP 214 Ca 0.22 0.19 0.00 0.00 -1.06 0.00 0.00 56.10 55.45 2cv4 s TRP 214 Cb -0.08 0.46 0.00 0.00 -1.16 0.00 0.00 33.47 32.69 2cv4 s TRP 214 CO 0.11 -0.80 0.00 -0.40 -4.06 0.00 0.00 176.95 171.80 2cv4 n ASP 215 N -0.32 0.41 -3.24 -2.66 5.75 -0.95 -2.33 116.55 113.20 2cv4 n ASP 215 Ca -0.17 -0.90 -0.24 0.00 -0.01 0.00 0.00 54.79 53.47 2cv4 n ASP 215 Cb 0.65 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.67 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 0.00 0.57 1.02 2.12 -2.24 -1.26 -0.81 114.28 113.67 2cv4 n THR 216 Ca 0.00 -4.56 0.14 0.00 -2.27 0.00 0.00 64.05 57.36 2cv4 n THR 216 Cb 0.00 -1.78 0.54 0.00 -2.10 0.00 0.00 70.33 66.99 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 0.99 0.03 -2.47 -0.78 -0.04 -1.26 -4.90 135.00 126.58 2cv4 n PRO 217 Ca 0.25 -0.01 -0.36 0.00 -0.04 0.00 0.00 63.50 63.35 2cv4 n PRO 217 Cb 0.50 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.43 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 -2.98 2.96 0.53 0.55 0.00 -1.26 -5.02 121.76 116.55 2cv4 s ALA 218 Ca 0.14 0.72 -0.18 0.00 0.00 0.00 0.00 51.96 52.64 2cv4 s ALA 218 Cb 0.19 -3.29 -0.07 0.00 0.00 0.00 0.00 23.12 19.95 2cv4 s ALA 218 CO 0.57 -0.37 1.03 -1.54 0.00 0.00 0.00 175.76 175.44 2cv4 s SER 219 N -1.69 6.21 0.39 0.00 1.04 -1.26 -4.88 113.70 113.52 2cv4 s SER 219 Ca 0.63 1.80 0.10 0.00 0.48 0.00 0.00 55.95 58.97 2cv4 s SER 219 Cb -0.21 -2.54 0.90 0.00 0.10 0.00 0.00 66.02 64.26 2cv4 s SER 219 CO 0.26 -0.87 1.94 -0.09 0.98 0.00 0.00 173.24 175.46 2cv4 h ARG 220 N 1.00 0.56 0.40 4.02 2.43 -1.98 -1.06 114.38 119.76 2cv4 h ARG 220 Ca -0.48 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 58.64 2cv4 h ARG 220 Cb 1.21 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 2cv4 h ARG 220 CO 0.59 0.37 -0.19 -0.44 -1.51 0.00 0.00 179.97 178.79 2cv4 h ASP 221 N 0.58 -0.45 -0.49 -3.80 3.32 -1.99 -0.78 116.42 112.81 2cv4 h ASP 221 Ca 0.34 -0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.48 2cv4 h ASP 221 Cb 0.53 0.12 -0.10 0.00 0.22 0.00 0.00 39.33 40.10 2cv4 h ASP 221 CO -0.12 -0.30 -0.17 0.44 -1.72 0.00 0.00 179.24 177.37 2cv4 h ASP 222 N -0.57 -0.60 0.27 6.45 3.32 -1.61 0.33 116.42 124.01 2cv4 h ASP 222 Ca -0.05 0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 2cv4 h ASP 222 Cb 0.43 0.36 -0.00 0.00 0.22 0.00 0.00 39.33 40.34 2cv4 h ASP 222 CO 0.09 -0.20 -0.15 0.58 -1.72 0.00 0.00 179.24 177.84 2cv4 h VAL 223 N -0.06 0.70 -0.75 -1.35 2.07 -1.14 -2.52 116.25 113.20 2cv4 h VAL 223 Ca 0.23 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.70 2cv4 h VAL 223 Cb 0.42 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 2cv4 h VAL 223 CO -0.53 0.00 0.25 -0.33 0.02 0.00 0.00 177.57 176.97 2cv4 h GLU 224 N -0.39 1.15 -0.56 1.57 5.08 -0.75 -0.05 114.58 120.63 2cv4 h GLU 224 Ca -0.03 -0.24 0.05 0.00 -1.00 0.00 0.00 59.36 58.14 2cv4 h GLU 224 Cb 0.31 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 29.34 2cv4 h GLU 224 CO 0.05 0.97 0.30 0.93 -1.00 0.00 0.00 179.01 180.25 2cv4 h GLU 225 N 1.11 0.55 -0.71 2.33 4.39 -0.89 0.50 114.58 121.85 2cv4 h GLU 225 Ca 0.24 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.90 2cv4 h GLU 225 Cb 0.29 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.78 2cv4 h GLU 225 CO -0.01 0.36 0.40 0.00 -1.16 0.00 0.00 179.01 178.60 2cv4 h ALA 226 N 1.30 0.91 -0.22 3.43 0.00 -1.09 -1.32 119.26 122.27 2cv4 h ALA 226 Ca 0.25 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 2cv4 h ALA 226 Cb 0.14 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2cv4 h ALA 226 CO -0.16 0.42 -0.29 -0.09 0.00 0.00 0.00 179.25 179.12 2cv4 h ARG 227 N 0.98 0.43 -0.95 0.00 2.43 -0.26 -2.88 114.38 114.13 2cv4 h ARG 227 Ca 0.25 -0.17 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2cv4 h ARG 227 Cb 0.03 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.51 2cv4 h ARG 227 CO -0.04 0.69 0.63 -0.09 -1.51 0.00 0.00 179.97 179.64 2cv4 h ARG 228 N 0.38 1.24 -0.80 0.20 2.43 0.11 -0.85 114.38 117.09 2cv4 h ARG 228 Ca 0.05 -0.07 0.04 0.00 -0.81 0.00 0.00 59.98 59.19 2cv4 h ARG 228 Cb 0.71 -0.28 -0.05 0.00 -0.42 0.00 0.00 29.97 29.93 2cv4 h ARG 228 CO 0.05 0.82 0.50 1.88 -1.51 0.00 0.00 179.97 181.72 2cv4 h TYR 229 N 1.28 0.94 -0.28 2.20 0.05 -1.18 -0.34 116.97 119.63 2cv4 h TYR 229 Ca 0.35 0.03 -0.18 0.00 0.05 0.00 0.00 58.73 58.97 2cv4 h TYR 229 Cb -0.14 -0.31 0.00 0.00 1.01 0.00 0.00 36.73 37.30 2cv4 h TYR 229 CO -0.00 0.51 -0.55 -0.07 -1.05 0.00 0.00 178.16 177.00 2cv4 h LEU 230 N 0.95 0.96 -0.32 3.88 4.07 -1.42 -2.13 115.31 121.29 2cv4 h LEU 230 Ca 0.33 -0.54 0.04 0.00 0.08 0.00 0.00 57.88 57.79 2cv4 h LEU 230 Cb 0.08 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 41.51 2cv4 h LEU 230 CO -0.14 1.32 0.11 -0.09 -1.08 0.00 0.00 178.44 178.56 2cv4 h ARG 231 N 0.63 0.24 -0.69 1.13 2.43 -0.52 0.23 114.38 117.83 2cv4 h ARG 231 Ca 0.01 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 2cv4 h ARG 231 Cb 1.16 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.62 2cv4 h ARG 231 CO 0.12 0.16 0.46 -0.09 -1.51 0.00 0.00 179.97 179.11 2cv4 h ARG 232 N 0.25 0.91 -0.04 0.20 2.43 -1.03 -0.43 114.38 116.67 2cv4 h ARG 232 Ca 0.15 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 2cv4 h ARG 232 Cb 0.12 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2cv4 h ARG 232 CO -0.15 0.60 -0.11 0.00 -1.51 0.00 0.00 179.97 178.80 2cv4 h ALA 233 N 1.26 1.73 0.00 2.80 0.00 -0.67 -2.85 119.26 121.53 2cv4 h ALA 233 Ca 0.25 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 2cv4 h ALA 233 Cb -0.11 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2cv4 h ALA 233 CO -0.06 0.20 -0.70 0.00 0.00 0.00 0.00 179.25 178.70 2cv4 h ALA 234 N 1.83 0.66 -2.33 0.00 0.00 0.30 -3.46 119.26 116.25 2cv4 h ALA 234 Ca 0.01 -0.53 -0.55 0.00 0.00 0.00 0.00 54.91 53.84 2cv4 h ALA 234 Cb 0.24 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2cv4 h ALA 234 CO 0.02 0.69 0.69 -1.21 0.00 0.00 0.00 179.25 179.44 2cv4 s GLU 235 N -2.95 4.36 0.14 0.00 2.02 -0.29 -4.98 118.70 116.98 2cv4 s GLU 235 Ca 0.03 1.70 -0.31 0.00 0.02 0.00 0.00 54.97 56.40 2cv4 s GLU 235 Cb 0.08 -3.54 -0.10 0.00 0.10 0.00 0.00 34.13 30.67 2cv4 s GLU 235 CO 0.76 -0.44 1.64 0.21 0.02 0.00 0.00 175.26 177.46 2cv4 s LYS 236 N 2.12 4.19 0.47 1.61 2.20 -1.26 -4.91 119.74 124.17 2cv4 s LYS 236 Ca 0.57 2.41 -0.24 0.00 -0.36 0.00 0.00 55.97 58.34 2cv4 s LYS 236 Cb -0.25 -3.33 -0.07 0.00 -1.51 0.00 0.00 37.83 32.66 2cv4 s LYS 236 CO 0.23 -0.69 1.36 -1.25 -0.36 0.00 0.00 175.35 174.64 2cv4 s PRO 237 N 1.79 3.58 -0.34 4.03 0.04 -1.26 -4.91 135.00 137.92 2cv4 s PRO 237 Ca 0.73 2.25 0.07 0.00 0.04 0.00 0.00 61.00 64.10 2cv4 s PRO 237 Cb -0.43 -2.53 0.69 0.00 0.04 0.00 0.00 34.50 32.26 2cv4 s PRO 237 CO 0.32 -0.85 1.79 0.00 0.04 0.00 0.00 177.00 178.30 2cv4 n ALA 238 N -0.42 4.77 0.00 8.56 0.00 -1.26 -4.67 120.51 127.50 2cv4 n ALA 238 Ca 0.07 -2.35 0.00 0.00 0.00 0.00 0.00 53.44 51.16 2cv4 n ALA 238 Cb 0.44 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 -0.39 0.00 -2.23 0.00 4.81 -1.26 -5.15 118.16 113.93 2cv4 n LYS 239 Ca 0.44 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.88 2cv4 n LYS 239 Cb 1.42 -0.01 0.00 0.00 0.02 0.00 0.00 35.03 36.46 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 -2.46 -6.42 0.00 3.14 4.77 -1.26 -4.83 117.00 109.94 2cv4 n LEU 240 Ca 0.00 3.09 0.10 0.00 -0.03 0.00 0.00 56.01 59.17 2cv4 n LEU 240 Cb 0.00 -3.23 0.56 0.00 -2.33 0.00 0.00 43.42 38.42 2cv4 n LEU 240 CO 0.00 -2.39 0.81 0.18 -1.33 0.00 0.00 177.39 174.66 2cv4 n LEU 241 N 1.88 0.00 0.00 2.23 4.77 -1.26 -5.24 117.00 119.39 2cv4 n LEU 241 Ca 0.00 0.15 0.14 0.00 -0.03 0.00 0.00 56.01 56.27 2cv4 n LEU 241 Cb 0.00 -0.15 0.82 0.00 -2.33 0.00 0.00 43.42 41.76 2cv4 n LEU 241 CO 0.00 -0.05 0.99 0.00 -1.33 0.00 0.00 177.39 177.00