#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vn2 n GLU 2 N 0.00 -0.33 0.03 0.03 4.07 -1.26 -2.70 120.64 120.48 2vn2 n GLU 2 Ca 0.00 1.18 -0.08 0.00 -0.06 0.00 0.00 57.16 58.20 2vn2 n GLU 2 Cb 0.00 -1.74 -0.13 0.00 -0.06 0.00 0.00 31.44 29.51 2vn2 n GLU 2 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 2vn2 h LYS 3 N 0.00 0.02 0.00 5.31 1.57 -2.05 -2.82 116.57 118.60 2vn2 h LYS 3 Ca 0.12 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2vn2 h LYS 3 Cb 0.31 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 2vn2 h LYS 3 CO -0.70 0.82 -0.02 -0.22 -0.57 0.00 0.00 179.45 178.76 2vn2 h LYS 4 N 0.01 0.00 0.10 3.15 3.11 -2.00 -2.39 116.57 118.55 2vn2 h LYS 4 Ca -0.13 0.00 -0.26 0.00 -2.81 0.00 0.00 60.65 57.45 2vn2 h LYS 4 Cb 1.88 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 33.10 2vn2 h LYS 4 CO 0.11 0.02 -1.34 -0.22 -2.81 0.00 0.00 179.45 175.21 2vn2 h LYS 5 N 0.00 0.21 -0.44 1.90 1.63 -1.50 -1.01 116.57 117.36 2vn2 h LYS 5 Ca -0.00 -0.36 0.05 0.00 -0.85 0.00 0.00 60.65 59.49 2vn2 h LYS 5 Cb 0.26 0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.98 2vn2 h LYS 5 CO 0.00 1.17 0.19 0.28 -3.45 0.00 0.00 179.45 177.64 2vn2 h VAL 6 N -0.40 0.91 -0.58 2.00 2.07 -1.51 -1.19 116.25 117.56 2vn2 h VAL 6 Ca -0.30 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.09 2vn2 h VAL 6 Cb 1.69 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 2vn2 h VAL 6 CO 0.03 0.07 0.36 0.00 0.02 0.00 0.00 177.57 178.05 2vn2 h ALA 7 N 1.26 0.73 -0.33 1.67 0.00 -1.47 0.24 119.26 121.36 2vn2 h ALA 7 Ca 0.20 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 2vn2 h ALA 7 Cb 0.15 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2vn2 h ALA 7 CO -0.17 0.20 -0.11 1.49 0.00 0.00 0.00 179.25 180.66 2vn2 h GLU 8 N 0.78 0.57 -0.00 0.00 4.81 -1.01 0.31 114.58 120.04 2vn2 h GLU 8 Ca 0.21 -0.17 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2vn2 h GLU 8 Cb -0.04 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 2vn2 h GLU 8 CO -0.04 0.67 0.00 -1.49 -0.73 0.00 0.00 179.01 177.42 2vn2 h TRP 9 N 0.53 0.01 -0.91 0.92 6.55 -0.71 -3.05 115.95 119.29 2vn2 h TRP 9 Ca 0.10 -0.00 0.14 0.00 0.95 0.00 0.00 58.89 60.07 2vn2 h TRP 9 Cb 0.50 -0.00 -0.07 0.00 -0.86 0.00 0.00 29.16 28.72 2vn2 h TRP 9 CO 0.02 0.19 0.58 -0.07 -1.05 0.00 0.00 178.44 178.11 2vn2 h LEU 10 N -0.17 0.71 0.00 -4.49 3.38 -0.54 -2.67 115.31 111.52 2vn2 h LEU 10 Ca 0.00 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2vn2 h LEU 10 Cb 0.18 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2vn2 h LEU 10 CO -0.00 0.36 0.00 0.00 0.09 0.00 0.00 178.44 178.89 2vn2 n ALA 11 N -2.42 2.05 0.10 1.53 0.00 0.06 -3.40 120.51 118.43 2vn2 n ALA 11 Ca 0.17 -0.09 -0.05 0.00 0.00 0.00 0.00 53.44 53.47 2vn2 n ALA 11 Cb 0.44 -1.31 0.06 0.00 0.00 0.00 0.00 19.45 18.64 2vn2 n ALA 11 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2vn2 h GLN 12 N 0.00 0.11 0.00 0.00 5.75 -1.43 -3.49 115.11 116.05 2vn2 h GLN 12 Ca 0.00 -0.10 0.00 0.00 -0.15 0.00 0.00 58.65 58.40 2vn2 h GLN 12 Cb 0.16 0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.73 2vn2 h GLN 12 CO 0.00 0.81 0.00 0.41 -2.65 0.00 0.00 178.83 177.40 2vn2 n GLY 13 N 0.60 -1.74 2.99 2.39 0.00 -1.22 -5.00 105.19 103.22 2vn2 n GLY 13 Ca -0.02 -1.31 -0.09 0.00 0.00 0.00 0.00 46.02 44.60 2vn2 n GLY 13 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vn2 s SER 14 N -4.00 0.28 -0.21 1.61 0.01 -1.26 -5.12 113.70 105.01 2vn2 s SER 14 Ca 0.00 -0.53 -0.14 0.00 1.31 0.00 0.00 55.95 56.59 2vn2 s SER 14 Cb 0.00 0.10 -0.04 0.00 0.21 0.00 0.00 66.02 66.29 2vn2 s SER 14 CO 0.00 -0.31 0.32 -0.63 0.41 0.00 0.00 173.24 173.02 2vn2 s ILE 15 N -1.61 5.26 -0.46 1.44 1.09 -1.26 -5.07 121.20 120.59 2vn2 s ILE 15 Ca -0.14 0.54 -0.26 0.00 -1.10 0.00 0.00 60.65 59.69 2vn2 s ILE 15 Cb -0.09 -3.65 0.03 0.00 -1.06 0.00 0.00 42.46 37.69 2vn2 s ILE 15 CO -0.01 0.30 0.96 0.00 -0.10 0.00 0.00 174.94 176.08 2vn2 s ALA 16 N 1.11 3.23 -0.40 9.38 0.00 -1.26 -5.01 121.76 128.80 2vn2 s ALA 16 Ca 0.16 -0.73 -0.14 0.00 0.00 0.00 0.00 51.96 51.24 2vn2 s ALA 16 Cb -0.14 -3.68 0.02 0.00 0.00 0.00 0.00 23.12 19.32 2vn2 s ALA 16 CO 0.06 -2.07 0.29 0.08 0.00 0.00 0.00 175.76 174.12 2vn2 s VAL 17 N 3.85 5.16 0.22 0.00 1.01 -1.26 -5.05 120.40 124.33 2vn2 s VAL 17 Ca 0.39 -0.68 -0.32 0.00 0.00 0.00 0.00 61.98 61.37 2vn2 s VAL 17 Cb -0.10 -3.87 -0.14 0.00 0.00 0.00 0.00 36.38 32.27 2vn2 s VAL 17 CO 0.27 -0.29 1.35 -2.65 0.00 0.00 0.00 175.10 173.78 2vn2 n PRO 18 N 5.14 1.82 0.25 2.72 -0.02 -1.26 -4.88 135.00 138.76 2vn2 n PRO 18 Ca -0.11 0.65 0.08 0.00 -2.02 0.00 0.00 63.50 62.10 2vn2 n PRO 18 Cb 0.47 -2.27 0.62 0.00 -0.02 0.00 0.00 33.50 32.30 2vn2 n PRO 18 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2vn2 h LYS 19 N 4.07 0.00 -0.49 -0.52 1.57 -1.98 -2.05 116.57 117.17 2vn2 h LYS 19 Ca -0.45 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.30 2vn2 h LYS 19 Cb 1.29 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.58 2vn2 h LYS 19 CO 0.75 0.13 0.16 -0.07 -0.57 0.00 0.00 179.45 179.85 2vn2 h LEU 20 N 0.00 0.71 -0.50 2.94 3.38 -1.97 0.70 115.31 120.56 2vn2 h LEU 20 Ca -0.00 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.66 2vn2 h LEU 20 Cb 0.26 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2vn2 h LEU 20 CO 0.02 0.72 -0.11 0.25 0.09 0.00 0.00 178.44 179.41 2vn2 h LEU 21 N 0.66 0.96 -0.40 1.67 5.85 -1.80 -3.01 115.31 119.24 2vn2 h LEU 21 Ca 0.16 -0.35 -0.16 0.00 0.84 0.00 0.00 57.88 58.36 2vn2 h LEU 21 Cb 0.26 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2vn2 h LEU 21 CO -0.01 1.09 -0.41 0.25 -0.34 0.00 0.00 178.44 179.03 2vn2 h LEU 22 N 0.82 0.97 -0.35 2.25 5.85 -1.32 0.12 115.31 123.64 2vn2 h LEU 22 Ca 0.13 -0.45 0.00 0.00 0.84 0.00 0.00 57.88 58.40 2vn2 h LEU 22 Cb 0.66 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.42 2vn2 h LEU 22 CO 0.05 1.25 0.00 0.61 -0.34 0.00 0.00 178.44 180.00 2vn2 n GLY 23 N 0.15 -1.30 0.00 3.75 0.00 0.23 -4.22 105.19 103.79 2vn2 n GLY 23 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2vn2 n GLY 23 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2vn2 n HIS 24 N -2.00 0.00 0.15 1.61 8.25 -0.99 -4.84 115.22 117.40 2vn2 n HIS 24 Ca 0.03 -0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.64 2vn2 n HIS 24 Cb 0.26 -0.00 0.71 0.00 1.12 0.00 0.00 29.99 32.08 2vn2 n HIS 24 CO 0.00 0.00 0.00 0.10 0.64 0.00 0.00 176.34 177.08 2vn2 h TYR 25 N 0.00 0.00 -0.00 4.41 -0.00 -0.95 -2.71 116.97 117.71 2vn2 h TYR 25 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.72 2vn2 h TYR 25 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.41 2vn2 h TYR 25 CO 0.00 0.00 -0.05 -0.22 -0.00 0.00 0.00 178.16 177.89 2vn2 h LYS 26 N 0.00 0.04 -1.59 0.10 1.63 -1.85 -0.32 116.57 114.58 2vn2 h LYS 26 Ca 0.11 -0.04 0.46 0.00 -0.85 0.00 0.00 60.65 60.33 2vn2 h LYS 26 Cb 0.47 0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 32.05 2vn2 h LYS 26 CO -0.00 0.77 1.14 1.96 -3.45 0.00 0.00 179.45 179.87 2vn2 h GLN 27 N -0.67 0.01 -0.00 1.90 4.20 -1.83 0.40 115.11 119.12 2vn2 h GLN 27 Ca -0.01 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 2vn2 h GLN 27 Cb 0.78 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.56 2vn2 h GLN 27 CO 0.01 0.01 -0.34 1.28 -0.67 0.00 0.00 178.83 179.12 2vn2 n LEU 28 N -4.09 0.52 0.00 1.46 4.32 -0.82 -4.93 117.00 113.46 2vn2 n LEU 28 Ca 0.36 0.02 0.00 0.00 -0.02 0.00 0.00 56.01 56.37 2vn2 n LEU 28 Cb 1.64 -0.25 0.00 0.00 -1.62 0.00 0.00 43.42 43.19 2vn2 n LEU 28 CO 0.41 0.12 0.00 0.61 -1.22 0.00 0.00 177.39 177.31 2vn2 n GLY 29 N 1.44 0.73 3.87 -0.72 0.00 0.13 -5.07 105.19 105.58 2vn2 n GLY 29 Ca 0.08 -0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 2vn2 n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vn2 s LEU 30 N 0.00 4.19 0.52 0.99 1.43 -0.19 -5.02 118.68 120.60 2vn2 s LEU 30 Ca 0.00 0.93 0.06 0.00 -1.03 0.00 0.00 54.13 54.10 2vn2 s LEU 30 Cb 0.00 -3.62 0.05 0.00 0.03 0.00 0.00 46.19 42.65 2vn2 s LEU 30 CO 0.00 -0.05 0.71 -0.83 0.23 0.00 0.00 176.35 176.42 2vn2 s GLY 31 N -2.27 1.85 0.23 -3.19 0.00 -1.26 -4.28 107.32 98.39 2vn2 s GLY 31 Ca 0.46 -1.74 0.01 0.00 0.00 0.00 0.00 44.72 43.44 2vn2 s GLY 31 CO 0.21 -1.43 1.58 0.83 0.00 0.00 0.00 173.10 174.29 2vn2 h GLU 32 N 0.29 0.44 -0.22 2.90 3.07 -1.99 -0.76 114.58 118.30 2vn2 h GLU 32 Ca -0.37 -0.25 -0.15 0.00 -0.50 0.00 0.00 59.36 58.09 2vn2 h GLU 32 Cb 1.28 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 29.20 2vn2 h GLU 32 CO 0.45 0.83 -0.47 0.78 -1.40 0.00 0.00 179.01 179.20 2vn2 h GLY 33 N 1.17 0.63 0.86 -3.84 0.00 -1.99 -1.48 103.07 98.43 2vn2 h GLY 33 Ca 0.02 -0.68 -0.01 0.00 0.00 0.00 0.00 47.33 46.66 2vn2 h GLY 33 CO 0.09 0.61 0.05 0.83 0.00 0.00 0.00 176.54 178.12 2vn2 h GLU 34 N 0.46 0.20 -0.32 4.80 5.08 -1.94 0.38 114.58 123.23 2vn2 h GLU 34 Ca 0.03 -0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.42 2vn2 h GLU 34 Cb 1.00 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 30.14 2vn2 h GLU 34 CO 0.09 0.31 -0.18 1.25 -1.00 0.00 0.00 179.01 179.48 2vn2 h LEU 35 N 0.04 -0.60 -0.70 1.33 5.85 -0.87 0.27 115.31 120.64 2vn2 h LEU 35 Ca 0.04 0.13 -0.10 0.00 0.84 0.00 0.00 57.88 58.79 2vn2 h LEU 35 Cb 0.19 0.32 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 2vn2 h LEU 35 CO -0.00 -0.22 -0.12 0.58 -0.34 0.00 0.00 178.44 178.35 2vn2 h VAL 36 N -0.14 1.26 -0.59 1.05 2.07 -1.15 -0.47 116.25 118.28 2vn2 h VAL 36 Ca 0.17 -1.22 0.09 0.00 0.82 0.00 0.00 66.70 66.55 2vn2 h VAL 36 Cb 0.39 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 31.11 2vn2 h VAL 36 CO -0.41 0.42 0.22 0.25 0.02 0.00 0.00 177.57 178.08 2vn2 h LEU 37 N 0.79 0.23 -1.45 2.57 5.85 0.40 -0.27 115.31 123.43 2vn2 h LEU 37 Ca 0.13 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.93 2vn2 h LEU 37 Cb 0.64 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 2vn2 h LEU 37 CO 0.04 0.14 0.37 -0.07 -0.34 0.00 0.00 178.44 178.59 2vn2 h LEU 38 N 0.41 0.64 -0.15 2.25 3.38 0.54 -0.65 115.31 121.73 2vn2 h LEU 38 Ca 0.29 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.21 2vn2 h LEU 38 Cb 0.35 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2vn2 h LEU 38 CO -0.29 0.46 -0.06 -0.07 0.09 0.00 0.00 178.44 178.57 2vn2 h LEU 39 N 0.76 0.32 -0.93 1.67 3.38 -0.47 0.00 115.31 120.03 2vn2 h LEU 39 Ca 0.21 -0.40 0.07 0.00 0.09 0.00 0.00 57.88 57.84 2vn2 h LEU 39 Cb -0.08 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.52 2vn2 h LEU 39 CO -0.05 0.65 0.59 0.45 0.09 0.00 0.00 178.44 180.17 2vn2 h HIS 40 N -0.01 1.09 -0.25 1.13 3.86 -0.75 -1.00 115.15 119.22 2vn2 h HIS 40 Ca 0.03 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.27 2vn2 h HIS 40 Cb 0.52 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 2vn2 h HIS 40 CO 0.06 0.55 0.12 0.52 0.86 0.00 0.00 177.93 180.05 2vn2 h MET 41 N 1.07 0.36 -0.57 2.45 2.86 -0.91 -0.65 114.93 119.54 2vn2 h MET 41 Ca 0.41 -0.05 0.07 0.00 -2.06 0.00 0.00 59.70 58.07 2vn2 h MET 41 Cb 0.18 -0.07 -0.06 0.00 0.06 0.00 0.00 31.60 31.71 2vn2 h MET 41 CO -0.18 0.36 0.24 0.37 1.06 0.00 0.00 176.91 178.76 2vn2 h GLN 42 N 0.28 0.43 -0.95 1.72 5.75 -0.80 -0.29 115.11 121.26 2vn2 h GLN 42 Ca 0.09 -0.03 0.01 0.00 -0.15 0.00 0.00 58.65 58.57 2vn2 h GLN 42 Cb 0.11 -0.10 -0.05 0.00 1.07 0.00 0.00 27.48 28.52 2vn2 h GLN 42 CO -0.01 0.29 0.62 1.03 -2.65 0.00 0.00 178.83 178.11 2vn2 h SER 43 N 0.45 1.10 -0.43 -0.69 0.87 -0.86 0.12 113.55 114.11 2vn2 h SER 43 Ca 0.27 -0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.78 2vn2 h SER 43 Cb 0.27 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 2vn2 h SER 43 CO -0.24 0.80 0.20 -0.26 -0.53 0.00 0.00 176.83 176.79 2vn2 h PHE 44 N 1.29 0.62 0.00 2.24 0.04 -0.55 -2.76 116.94 117.82 2vn2 h PHE 44 Ca 0.35 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 61.07 2vn2 h PHE 44 Cb -0.14 -0.19 -0.00 0.00 2.20 0.00 0.00 35.95 37.82 2vn2 h PHE 44 CO -0.00 0.52 -0.06 0.74 -0.60 0.00 0.00 178.31 178.91 2vn2 h PHE 45 N 0.55 0.00 0.00 -0.55 0.04 0.20 0.16 116.94 117.33 2vn2 h PHE 45 Ca 0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.92 2vn2 h PHE 45 Cb 0.14 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.29 2vn2 h PHE 45 CO -0.01 0.06 -0.55 0.93 -0.60 0.00 0.00 178.31 178.13 2vn2 h GLU 46 N 0.00 0.00 -0.35 1.51 5.08 -0.81 -2.74 114.58 117.26 2vn2 h GLU 46 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2vn2 h GLU 46 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2vn2 h GLU 46 CO 0.01 0.00 0.00 0.39 -1.00 0.00 0.00 179.01 178.41 2vn2 n GLU 47 N -2.25 2.02 -0.57 2.33 1.02 -0.96 -4.95 120.64 117.28 2vn2 n GLU 47 Ca 0.03 -1.56 0.00 0.00 -0.02 0.00 0.00 57.16 55.62 2vn2 n GLU 47 Cb 0.46 -1.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.48 2vn2 n GLU 47 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2vn2 n GLY 48 N 1.24 1.32 3.49 0.62 0.00 -1.03 -5.01 105.19 105.81 2vn2 n GLY 48 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2vn2 n GLY 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vn2 s VAL 49 N -3.36 4.13 -0.88 1.61 1.01 0.52 -4.88 120.40 118.55 2vn2 s VAL 49 Ca 0.00 -0.22 0.24 0.00 0.00 0.00 0.00 61.98 62.01 2vn2 s VAL 49 Cb 0.00 -4.79 -0.02 0.00 0.00 0.00 0.00 36.38 31.57 2vn2 s VAL 49 CO 0.00 -1.62 1.31 0.18 0.00 0.00 0.00 175.10 174.97 2vn2 n LEU 50 N 8.24 0.58 -3.17 3.92 4.32 -1.26 -2.78 117.00 126.85 2vn2 n LEU 50 Ca 0.02 0.01 -0.20 0.00 -0.02 0.00 0.00 56.01 55.83 2vn2 n LEU 50 Cb 0.47 -0.20 -0.04 0.00 -1.62 0.00 0.00 43.42 42.04 2vn2 n LEU 50 CO 0.66 0.09 -0.21 0.33 -1.22 0.00 0.00 177.39 177.04 2vn2 n PHE 51 N -1.68 0.43 -1.72 -1.77 7.35 -1.26 -0.95 117.46 117.85 2vn2 n PHE 51 Ca 0.04 -3.80 -0.38 0.00 -0.76 0.00 0.00 57.45 52.55 2vn2 n PHE 51 Cb 0.37 -0.42 0.05 0.00 0.35 0.00 0.00 39.48 39.83 2vn2 n PHE 51 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2vn2 n PRO 52 N 0.39 1.44 -1.88 -7.13 -0.04 -1.26 -4.98 135.00 121.54 2vn2 n PRO 52 Ca 0.25 0.54 -0.30 0.00 -0.04 0.00 0.00 63.50 63.95 2vn2 n PRO 52 Cb 0.62 -2.51 0.05 0.00 -0.04 0.00 0.00 33.50 31.61 2vn2 n PRO 52 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2vn2 s THR 53 N -1.34 3.51 0.32 0.52 -4.23 -1.26 -4.92 115.64 108.24 2vn2 s THR 53 Ca 0.75 0.49 0.11 0.00 -1.18 0.00 0.00 61.69 61.87 2vn2 s THR 53 Cb -0.41 -3.48 0.03 0.00 1.34 0.00 0.00 72.50 69.98 2vn2 s THR 53 CO 0.46 -0.64 1.71 -0.65 -0.54 0.00 0.00 174.62 174.97 2vn2 h PRO 54 N -0.65 0.00 -0.78 3.99 0.11 -1.94 -1.45 132.00 131.29 2vn2 h PRO 54 Ca -0.45 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 2vn2 h PRO 54 Cb 1.25 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 2vn2 h PRO 54 CO 0.64 0.51 0.28 0.00 -0.21 0.00 0.00 178.00 179.22 2vn2 h ALA 55 N 1.49 1.01 -0.30 -0.75 0.00 -1.94 0.18 119.26 118.95 2vn2 h ALA 55 Ca -0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2vn2 h ALA 55 Cb 0.89 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2vn2 h ALA 55 CO 0.07 0.66 0.10 0.93 0.00 0.00 0.00 179.25 181.01 2vn2 h GLU 56 N 1.14 0.45 -0.47 0.00 5.08 -1.81 -2.39 114.58 116.58 2vn2 h GLU 56 Ca 0.26 -0.09 0.02 0.00 -1.00 0.00 0.00 59.36 58.54 2vn2 h GLU 56 Cb 0.25 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 2vn2 h GLU 56 CO -0.02 0.49 0.31 -0.07 -1.00 0.00 0.00 179.01 178.72 2vn2 h LEU 57 N 0.32 0.50 0.00 1.33 3.38 -1.21 -3.02 115.31 116.62 2vn2 h LEU 57 Ca 0.10 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 2vn2 h LEU 57 Cb 0.22 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2vn2 h LEU 57 CO -0.01 0.36 -0.53 0.00 0.09 0.00 0.00 178.44 178.35 2vn2 h ALA 58 N 1.72 0.74 -0.94 1.53 0.00 -0.29 -3.33 119.26 118.68 2vn2 h ALA 58 Ca 0.18 -0.34 0.17 0.00 0.00 0.00 0.00 54.91 54.92 2vn2 h ALA 58 Cb 0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 17.68 2vn2 h ALA 58 CO -0.04 0.44 0.54 1.49 0.00 0.00 0.00 179.25 181.67 2vn2 h GLU 59 N 0.00 0.68 -0.48 0.00 4.57 -1.30 -1.41 114.58 116.64 2vn2 h GLU 59 Ca -0.02 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2vn2 h GLU 59 Cb 1.27 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.71 2vn2 h GLU 59 CO 0.04 0.45 0.00 0.54 -1.18 0.00 0.00 179.01 178.86 2vn2 n ARG 60 N -4.82 2.44 -3.77 1.92 1.74 -1.25 -4.99 116.66 107.94 2vn2 n ARG 60 Ca 0.21 -2.21 -0.22 0.00 -0.77 0.00 0.00 57.85 54.87 2vn2 n ARG 60 Cb 0.52 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.41 2vn2 n ARG 60 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2vn2 s MET 61 N -1.37 2.52 0.00 5.56 -1.94 -0.53 -5.03 119.30 118.52 2vn2 s MET 61 Ca 0.40 -1.51 0.29 0.00 -1.71 0.00 0.00 55.69 53.16 2vn2 s MET 61 Cb 0.22 -2.33 1.23 0.00 2.01 0.00 0.00 34.83 35.97 2vn2 s MET 61 CO 0.30 -0.07 1.88 0.25 -0.01 0.00 0.00 175.02 177.38 2vn2 n THR 62 N -1.41 0.00 -3.23 2.05 -2.24 -1.26 -4.86 114.28 103.33 2vn2 n THR 62 Ca 0.01 -0.02 -0.29 0.00 -2.27 0.00 0.00 64.05 61.47 2vn2 n THR 62 Cb 0.61 -0.25 -0.03 0.00 -2.10 0.00 0.00 70.33 68.56 2vn2 n THR 62 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2vn2 s VAL 63 N -2.67 4.96 0.82 2.28 -7.23 -1.26 -5.10 120.40 112.20 2vn2 s VAL 63 Ca 0.24 0.21 -0.12 0.00 -1.81 0.00 0.00 61.98 60.50 2vn2 s VAL 63 Cb 0.20 -3.73 0.08 0.00 0.56 0.00 0.00 36.38 33.49 2vn2 s VAL 63 CO 0.51 -0.36 1.12 -0.94 -0.31 0.00 0.00 175.10 175.12 2vn2 s SER 64 N -3.13 4.36 0.24 4.85 1.04 -1.26 -4.79 113.70 115.01 2vn2 s SER 64 Ca 0.46 1.13 -0.06 0.00 0.48 0.00 0.00 55.95 57.95 2vn2 s SER 64 Cb -0.11 -1.80 0.32 0.00 0.10 0.00 0.00 66.02 64.53 2vn2 s SER 64 CO 0.30 -2.03 1.84 0.00 0.98 0.00 0.00 173.24 174.33 2vn2 h ALA 65 N -1.13 1.13 -0.45 5.32 0.00 -1.90 -0.76 119.26 121.47 2vn2 h ALA 65 Ca -0.48 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.33 2vn2 h ALA 65 Cb 1.29 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 2vn2 h ALA 65 CO 0.61 0.24 -0.13 0.00 0.00 0.00 0.00 179.25 179.97 2vn2 h ALA 66 N 1.39 0.91 -0.64 0.00 0.00 -1.93 -0.49 119.26 118.50 2vn2 h ALA 66 Ca 0.36 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2vn2 h ALA 66 Cb 0.17 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2vn2 h ALA 66 CO -0.17 0.63 0.25 0.93 0.00 0.00 0.00 179.25 180.88 2vn2 h GLU 67 N 0.75 0.96 -0.66 0.00 5.08 -1.81 -1.52 114.58 117.38 2vn2 h GLU 67 Ca 0.12 -0.18 0.05 0.00 -1.00 0.00 0.00 59.36 58.35 2vn2 h GLU 67 Cb 0.64 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.69 2vn2 h GLU 67 CO 0.04 0.81 0.39 0.00 -1.00 0.00 0.00 179.01 179.25 2vn2 h MET 69 N 0.73 1.00 -0.62 0.00 1.85 -0.83 0.03 114.93 117.09 2vn2 h MET 69 Ca 0.29 -0.23 -0.01 0.00 -0.61 0.00 0.00 59.70 59.13 2vn2 h MET 69 Cb 0.12 -0.14 -0.03 0.00 0.43 0.00 0.00 31.60 31.99 2vn2 h MET 69 CO -0.15 0.90 0.33 0.93 -0.40 0.00 0.00 176.91 178.51 2vn2 h GLU 70 N 0.93 0.87 -0.48 0.39 5.08 -0.56 0.17 114.58 120.98 2vn2 h GLU 70 Ca 0.20 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.39 2vn2 h GLU 70 Cb 0.33 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2vn2 h GLU 70 CO -0.00 0.67 0.06 0.52 -1.00 0.00 0.00 179.01 179.26 2vn2 h MET 71 N 0.84 0.80 -0.19 2.33 2.86 -0.24 0.37 114.93 121.71 2vn2 h MET 71 Ca 0.22 -0.22 0.03 0.00 -2.06 0.00 0.00 59.70 57.66 2vn2 h MET 71 Cb 0.06 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.60 2vn2 h MET 71 CO -0.03 0.82 -0.01 0.28 1.06 0.00 0.00 176.91 179.03 2vn2 h VAL 72 N 0.67 0.86 -0.52 -2.22 2.07 -0.80 0.23 116.25 116.55 2vn2 h VAL 72 Ca 0.14 -0.02 0.09 0.00 0.82 0.00 0.00 66.70 67.74 2vn2 h VAL 72 Cb 0.41 0.81 -0.07 0.00 -1.52 0.00 0.00 31.29 30.92 2vn2 h VAL 72 CO 0.01 0.01 0.09 0.03 0.02 0.00 0.00 177.57 177.73 2vn2 h ARG 73 N 0.05 0.22 -0.40 1.57 3.08 -0.32 0.28 114.38 118.86 2vn2 h ARG 73 Ca 0.09 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 2vn2 h ARG 73 Cb 0.11 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2vn2 h ARG 73 CO -0.15 0.14 -0.01 -0.09 -1.07 0.00 0.00 179.97 178.79 2vn2 h ARG 74 N 0.22 0.65 -0.53 0.04 2.43 -0.41 -1.86 114.38 114.93 2vn2 h ARG 74 Ca 0.26 -0.16 -0.12 0.00 -0.81 0.00 0.00 59.98 59.16 2vn2 h ARG 74 Cb 0.37 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 2vn2 h ARG 74 CO -0.35 0.68 -0.13 -0.07 -1.51 0.00 0.00 179.97 178.59 2vn2 h LEU 75 N 0.61 1.02 -0.10 3.80 3.38 0.28 -0.40 115.31 123.91 2vn2 h LEU 75 Ca 0.12 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 57.76 2vn2 h LEU 75 Cb 0.40 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2vn2 h LEU 75 CO 0.02 1.15 -0.04 -0.07 0.09 0.00 0.00 178.44 179.58 2vn2 h LEU 76 N 0.88 -0.14 -1.01 1.67 3.38 -0.71 -1.95 115.31 117.44 2vn2 h LEU 76 Ca 0.13 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 2vn2 h LEU 76 Cb 0.70 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 2vn2 h LEU 76 CO 0.05 -0.06 0.47 1.56 0.09 0.00 0.00 178.44 180.56 2vn2 h GLN 77 N -0.03 1.16 0.00 1.13 4.20 -1.30 -1.36 115.11 118.91 2vn2 h GLN 77 Ca 0.05 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.64 2vn2 h GLN 77 Cb 0.11 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.66 2vn2 h GLN 77 CO -0.12 0.84 0.00 1.63 -0.67 0.00 0.00 178.83 180.51 2vn2 n LYS 78 N -4.35 0.14 -2.25 1.46 5.02 -0.17 -4.91 118.16 113.10 2vn2 n LYS 78 Ca 0.09 0.23 -0.04 0.00 -2.02 0.00 0.00 58.31 56.57 2vn2 n LYS 78 Cb 0.09 -1.70 0.00 0.00 -0.02 0.00 0.00 35.03 33.40 2vn2 n LYS 78 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2vn2 n GLY 79 N 0.73 0.34 0.08 0.72 0.00 -0.51 -4.94 105.19 101.61 2vn2 n GLY 79 Ca 0.05 -0.66 -0.09 0.00 0.00 0.00 0.00 46.02 45.31 2vn2 n GLY 79 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2vn2 n MET 80 N -1.36 0.64 -4.40 1.61 2.81 -0.79 -3.89 117.12 111.74 2vn2 n MET 80 Ca -0.03 0.28 -0.20 0.00 -1.81 0.00 0.00 57.70 55.94 2vn2 n MET 80 Cb 0.53 -1.78 -0.10 0.00 -0.71 0.00 0.00 33.22 31.16 2vn2 n MET 80 CO 0.00 0.00 0.00 0.96 1.51 0.00 0.00 175.97 178.44 2vn2 s ILE 81 N -2.59 1.09 0.11 2.02 -4.36 -1.19 -1.97 121.20 114.31 2vn2 s ILE 81 Ca -0.05 -2.02 -0.07 0.00 -0.26 0.00 0.00 60.65 58.25 2vn2 s ILE 81 Cb 0.08 -2.62 -0.01 0.00 1.25 0.00 0.00 42.46 41.15 2vn2 s ILE 81 CO 0.82 -0.11 0.16 0.00 0.24 0.00 0.00 174.94 176.05 2vn2 s ALA 82 N -3.37 0.06 0.06 2.27 0.00 -0.87 -4.36 121.76 115.55 2vn2 s ALA 82 Ca 0.34 -0.87 0.01 0.00 0.00 0.00 0.00 51.96 51.44 2vn2 s ALA 82 Cb 0.07 0.58 -0.04 0.00 0.00 0.00 0.00 23.12 23.74 2vn2 s ALA 82 CO 0.13 -0.52 0.17 0.42 0.00 0.00 0.00 175.76 175.97 2vn2 s ILE 83 N -3.92 5.16 0.08 0.00 1.01 -1.26 -0.48 121.20 121.79 2vn2 s ILE 83 Ca 0.10 -0.48 -0.09 0.00 0.00 0.00 0.00 60.65 60.18 2vn2 s ILE 83 Cb 0.05 -3.50 -0.00 0.00 0.01 0.00 0.00 42.46 39.02 2vn2 s ILE 83 CO -0.07 0.15 0.19 -1.61 0.00 0.00 0.00 174.94 173.60 2vn2 s GLU 84 N -2.45 0.81 0.00 2.79 2.02 -0.17 -4.95 118.70 116.76 2vn2 s GLU 84 Ca 0.33 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.43 2vn2 s GLU 84 Cb -0.13 0.33 0.00 0.00 0.10 0.00 0.00 34.13 34.43 2vn2 s GLU 84 CO 0.26 -0.25 0.00 -1.91 0.02 0.00 0.00 175.26 173.38 2vn2 n GLU 85 N 0.09 0.00 0.02 1.61 4.07 -1.26 0.20 120.64 125.37 2vn2 n GLU 85 Ca -0.16 0.00 0.11 0.00 -0.06 0.00 0.00 57.16 57.05 2vn2 n GLU 85 Cb 0.62 0.00 0.02 0.00 -0.06 0.00 0.00 31.44 32.02 2vn2 n GLU 85 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 2vn2 n GLU 95 N 0.00 0.22 -3.93 5.31 -0.00 -1.26 -5.71 120.64 115.27 2vn2 n GLU 95 Ca 0.00 -0.01 -0.10 0.00 -0.00 0.00 0.00 57.16 57.05 2vn2 n GLU 95 Cb 0.00 -1.57 -0.12 0.00 -0.00 0.00 0.00 31.44 29.76 2vn2 n GLU 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.13 175.54 2vn2 s LYS 96 N -3.15 0.23 0.38 3.44 -2.85 0.13 -4.48 119.74 113.44 2vn2 s LYS 96 Ca 0.05 -0.39 -0.23 0.00 -1.00 0.00 0.00 55.97 54.40 2vn2 s LYS 96 Cb 0.15 0.09 -0.10 0.00 -2.06 0.00 0.00 37.83 35.90 2vn2 s LYS 96 CO 0.80 -0.04 0.93 0.71 0.10 0.00 0.00 175.35 177.85 2vn2 s TYR 97 N -0.99 3.46 0.04 1.78 2.02 -0.13 -1.00 117.35 122.54 2vn2 s TYR 97 Ca -0.11 1.65 0.04 0.00 -0.37 0.00 0.00 57.07 58.28 2vn2 s TYR 97 Cb -0.07 -2.85 -0.02 0.00 -0.40 0.00 0.00 41.96 38.62 2vn2 s TYR 97 CO -0.00 0.03 -0.13 -0.08 -1.57 0.00 0.00 175.55 173.80 2vn2 s THR 98 N -1.94 1.02 -2.64 -0.71 -1.32 0.37 -4.94 115.64 105.48 2vn2 s THR 98 Ca 0.57 -0.98 0.25 0.00 -1.21 0.00 0.00 61.69 60.32 2vn2 s THR 98 Cb -0.13 -0.93 0.40 0.00 -1.51 0.00 0.00 72.50 70.32 2vn2 s THR 98 CO 0.17 -0.04 1.50 0.18 -2.21 0.00 0.00 174.62 174.23 2vn2 n LEU 99 N 1.89 2.29 -0.30 9.08 4.32 -1.26 -2.05 117.00 130.96 2vn2 n LEU 99 Ca -0.18 -0.83 0.05 0.00 -0.02 0.00 0.00 56.01 55.03 2vn2 n LEU 99 Cb 0.55 -0.05 0.11 0.00 -1.62 0.00 0.00 43.42 42.41 2vn2 n LEU 99 CO 0.23 0.41 0.55 1.21 -1.22 0.00 0.00 177.39 178.57 2vn2 n GLU 100 N 0.77 -0.08 -0.28 3.23 4.07 -1.26 -0.80 120.64 126.29 2vn2 n GLU 100 Ca 0.17 1.31 0.01 0.00 -0.06 0.00 0.00 57.16 58.59 2vn2 n GLU 100 Cb 0.47 -1.96 0.21 0.00 -0.06 0.00 0.00 31.44 30.10 2vn2 n GLU 100 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 2vn2 h PRO 101 N 0.00 1.08 -0.47 5.31 0.11 -1.80 -1.67 132.00 134.56 2vn2 h PRO 101 Ca 0.40 -0.07 0.08 0.00 0.11 0.00 0.00 66.00 66.53 2vn2 h PRO 101 Cb 0.61 -0.24 -0.07 0.00 0.11 0.00 0.00 31.00 31.40 2vn2 h PRO 101 CO -0.87 0.72 0.06 1.25 -0.21 0.00 0.00 178.00 178.95 2vn2 h LEU 102 N 1.12 -0.07 -1.31 2.35 5.85 -0.31 -1.96 115.31 120.98 2vn2 h LEU 102 Ca 0.32 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 59.08 2vn2 h LEU 102 Cb -0.07 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2vn2 h LEU 102 CO -0.08 -0.00 -0.17 -0.50 -0.34 0.00 0.00 178.44 177.34 2vn2 h TRP 103 N 0.19 0.27 -0.18 1.25 4.06 -0.91 -0.53 115.95 120.10 2vn2 h TRP 103 Ca 0.24 -0.04 -0.04 0.00 2.06 0.00 0.00 58.89 61.11 2vn2 h TRP 103 Cb 0.33 -0.07 -0.01 0.00 -1.00 0.00 0.00 29.16 28.41 2vn2 h TRP 103 CO -0.25 0.42 -0.05 0.93 -3.56 0.00 0.00 178.44 175.94 2vn2 h GLU 104 N 0.24 0.36 -0.58 0.49 5.08 -1.01 0.41 114.58 119.57 2vn2 h GLU 104 Ca 0.05 -0.14 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2vn2 h GLU 104 Cb 0.45 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 2vn2 h GLU 104 CO 0.03 0.62 0.35 0.87 -1.00 0.00 0.00 179.01 179.88 2vn2 h LYS 105 N 0.07 0.79 -0.44 2.33 1.57 -1.02 -2.11 116.57 117.76 2vn2 h LYS 105 Ca 0.05 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 2vn2 h LYS 105 Cb 0.49 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 2vn2 h LYS 105 CO 0.02 0.57 0.07 1.25 -0.57 0.00 0.00 179.45 180.78 2vn2 h LEU 106 N 0.78 0.69 -1.20 2.94 5.85 -0.90 -1.82 115.31 121.65 2vn2 h LEU 106 Ca 0.21 -0.26 0.06 0.00 0.84 0.00 0.00 57.88 58.72 2vn2 h LEU 106 Cb -0.02 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.78 2vn2 h LEU 106 CO -0.04 0.78 0.56 0.58 -0.34 0.00 0.00 178.44 179.98 2vn2 h VAL 107 N 0.58 1.07 0.26 1.05 2.07 0.08 0.28 116.25 121.65 2vn2 h VAL 107 Ca 0.13 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 2vn2 h VAL 107 Cb 0.38 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 2vn2 h VAL 107 CO 0.01 0.18 -0.19 -0.74 0.02 0.00 0.00 177.57 176.85 2vn2 h HIS 108 N 0.98 -0.49 -0.16 1.57 -0.00 -0.88 0.13 115.15 116.29 2vn2 h HIS 108 Ca 0.36 -0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.76 2vn2 h HIS 108 Cb 0.17 0.18 -0.03 0.00 -0.00 0.00 0.00 27.41 27.74 2vn2 h HIS 108 CO -0.00 -0.29 -0.02 1.25 -0.00 0.00 0.00 177.93 178.87 2vn2 h HIS 109 N -0.45 -0.04 -0.69 5.26 6.17 -1.18 0.38 115.15 124.60 2vn2 h HIS 109 Ca -0.02 0.01 -0.05 0.00 0.71 0.00 0.00 60.37 61.02 2vn2 h HIS 109 Cb 0.39 0.04 -0.03 0.00 2.52 0.00 0.00 27.41 30.33 2vn2 h HIS 109 CO -0.11 -0.04 0.23 -0.07 0.71 0.00 0.00 177.93 178.65 2vn2 h LEU 110 N 0.03 0.97 0.20 0.26 3.38 -0.79 0.11 115.31 119.48 2vn2 h LEU 110 Ca 0.08 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2vn2 h LEU 110 Cb 0.10 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2vn2 h LEU 110 CO -0.14 0.89 -0.10 1.88 0.09 0.00 0.00 178.44 181.06 2vn2 h TYR 111 N 1.02 -0.25 0.13 1.13 -1.99 -0.14 -2.02 116.97 114.84 2vn2 h TYR 111 Ca 0.23 -0.01 0.01 0.00 2.00 0.00 0.00 58.73 60.97 2vn2 h TYR 111 Cb 0.26 0.08 -0.05 0.00 2.00 0.00 0.00 36.73 39.02 2vn2 h TYR 111 CO 0.02 -0.15 -0.50 1.15 -0.00 0.00 0.00 178.16 178.68 2vn2 h THR 112 N -0.28 0.05 -1.01 -2.88 2.02 -0.08 0.79 112.91 111.52 2vn2 h THR 112 Ca -0.03 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.24 2vn2 h THR 112 Cb 0.21 0.05 -0.08 0.00 -1.74 0.00 0.00 68.15 66.59 2vn2 h THR 112 CO 0.05 0.00 0.64 -0.61 0.37 0.00 0.00 175.52 175.97 2vn2 h GLN 113 N -0.74 1.07 -0.61 6.66 4.15 -0.80 0.31 115.11 125.14 2vn2 h GLN 113 Ca 0.00 -0.06 0.03 0.00 0.77 0.00 0.00 58.65 59.39 2vn2 h GLN 113 Cb 0.75 -0.24 -0.04 0.00 0.21 0.00 0.00 27.48 28.16 2vn2 h GLN 113 CO -0.27 0.71 0.37 0.00 -1.93 0.00 0.00 178.83 177.71 2vn2 h ALA 114 N 1.49 0.79 -0.15 3.38 0.00 -1.15 -2.80 119.26 120.82 2vn2 h ALA 114 Ca 0.46 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.24 2vn2 h ALA 114 Cb 0.32 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2vn2 h ALA 114 CO -0.22 0.11 -0.41 0.00 0.00 0.00 0.00 179.25 178.73 2vn2 h ALA 115 N 1.27 1.01 -0.02 0.00 0.00 0.67 -0.57 119.26 121.62 2vn2 h ALA 115 Ca 0.25 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2vn2 h ALA 115 Cb 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2vn2 h ALA 115 CO -0.10 0.61 0.00 0.00 0.00 0.00 0.00 179.25 179.76 2vn2 n GLN 116 N -4.02 1.27 -0.37 0.00 10.64 -0.05 -3.33 117.38 121.51 2vn2 n GLN 116 Ca -0.02 -0.39 0.09 0.00 -1.83 0.00 0.00 57.00 54.85 2vn2 n GLN 116 Cb 0.50 -1.45 0.24 0.00 -0.86 0.00 0.00 30.24 28.66 2vn2 n GLN 116 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 2vn2 n GLN 117 N -0.49 2.65 0.00 2.61 6.02 -0.92 -4.98 117.38 122.27 2vn2 n GLN 117 Ca 0.20 -2.77 0.00 0.00 -0.01 0.00 0.00 57.00 54.42 2vn2 n GLN 117 Cb 0.20 -1.77 0.00 0.00 1.02 0.00 0.00 30.24 29.69 2vn2 n GLN 117 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2vn2 n GLY 118 N -0.64 2.22 0.00 1.08 0.00 -1.21 -4.51 105.19 102.13 2vn2 n GLY 118 Ca 0.20 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.46 2vn2 n GLY 118 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2vn2 n GLU 119 N 0.00 0.00 0.00 1.61 4.07 -0.27 -4.76 120.64 121.29 2vn2 n GLU 119 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2vn2 n GLU 119 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 2vn2 n GLU 119 CO 0.00 0.00 0.00 1.47 -0.06 0.00 0.00 177.13 178.54