#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vl4 n ASP 29 N 0.00 -0.52 -0.25 1.20 5.68 -1.26 -4.63 116.55 116.77 2vl4 n ASP 29 Ca 0.00 -1.55 0.15 0.00 -0.50 0.00 0.00 54.79 52.89 2vl4 n ASP 29 Cb 0.00 0.93 0.73 0.00 -1.14 0.00 0.00 41.12 41.63 2vl4 n ASP 29 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2vl4 n THR 30 N -0.17 0.00 -1.53 2.12 -2.24 0.69 -4.89 114.28 108.26 2vl4 n THR 30 Ca -0.01 -0.13 -0.33 0.00 -2.27 0.00 0.00 64.05 61.31 2vl4 n THR 30 Cb 0.18 0.02 0.08 0.00 -2.10 0.00 0.00 70.33 68.51 2vl4 n THR 30 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2vl4 s SER 31 N -2.01 4.57 -0.08 3.42 1.04 -1.26 -4.86 113.70 114.53 2vl4 s SER 31 Ca 0.43 2.14 0.03 0.00 0.48 0.00 0.00 55.95 59.03 2vl4 s SER 31 Cb 0.21 -2.56 -0.01 0.00 0.10 0.00 0.00 66.02 63.76 2vl4 s SER 31 CO 0.35 -2.00 -0.19 -0.70 0.98 0.00 0.00 173.24 171.69 2vl4 s GLU 32 N -4.11 2.84 -0.16 4.02 2.12 -0.07 -4.97 118.70 118.37 2vl4 s GLU 32 Ca 0.69 -0.78 -0.03 0.00 0.36 0.00 0.00 54.97 55.21 2vl4 s GLU 32 Cb -0.24 -2.37 -0.02 0.00 0.26 0.00 0.00 34.13 31.75 2vl4 s GLU 32 CO 0.45 0.37 -0.05 0.08 -0.54 0.00 0.00 175.26 175.57 2vl4 s VAL 33 N -0.10 3.76 -0.25 3.70 1.01 -1.26 -0.91 120.40 126.34 2vl4 s VAL 33 Ca -0.03 -0.40 -0.08 0.00 0.00 0.00 0.00 61.98 61.47 2vl4 s VAL 33 Cb -0.14 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 2vl4 s VAL 33 CO 0.04 0.49 0.08 -0.04 0.00 0.00 0.00 175.10 175.67 2vl4 s MET 34 N 0.46 3.66 -0.17 2.72 -1.94 0.85 -4.97 119.30 119.92 2vl4 s MET 34 Ca -0.04 -0.48 -0.26 0.00 -1.71 0.00 0.00 55.69 53.20 2vl4 s MET 34 Cb -0.14 -3.36 -0.01 0.00 2.01 0.00 0.00 34.83 33.32 2vl4 s MET 34 CO 0.03 -0.20 0.88 -0.51 -0.01 0.00 0.00 175.02 175.21 2vl4 s LEU 35 N 1.63 4.18 -1.22 -0.03 1.43 -1.26 -0.84 118.68 122.56 2vl4 s LEU 35 Ca 0.06 1.24 -0.11 0.00 -1.03 0.00 0.00 54.13 54.30 2vl4 s LEU 35 Cb -0.15 -3.31 0.19 0.00 0.03 0.00 0.00 46.19 42.95 2vl4 s LEU 35 CO 0.04 -0.43 1.60 0.18 0.23 0.00 0.00 176.35 177.97 2vl4 n LEU 36 N 5.31 5.96 -0.01 1.79 4.77 -0.18 -4.66 117.00 129.98 2vl4 n LEU 36 Ca 0.06 -4.65 0.00 0.00 -0.03 0.00 0.00 56.01 51.39 2vl4 n LEU 36 Cb 0.48 -1.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.06 2vl4 n LEU 36 CO 0.49 1.14 0.39 -0.90 -1.33 0.00 0.00 177.39 177.18 2vl4 n ASP 37 N 4.27 1.09 -4.07 -1.43 5.75 -1.26 -4.53 116.55 116.37 2vl4 n ASP 37 Ca 0.36 -1.59 -0.08 0.00 -0.01 0.00 0.00 54.79 53.47 2vl4 n ASP 37 Cb 0.39 -0.02 -0.09 0.00 -1.03 0.00 0.00 41.12 40.37 2vl4 n ASP 37 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2vl4 s THR 38 N -0.59 0.16 -0.08 2.12 -4.23 -1.26 -4.52 115.64 107.24 2vl4 s THR 38 Ca 0.01 -1.74 0.00 0.00 -1.18 0.00 0.00 61.69 58.78 2vl4 s THR 38 Cb 0.01 -1.69 0.00 0.00 1.34 0.00 0.00 72.50 72.16 2vl4 s THR 38 CO 0.00 -0.74 0.00 0.61 -0.54 0.00 0.00 174.62 173.95 2vl4 n GLY 39 N 0.00 0.47 3.77 3.99 0.00 -1.26 -4.92 105.19 107.25 2vl4 n GLY 39 Ca -0.11 -0.24 -0.38 0.00 0.00 0.00 0.00 46.02 45.30 2vl4 n GLY 39 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2vl4 s TRP 40 N -1.92 3.80 0.20 1.61 0.52 -1.26 -4.52 118.94 117.37 2vl4 s TRP 40 Ca 0.00 1.78 0.09 0.00 0.02 0.00 0.00 56.10 57.99 2vl4 s TRP 40 Cb 0.00 -2.90 -0.05 0.00 -1.15 0.00 0.00 33.47 29.37 2vl4 s TRP 40 CO 0.00 0.32 -0.17 -1.21 0.02 0.00 0.00 176.95 175.91 2vl4 s GLU 41 N -1.71 1.37 0.15 4.98 2.02 -0.09 -0.31 118.70 125.11 2vl4 s GLU 41 Ca 0.46 -1.56 0.03 0.00 0.02 0.00 0.00 54.97 53.92 2vl4 s GLU 41 Cb -0.21 -1.31 -0.04 0.00 0.10 0.00 0.00 34.13 32.66 2vl4 s GLU 41 CO 0.26 0.24 -0.05 -0.59 0.02 0.00 0.00 175.26 175.14 2vl4 s PHE 42 N -2.56 1.18 -0.15 1.61 -0.12 0.44 -1.31 117.98 117.08 2vl4 s PHE 42 Ca 0.21 -0.89 -0.12 0.00 -0.05 0.00 0.00 56.93 56.08 2vl4 s PHE 42 Cb -0.03 -0.65 0.04 0.00 -0.63 0.00 0.00 43.02 41.75 2vl4 s PHE 42 CO 0.08 -0.08 0.38 0.45 -0.05 0.00 0.00 175.22 176.01 2vl4 s SER 43 N -3.15 -0.41 -0.06 1.98 0.15 -0.12 -1.51 113.70 110.58 2vl4 s SER 43 Ca 0.19 0.78 -0.30 0.00 0.70 0.00 0.00 55.95 57.32 2vl4 s SER 43 Cb 0.05 0.76 -0.05 0.00 -1.71 0.00 0.00 66.02 65.06 2vl4 s SER 43 CO 0.01 -0.14 1.62 -1.58 1.20 0.00 0.00 173.24 174.34 2vl4 s GLN 44 N 0.44 4.19 0.29 5.44 0.74 -1.26 -1.33 119.66 128.16 2vl4 s GLN 44 Ca -0.02 2.14 -0.30 0.00 0.05 0.00 0.00 55.36 57.24 2vl4 s GLN 44 Cb -0.04 -3.97 -0.13 0.00 1.10 0.00 0.00 33.01 29.98 2vl4 s GLN 44 CO -0.02 -0.83 1.38 0.43 -0.55 0.00 0.00 175.29 175.70 2vl4 n SER 45 N 7.08 2.88 0.00 6.67 7.64 -0.20 -1.56 113.62 136.13 2vl4 n SER 45 Ca 0.17 1.17 0.00 0.00 1.01 0.00 0.00 58.87 61.22 2vl4 n SER 45 Cb 0.43 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.16 2vl4 n SER 45 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vl4 n GLY 46 N 1.61 1.55 0.08 0.23 0.00 -1.26 -4.84 105.19 102.57 2vl4 n GLY 46 Ca 0.09 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.17 2vl4 n GLY 46 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2vl4 n THR 47 N -2.00 0.72 -1.21 2.61 -2.24 -0.60 -4.94 114.28 106.62 2vl4 n THR 47 Ca 0.00 -0.61 -0.09 0.00 -2.27 0.00 0.00 64.05 61.08 2vl4 n THR 47 Cb 0.00 -0.40 -0.04 0.00 -2.10 0.00 0.00 70.33 67.79 2vl4 n THR 47 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2vl4 n GLU 48 N -2.66 -1.73 -3.88 -0.78 1.02 -1.26 -4.95 120.64 106.40 2vl4 n GLU 48 Ca -0.06 0.77 -0.36 0.00 -0.02 0.00 0.00 57.16 57.49 2vl4 n GLU 48 Cb 0.69 -5.11 -0.11 0.00 -0.02 0.00 0.00 31.44 26.90 2vl4 n GLU 48 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2vl4 s LYS 49 N -2.65 3.87 0.02 3.49 2.20 -1.26 -5.10 119.74 120.32 2vl4 s LYS 49 Ca 0.00 -0.38 0.06 0.00 -0.36 0.00 0.00 55.97 55.29 2vl4 s LYS 49 Cb 0.00 -3.31 -0.03 0.00 -1.51 0.00 0.00 37.83 32.98 2vl4 s LYS 49 CO 0.00 0.07 -0.16 -1.58 -0.36 0.00 0.00 175.35 173.32 2vl4 s TRP 50 N 0.95 2.62 0.04 4.03 0.52 -1.26 -4.33 118.94 121.51 2vl4 s TRP 50 Ca 0.04 -0.21 -0.01 0.00 0.02 0.00 0.00 56.10 55.94 2vl4 s TRP 50 Cb -0.14 -1.50 -0.04 0.00 -1.15 0.00 0.00 33.47 30.64 2vl4 s TRP 50 CO 0.03 0.26 -0.03 -1.64 0.02 0.00 0.00 176.95 175.59 2vl4 s MET 51 N -1.35 0.55 0.40 4.98 -1.94 -0.57 -4.96 119.30 116.41 2vl4 s MET 51 Ca 0.15 -1.09 -0.26 0.00 -1.71 0.00 0.00 55.69 52.78 2vl4 s MET 51 Cb -0.11 0.19 -0.10 0.00 2.01 0.00 0.00 34.83 36.82 2vl4 s MET 51 CO 0.05 -0.10 1.30 -2.30 -0.01 0.00 0.00 175.02 173.96 2vl4 n PRO 52 N 0.42 2.05 -4.46 2.03 -0.02 -1.26 -0.42 135.00 133.35 2vl4 n PRO 52 Ca -0.16 0.73 -0.22 0.00 -2.02 0.00 0.00 63.50 61.82 2vl4 n PRO 52 Cb 0.60 -2.41 -0.10 0.00 -0.02 0.00 0.00 33.50 31.56 2vl4 n PRO 52 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vl4 s ALA 53 N -1.17 2.45 -0.14 3.55 0.00 0.57 -4.68 121.76 122.35 2vl4 s ALA 53 Ca 0.59 -1.99 0.00 0.00 0.00 0.00 0.00 51.96 50.56 2vl4 s ALA 53 Cb -0.51 0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.91 2vl4 s ALA 53 CO 0.59 -0.14 -0.15 0.99 0.00 0.00 0.00 175.76 177.06 2vl4 s THR 54 N -3.05 2.81 -0.05 0.00 2.01 -1.26 -4.40 115.64 111.70 2vl4 s THR 54 Ca 0.32 -0.74 0.01 0.00 0.31 0.00 0.00 61.69 61.59 2vl4 s THR 54 Cb 0.06 -2.18 0.02 0.00 0.01 0.00 0.00 72.50 70.41 2vl4 s THR 54 CO 0.14 0.52 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.84 2vl4 s VAL 55 N 0.55 0.62 0.57 3.82 1.01 -1.26 -3.24 120.40 122.46 2vl4 s VAL 55 Ca -0.09 -0.16 -0.21 0.00 0.00 0.00 0.00 61.98 61.52 2vl4 s VAL 55 Cb -0.16 -0.64 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 2vl4 s VAL 55 CO 0.04 0.25 1.34 -2.84 0.00 0.00 0.00 175.10 173.89 2vl4 s PRO 56 N 0.97 3.02 0.00 2.72 0.02 -1.26 -4.59 135.00 135.89 2vl4 s PRO 56 Ca -0.10 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.11 2vl4 s PRO 56 Cb -0.14 -2.17 0.00 0.00 0.02 0.00 0.00 34.50 32.21 2vl4 s PRO 56 CO -0.00 -1.27 0.00 0.41 -0.33 0.00 0.00 177.00 175.81 2vl4 n GLY 57 N 0.75 1.10 3.04 0.52 0.00 -0.35 -4.96 105.19 105.28 2vl4 n GLY 57 Ca 0.12 -0.81 -0.09 0.00 0.00 0.00 0.00 46.02 45.23 2vl4 n GLY 57 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vl4 s THR 58 N -2.35 0.13 0.21 2.61 -4.23 -1.26 -3.82 115.64 106.94 2vl4 s THR 58 Ca 0.00 -1.09 -0.09 0.00 -1.18 0.00 0.00 61.69 59.33 2vl4 s THR 58 Cb 0.00 -0.62 0.17 0.00 1.34 0.00 0.00 72.50 73.38 2vl4 s THR 58 CO 0.00 -0.60 1.71 0.58 -0.54 0.00 0.00 174.62 175.77 2vl4 h VAL 59 N 4.16 0.65 -0.08 2.29 2.07 -1.62 -1.80 116.25 121.93 2vl4 h VAL 59 Ca -0.32 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.10 2vl4 h VAL 59 Cb 1.19 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.30 2vl4 h VAL 59 CO 0.47 0.05 0.04 0.45 0.02 0.00 0.00 177.57 178.60 2vl4 h HIS 60 N 0.29 0.11 -0.71 1.57 3.86 -1.97 -1.00 115.15 117.30 2vl4 h HIS 60 Ca 0.32 -0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.58 2vl4 h HIS 60 Cb 0.47 -0.04 -0.05 0.00 1.06 0.00 0.00 27.41 28.85 2vl4 h HIS 60 CO -0.23 0.19 0.42 0.37 0.86 0.00 0.00 177.93 179.53 2vl4 h GLN 61 N 0.00 0.75 -0.88 2.45 5.75 -1.94 0.12 115.11 121.36 2vl4 h GLN 61 Ca 0.03 -0.05 0.02 0.00 -0.15 0.00 0.00 58.65 58.50 2vl4 h GLN 61 Cb 0.12 -0.17 -0.05 0.00 1.07 0.00 0.00 27.48 28.46 2vl4 h GLN 61 CO -0.00 0.50 0.58 -0.44 -2.65 0.00 0.00 178.83 176.81 2vl4 h ASP 62 N 0.77 0.99 -0.01 -0.69 3.32 -0.90 0.15 116.42 120.05 2vl4 h ASP 62 Ca 0.31 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.34 2vl4 h ASP 62 Cb 0.16 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.46 2vl4 h ASP 62 CO -0.17 0.71 0.00 -0.07 -1.72 0.00 0.00 179.24 177.99 2vl4 h LEU 63 N 1.17 0.01 -0.61 1.55 3.38 -0.88 -2.98 115.31 116.94 2vl4 h LEU 63 Ca 0.33 -0.21 0.12 0.00 0.09 0.00 0.00 57.88 58.21 2vl4 h LEU 63 Cb -0.10 -0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.56 2vl4 h LEU 63 CO -0.08 0.21 0.12 0.40 0.09 0.00 0.00 178.44 179.18 2vl4 h ILE 64 N -0.20 0.62 0.00 1.22 2.04 -0.51 0.44 117.51 121.12 2vl4 h ILE 64 Ca 0.00 -0.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 2vl4 h ILE 64 Cb 0.21 0.35 -0.00 0.00 -0.74 0.00 0.00 36.82 36.64 2vl4 h ILE 64 CO -0.00 0.05 -0.00 0.77 0.00 0.00 0.00 178.15 178.96 2vl4 h SER 65 N 0.25 0.00 -0.15 1.72 4.64 -0.58 -0.93 113.55 118.50 2vl4 h SER 65 Ca 0.32 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.60 2vl4 h SER 65 Cb 0.49 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.55 2vl4 h SER 65 CO -0.42 0.00 -0.11 1.41 -0.87 0.00 0.00 176.83 176.84 2vl4 n HIS 66 N -3.09 0.50 -3.16 4.77 8.25 -0.47 -4.97 115.22 117.05 2vl4 n HIS 66 Ca -0.03 -1.20 -0.21 0.00 -0.26 0.00 0.00 57.72 56.02 2vl4 n HIS 66 Cb 0.09 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 30.91 2vl4 n HIS 66 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2vl4 n GLU 67 N -1.07 -3.41 0.00 -0.41 1.02 -0.35 -4.81 120.64 111.61 2vl4 n GLU 67 Ca 0.22 0.55 0.12 0.00 -0.02 0.00 0.00 57.16 58.03 2vl4 n GLU 67 Cb 0.81 -5.26 0.17 0.00 -0.02 0.00 0.00 31.44 27.14 2vl4 n GLU 67 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2vl4 n LEU 68 N -3.61 2.46 -3.81 -4.62 4.77 0.02 -4.81 117.00 107.40 2vl4 n LEU 68 Ca -0.05 -0.83 -0.12 0.00 -0.03 0.00 0.00 56.01 54.98 2vl4 n LEU 68 Cb 0.56 -0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 41.55 2vl4 n LEU 68 CO 0.45 0.42 -0.08 -0.76 -1.33 0.00 0.00 177.39 176.09 2vl4 s LEU 69 N -2.12 1.15 0.70 2.23 1.43 -1.23 -4.86 118.68 115.98 2vl4 s LEU 69 Ca 0.28 0.12 -0.11 0.00 -1.03 0.00 0.00 54.13 53.39 2vl4 s LEU 69 Cb 0.20 0.93 0.01 0.00 0.03 0.00 0.00 46.19 47.36 2vl4 s LEU 69 CO 0.37 -0.30 1.08 -2.16 0.23 0.00 0.00 176.35 175.57 2vl4 s PRO 70 N -0.87 2.94 -0.26 1.29 0.04 -1.26 -4.45 135.00 132.43 2vl4 s PRO 70 Ca -0.10 0.58 -0.30 0.00 0.04 0.00 0.00 61.00 61.22 2vl4 s PRO 70 Cb -0.05 -2.02 -0.07 0.00 0.04 0.00 0.00 34.50 32.40 2vl4 s PRO 70 CO 0.02 -1.00 2.21 -1.71 0.04 0.00 0.00 177.00 176.56 2vl4 n ASN 71 N -3.01 2.92 0.28 6.66 5.15 -1.26 -4.80 115.26 121.20 2vl4 n ASN 71 Ca 0.07 0.27 0.16 0.00 -0.60 0.00 0.00 54.58 54.48 2vl4 n ASN 71 Cb 0.56 -1.47 0.92 0.00 -0.53 0.00 0.00 39.78 39.26 2vl4 n ASN 71 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2vl4 h PRO 72 N 14.24 0.00 0.00 1.20 0.13 -1.92 -2.18 132.00 143.46 2vl4 h PRO 72 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2vl4 h PRO 72 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2vl4 h PRO 72 CO 0.98 0.00 -0.83 1.19 -0.23 0.00 0.00 178.00 179.11 2vl4 n PHE 73 N -3.76 0.62 -2.50 1.56 3.72 -1.26 -4.09 117.46 111.75 2vl4 n PHE 73 Ca -0.02 0.18 -0.42 0.00 -0.05 0.00 0.00 57.45 57.14 2vl4 n PHE 73 Cb 0.15 -0.70 -0.03 0.00 -0.94 0.00 0.00 39.48 37.95 2vl4 n PHE 73 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 2vl4 s TYR 74 N -3.23 3.48 0.00 1.38 5.04 -0.82 -4.75 117.35 118.45 2vl4 s TYR 74 Ca 0.04 1.40 0.00 0.00 -2.44 0.00 0.00 57.07 56.07 2vl4 s TYR 74 Cb 0.12 -3.34 0.00 0.00 0.35 0.00 0.00 41.96 39.10 2vl4 s TYR 74 CO 0.76 -0.93 0.00 0.41 -1.34 0.00 0.00 175.55 174.45 2vl4 n GLY 75 N 3.14 1.15 0.33 8.97 0.00 0.12 -1.22 105.19 117.67 2vl4 n GLY 75 Ca 0.08 0.55 0.07 0.00 0.00 0.00 0.00 46.02 46.73 2vl4 n GLY 75 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2vl4 n MET 76 N 0.00 1.11 0.00 1.61 2.81 -1.26 -4.62 117.12 116.77 2vl4 n MET 76 Ca 0.00 -2.50 0.02 0.00 -1.81 0.00 0.00 57.70 53.41 2vl4 n MET 76 Cb 0.00 -1.31 0.08 0.00 -0.71 0.00 0.00 33.22 31.28 2vl4 n MET 76 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2vl4 n ASN 77 N -1.06 0.00 0.06 7.83 3.02 -0.36 -3.48 115.26 121.27 2vl4 n ASN 77 Ca 0.14 0.25 -0.13 0.00 -0.03 0.00 0.00 54.58 54.81 2vl4 n ASN 77 Cb 0.69 -0.30 -0.08 0.00 -0.61 0.00 0.00 39.78 39.48 2vl4 n ASN 77 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2vl4 h GLU 78 N 0.00 -0.11 -0.23 3.52 4.81 -1.83 -2.61 114.58 118.14 2vl4 h GLU 78 Ca 0.00 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 2vl4 h GLU 78 Cb 0.03 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 2vl4 h GLU 78 CO 0.00 0.08 0.02 -0.22 -0.73 0.00 0.00 179.01 178.16 2vl4 h LYS 79 N -0.28 0.33 0.00 1.92 3.64 -1.95 -2.94 116.57 117.29 2vl4 h LYS 79 Ca -0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2vl4 h LYS 79 Cb 0.24 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 2vl4 h LYS 79 CO 0.02 0.34 0.00 1.63 -2.27 0.00 0.00 179.45 179.17 2vl4 n LYS 80 N -4.37 0.12 0.00 1.90 5.02 -1.00 -3.39 118.16 116.45 2vl4 n LYS 80 Ca 0.00 0.39 0.04 0.00 -2.02 0.00 0.00 58.31 56.72 2vl4 n LYS 80 Cb 0.18 -1.75 0.01 0.00 -0.02 0.00 0.00 35.03 33.45 2vl4 n LYS 80 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2vl4 n ILE 81 N -1.99 0.00 0.26 -0.18 -5.35 -1.11 -4.67 119.36 106.32 2vl4 n ILE 81 Ca 0.02 -0.46 0.11 0.00 -0.27 0.00 0.00 62.75 62.15 2vl4 n ILE 81 Cb 0.19 1.12 0.69 0.00 -1.74 0.00 0.00 39.64 39.90 2vl4 n ILE 81 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 2vl4 h GLN 82 N 1.09 0.00 -0.17 6.28 1.08 -1.62 -2.99 115.11 118.78 2vl4 h GLN 82 Ca 0.00 0.00 0.05 0.00 -1.45 0.00 0.00 58.65 57.25 2vl4 h GLN 82 Cb 0.27 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.69 2vl4 h GLN 82 CO 0.00 0.13 0.16 0.11 -0.95 0.00 0.00 178.83 178.28 2vl4 h TRP 83 N 0.00 0.00 -0.97 2.96 5.08 -1.83 -2.59 115.95 118.61 2vl4 h TRP 83 Ca -0.00 0.00 0.08 0.00 1.08 0.00 0.00 58.89 60.05 2vl4 h TRP 83 Cb 0.32 0.00 -0.07 0.00 -3.00 0.00 0.00 29.16 26.41 2vl4 h TRP 83 CO 0.00 0.00 0.62 0.28 -1.28 0.00 0.00 178.44 178.06 2vl4 h VAL 84 N 0.00 1.02 0.00 0.12 2.07 -1.90 -2.02 116.25 115.55 2vl4 h VAL 84 Ca 0.08 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2vl4 h VAL 84 Cb 0.40 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 2vl4 h VAL 84 CO -0.00 0.19 0.00 -1.84 0.02 0.00 0.00 177.57 175.94 2vl4 n GLU 85 N -4.53 0.07 0.03 1.57 0.28 -0.98 -2.16 120.64 114.93 2vl4 n GLU 85 Ca 0.16 0.25 0.12 0.00 -0.16 0.00 0.00 57.16 57.53 2vl4 n GLU 85 Cb 0.25 -1.62 0.16 0.00 1.43 0.00 0.00 31.44 31.66 2vl4 n GLU 85 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2vl4 n ASN 86 N -1.76 0.61 -4.95 -1.84 5.03 -0.76 -4.27 115.26 107.33 2vl4 n ASN 86 Ca 0.04 -0.10 -0.24 0.00 0.87 0.00 0.00 54.58 55.15 2vl4 n ASN 86 Cb 0.23 0.35 -0.02 0.00 -1.02 0.00 0.00 39.78 39.32 2vl4 n ASN 86 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2vl4 s GLU 87 N -3.11 3.48 0.29 3.52 0.41 -0.92 -4.91 118.70 117.46 2vl4 s GLU 87 Ca 0.07 -0.44 0.00 0.00 -0.41 0.00 0.00 54.97 54.20 2vl4 s GLU 87 Cb 0.15 -2.76 -0.04 0.00 -1.78 0.00 0.00 34.13 29.71 2vl4 s GLU 87 CO 0.73 0.27 0.48 -0.51 -0.49 0.00 0.00 175.26 175.74 2vl4 s ASP 88 N -3.83 6.34 -0.01 -0.19 1.01 -1.26 -3.99 116.67 114.74 2vl4 s ASP 88 Ca 0.38 0.40 0.01 0.00 0.71 0.00 0.00 52.55 54.06 2vl4 s ASP 88 Cb -0.10 -2.01 0.01 0.00 1.01 0.00 0.00 42.92 41.83 2vl4 s ASP 88 CO 0.33 -0.18 -0.03 0.26 0.21 0.00 0.00 175.17 175.76 2vl4 s TRP 89 N -2.12 0.36 0.03 4.23 0.52 -0.55 -1.03 118.94 120.37 2vl4 s TRP 89 Ca 0.39 -0.05 0.07 0.00 0.02 0.00 0.00 56.10 56.53 2vl4 s TRP 89 Cb -0.10 -0.32 -0.03 0.00 -1.15 0.00 0.00 33.47 31.87 2vl4 s TRP 89 CO 0.32 -0.06 -0.21 -1.21 0.02 0.00 0.00 176.95 175.82 2vl4 s GLU 90 N 0.36 2.05 0.02 4.98 2.02 -0.44 -0.25 118.70 127.44 2vl4 s GLU 90 Ca -0.04 -0.98 0.07 0.00 0.02 0.00 0.00 54.97 54.05 2vl4 s GLU 90 Cb -0.07 -2.14 -0.02 0.00 0.10 0.00 0.00 34.13 32.00 2vl4 s GLU 90 CO -0.01 0.54 -0.20 0.71 0.02 0.00 0.00 175.26 176.32 2vl4 s TYR 91 N -0.84 1.80 0.01 1.61 2.02 -0.01 -0.94 117.35 121.00 2vl4 s TYR 91 Ca 0.13 -0.36 -0.06 0.00 -0.37 0.00 0.00 57.07 56.41 2vl4 s TYR 91 Cb -0.10 -1.10 -0.00 0.00 -0.40 0.00 0.00 41.96 40.35 2vl4 s TYR 91 CO 0.03 0.05 0.10 -0.98 -1.57 0.00 0.00 175.55 173.19 2vl4 s ARG 92 N -0.95 0.47 0.07 -0.62 1.70 -0.42 0.01 118.95 119.21 2vl4 s ARG 92 Ca 0.07 -0.49 -0.14 0.00 -0.47 0.00 0.00 55.73 54.71 2vl4 s ARG 92 Cb -0.08 0.19 0.02 0.00 -0.57 0.00 0.00 34.95 34.51 2vl4 s ARG 92 CO 0.01 -0.11 0.31 -0.08 -1.08 0.00 0.00 175.30 174.35 2vl4 s THR 93 N -1.59 0.09 0.09 4.99 -1.32 -0.35 -0.91 115.64 116.65 2vl4 s THR 93 Ca -0.14 -0.74 0.09 0.00 -1.21 0.00 0.00 61.69 59.69 2vl4 s THR 93 Cb -0.07 -1.08 -0.03 0.00 -1.51 0.00 0.00 72.50 69.81 2vl4 s THR 93 CO 0.00 -0.41 -0.24 -0.44 -2.21 0.00 0.00 174.62 171.32 2vl4 s SER 94 N -2.41 2.94 0.09 8.08 0.01 -1.26 -1.03 113.70 120.12 2vl4 s SER 94 Ca -0.01 -0.67 -0.12 0.00 1.31 0.00 0.00 55.95 56.46 2vl4 s SER 94 Cb 0.01 -0.21 0.01 0.00 0.21 0.00 0.00 66.02 66.05 2vl4 s SER 94 CO -0.07 0.16 0.27 0.72 0.41 0.00 0.00 173.24 174.73 2vl4 s PHE 95 N -1.00 -0.01 -0.12 2.43 -0.12 -0.54 -4.95 117.98 113.67 2vl4 s PHE 95 Ca 0.10 -0.33 -0.06 0.00 -0.05 0.00 0.00 56.93 56.59 2vl4 s PHE 95 Cb -0.10 0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 42.32 2vl4 s PHE 95 CO 0.04 -0.58 0.11 0.42 -0.05 0.00 0.00 175.22 175.17 2vl4 s ILE 96 N -3.52 5.25 -0.07 -4.49 -1.09 -1.26 -0.28 121.20 115.74 2vl4 s ILE 96 Ca 0.02 0.12 0.03 0.00 -2.23 0.00 0.00 60.65 58.59 2vl4 s ILE 96 Cb 0.03 -3.29 0.00 0.00 -1.58 0.00 0.00 42.46 37.62 2vl4 s ILE 96 CO -0.09 0.59 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.35 2vl4 s VAL 97 N -0.82 1.52 0.53 2.92 1.01 -0.42 -4.98 120.40 120.16 2vl4 s VAL 97 Ca 0.13 -0.72 -0.08 0.00 0.00 0.00 0.00 61.98 61.31 2vl4 s VAL 97 Cb -0.12 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 2vl4 s VAL 97 CO 0.03 0.44 0.89 -0.94 0.00 0.00 0.00 175.10 175.52 2vl4 s SER 98 N 0.39 6.29 0.36 3.32 1.04 -1.26 -0.66 113.70 123.18 2vl4 s SER 98 Ca -0.13 1.16 0.10 0.00 0.48 0.00 0.00 55.95 57.56 2vl4 s SER 98 Cb -0.15 -2.35 0.84 0.00 0.10 0.00 0.00 66.02 64.46 2vl4 s SER 98 CO 0.05 -0.68 1.88 -0.08 0.98 0.00 0.00 173.24 175.39 2vl4 h GLU 99 N 0.13 0.64 -0.36 4.02 4.81 -1.98 -1.27 114.58 120.58 2vl4 h GLU 99 Ca -0.46 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 58.61 2vl4 h GLU 99 Cb 1.20 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 2vl4 h GLU 99 CO 0.62 0.43 -0.25 0.93 -0.73 0.00 0.00 179.01 180.01 2vl4 h GLU 100 N 0.66 0.81 -0.32 1.92 3.07 -1.98 -2.78 114.58 115.96 2vl4 h GLU 100 Ca 0.43 -0.38 -0.01 0.00 -0.50 0.00 0.00 59.36 58.90 2vl4 h GLU 100 Cb 0.72 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.61 2vl4 h GLU 100 CO -0.19 1.01 0.16 1.96 -1.40 0.00 0.00 179.01 180.55 2vl4 h GLN 101 N 0.60 0.46 0.00 2.33 4.20 -1.79 -2.94 115.11 117.97 2vl4 h GLN 101 Ca 0.07 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2vl4 h GLN 101 Cb 0.81 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.51 2vl4 h GLN 101 CO 0.07 0.42 0.00 1.25 -0.67 0.00 0.00 178.83 179.90 2vl4 h LEU 102 N 0.39 0.00 -1.10 1.46 5.85 -1.25 -1.62 115.31 119.03 2vl4 h LEU 102 Ca 0.11 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.83 2vl4 h LEU 102 Cb 0.11 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.14 2vl4 h LEU 102 CO -0.01 0.00 0.00 -3.20 -0.34 0.00 0.00 178.44 174.89 2vl4 n ASN 103 N -2.93 1.70 -4.76 1.25 2.85 -1.05 -4.91 115.26 107.41 2vl4 n ASN 103 Ca -0.02 -1.59 -0.32 0.00 -0.11 0.00 0.00 54.58 52.54 2vl4 n ASN 103 Cb 0.11 -0.03 0.08 0.00 1.24 0.00 0.00 39.78 41.19 2vl4 n ASN 103 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 2vl4 s ARG 104 N -1.94 2.35 0.14 1.20 1.81 -0.61 -4.96 118.95 116.93 2vl4 s ARG 104 Ca 0.36 1.36 -0.14 0.00 -1.72 0.00 0.00 55.73 55.58 2vl4 s ARG 104 Cb 0.20 -1.90 0.02 0.00 -0.45 0.00 0.00 34.95 32.82 2vl4 s ARG 104 CO 0.32 -1.60 1.67 -0.44 -0.68 0.00 0.00 175.30 174.57 2vl4 h ASP 105 N -0.64 0.68 -4.56 0.23 3.32 -1.78 -3.45 116.42 110.22 2vl4 h ASP 105 Ca -0.45 -0.21 -0.36 0.00 0.02 0.00 0.00 57.03 56.03 2vl4 h ASP 105 Cb 1.25 -0.18 -0.21 0.00 0.22 0.00 0.00 39.33 40.41 2vl4 h ASP 105 CO 0.51 0.70 -0.76 -0.83 -1.72 0.00 0.00 179.24 177.15 2vl4 s GLY 106 N -3.10 0.76 -0.04 2.75 0.00 -0.55 -4.89 107.32 102.25 2vl4 s GLY 106 Ca -0.13 -0.94 -0.02 0.00 0.00 0.00 0.00 44.72 43.63 2vl4 s GLY 106 CO 0.78 -0.98 0.05 -0.42 0.00 0.00 0.00 173.10 172.52 2vl4 s ILE 107 N -1.39 -0.06 -0.09 0.90 1.01 -1.26 -1.30 121.20 119.01 2vl4 s ILE 107 Ca -0.04 0.37 0.04 0.00 0.00 0.00 0.00 60.65 61.02 2vl4 s ILE 107 Cb -0.09 -0.17 0.00 0.00 0.01 0.00 0.00 42.46 42.21 2vl4 s ILE 107 CO 0.02 0.17 -0.22 -1.58 0.00 0.00 0.00 174.94 173.32 2vl4 s GLN 108 N 1.95 2.82 -0.20 2.79 0.74 -0.01 -0.09 119.66 127.65 2vl4 s GLN 108 Ca 0.02 -0.81 -0.09 0.00 0.05 0.00 0.00 55.36 54.54 2vl4 s GLN 108 Cb -0.12 -2.15 -0.04 0.00 1.10 0.00 0.00 33.01 31.79 2vl4 s GLN 108 CO -0.03 0.16 0.10 -1.17 -0.55 0.00 0.00 175.29 173.80 2vl4 s LEU 109 N 0.37 3.98 -0.14 3.68 2.96 0.53 -0.20 118.68 129.86 2vl4 s LEU 109 Ca -0.18 0.13 0.02 0.00 -0.22 0.00 0.00 54.13 53.88 2vl4 s LEU 109 Cb -0.17 -2.02 0.01 0.00 0.50 0.00 0.00 46.19 44.50 2vl4 s LEU 109 CO 0.08 0.15 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.42 2vl4 s ILE 110 N 0.50 2.02 -0.38 6.68 1.09 0.26 0.27 121.20 131.64 2vl4 s ILE 110 Ca 0.05 -0.95 -0.09 0.00 -1.10 0.00 0.00 60.65 58.56 2vl4 s ILE 110 Cb -0.12 -1.79 0.05 0.00 -1.06 0.00 0.00 42.46 39.53 2vl4 s ILE 110 CO 0.00 0.54 0.20 -0.36 -0.10 0.00 0.00 174.94 175.22 2vl4 s PHE 111 N 0.88 3.28 -0.23 3.97 0.08 0.25 -1.53 117.98 124.67 2vl4 s PHE 111 Ca -0.06 -1.25 0.28 0.00 0.12 0.00 0.00 56.93 56.02 2vl4 s PHE 111 Cb -0.15 -2.56 1.17 0.00 -0.57 0.00 0.00 43.02 40.92 2vl4 s PHE 111 CO -0.03 -0.73 1.82 0.93 -0.10 0.00 0.00 175.22 177.11 2vl4 h GLU 112 N 8.38 0.00 -1.19 0.44 5.08 -1.55 0.16 114.58 125.90 2vl4 h GLU 112 Ca -0.24 0.00 0.17 0.00 -1.00 0.00 0.00 59.36 58.29 2vl4 h GLU 112 Cb 1.09 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 30.05 2vl4 h GLU 112 CO 0.68 0.00 0.55 0.20 -1.00 0.00 0.00 179.01 179.44 2vl4 s GLY 113 N -3.78 0.29 -0.09 -3.84 0.00 -1.26 -4.18 107.32 94.47 2vl4 s GLY 113 Ca 0.02 3.49 0.01 0.00 0.00 0.00 0.00 44.72 48.24 2vl4 s GLY 113 CO 0.43 2.78 -0.10 1.08 0.00 0.00 0.00 173.10 177.29 2vl4 s LEU 114 N 1.34 1.44 -0.46 0.66 1.43 -1.26 -2.34 118.68 119.49 2vl4 s LEU 114 Ca -0.07 -0.30 -0.04 0.00 -1.03 0.00 0.00 54.13 52.69 2vl4 s LEU 114 Cb -0.03 -0.82 0.12 0.00 0.03 0.00 0.00 46.19 45.49 2vl4 s LEU 114 CO -0.13 -0.04 0.26 -0.62 0.23 0.00 0.00 176.35 176.06 2vl4 s ASP 115 N 1.12 5.31 0.14 2.29 -1.08 -0.19 -3.73 116.67 120.53 2vl4 s ASP 115 Ca -0.06 -2.17 0.00 0.00 -0.52 0.00 0.00 52.55 49.80 2vl4 s ASP 115 Cb -0.14 -1.85 0.00 0.00 -1.46 0.00 0.00 42.92 39.46 2vl4 s ASP 115 CO -0.02 -0.53 0.00 0.41 0.52 0.00 0.00 175.17 175.55 2vl4 n THR 116 N 4.42 0.00 -2.89 1.71 -1.04 -1.26 -0.78 114.28 114.44 2vl4 n THR 116 Ca -0.01 0.00 -0.44 0.00 -2.04 0.00 0.00 64.05 61.57 2vl4 n THR 116 Cb 0.41 -0.49 -0.03 0.00 -1.82 0.00 0.00 70.33 68.40 2vl4 n THR 116 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2vl4 s TYR 117 N -2.00 2.99 -0.12 -1.42 2.02 -1.26 -3.04 117.35 114.52 2vl4 s TYR 117 Ca 0.00 -1.18 0.01 0.00 -0.37 0.00 0.00 57.07 55.53 2vl4 s TYR 117 Cb 0.00 -4.30 0.02 0.00 -0.40 0.00 0.00 41.96 37.27 2vl4 s TYR 117 CO 0.00 -1.54 -0.14 0.00 -1.57 0.00 0.00 175.55 172.30 2vl4 s ALA 118 N 3.09 1.69 -0.34 3.71 0.00 -1.06 -0.90 121.76 127.96 2vl4 s ALA 118 Ca 0.31 -0.75 -0.16 0.00 0.00 0.00 0.00 51.96 51.35 2vl4 s ALA 118 Cb -0.07 -0.90 -0.01 0.00 0.00 0.00 0.00 23.12 22.14 2vl4 s ALA 118 CO -0.05 -0.19 0.43 -0.51 0.00 0.00 0.00 175.76 175.43 2vl4 s ASP 119 N 1.19 6.25 -0.27 0.00 1.01 0.39 0.36 116.67 125.60 2vl4 s ASP 119 Ca -0.02 -0.08 -0.09 0.00 0.71 0.00 0.00 52.55 53.07 2vl4 s ASP 119 Cb -0.14 -2.23 -0.03 0.00 1.01 0.00 0.00 42.92 41.53 2vl4 s ASP 119 CO -0.05 -0.38 0.13 -0.69 0.21 0.00 0.00 175.17 174.39 2vl4 s VAL 120 N 2.18 4.73 -0.04 -1.27 1.01 -0.15 -0.73 120.40 126.11 2vl4 s VAL 120 Ca 0.15 -0.08 0.06 0.00 0.00 0.00 0.00 61.98 62.10 2vl4 s VAL 120 Cb -0.16 -3.26 -0.02 0.00 0.00 0.00 0.00 36.38 32.94 2vl4 s VAL 120 CO 0.12 0.26 -0.21 -0.31 0.00 0.00 0.00 175.10 174.97 2vl4 s TYR 121 N 1.67 2.51 -0.12 5.22 2.02 0.28 -0.33 117.35 128.61 2vl4 s TYR 121 Ca 0.06 -0.39 -0.01 0.00 -0.37 0.00 0.00 57.07 56.36 2vl4 s TYR 121 Cb -0.16 -1.58 0.04 0.00 -0.40 0.00 0.00 41.96 39.86 2vl4 s TYR 121 CO 0.07 0.01 -0.01 -1.17 -1.57 0.00 0.00 175.55 172.88 2vl4 s LEU 122 N -0.53 0.99 -1.45 -1.29 2.96 0.03 -0.97 118.68 118.42 2vl4 s LEU 122 Ca 0.07 -0.40 -0.10 0.00 -0.22 0.00 0.00 54.13 53.48 2vl4 s LEU 122 Cb -0.11 -0.61 0.05 0.00 0.50 0.00 0.00 46.19 46.02 2vl4 s LEU 122 CO 0.01 -0.21 0.99 0.59 -1.32 0.00 0.00 176.35 176.40 2vl4 n ASN 123 N 5.05 -4.46 0.00 3.68 3.02 -0.51 -1.51 115.26 120.53 2vl4 n ASN 123 Ca -0.09 -0.73 0.00 0.00 -0.03 0.00 0.00 54.58 53.73 2vl4 n ASN 123 Cb 0.49 -4.21 0.00 0.00 -0.61 0.00 0.00 39.78 35.45 2vl4 n ASN 123 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vl4 n GLY 124 N -1.72 2.16 3.72 7.41 0.00 -1.26 -5.03 105.19 110.47 2vl4 n GLY 124 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 2vl4 n GLY 124 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2vl4 s SER 125 N -2.71 6.44 -0.61 1.61 0.15 -0.57 -5.04 113.70 112.98 2vl4 s SER 125 Ca 0.00 0.52 -0.27 0.00 0.70 0.00 0.00 55.95 56.89 2vl4 s SER 125 Cb 0.00 -2.19 0.01 0.00 -1.71 0.00 0.00 66.02 62.13 2vl4 s SER 125 CO 0.00 0.08 1.53 -0.22 1.20 0.00 0.00 173.24 175.83 2vl4 s LEU 126 N 0.56 3.32 0.15 3.45 2.96 -1.26 -0.79 118.68 127.07 2vl4 s LEU 126 Ca 0.17 0.18 0.11 0.00 -0.22 0.00 0.00 54.13 54.37 2vl4 s LEU 126 Cb -0.13 -2.81 -0.13 0.00 0.50 0.00 0.00 46.19 43.62 2vl4 s LEU 126 CO 0.04 -1.93 1.24 -0.07 -1.32 0.00 0.00 176.35 174.31 2vl4 h LEU 127 N 14.08 0.00 -7.00 -0.68 3.38 -1.05 -3.48 115.31 120.56 2vl4 h LEU 127 Ca -0.27 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.78 2vl4 h LEU 127 Cb 1.11 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.59 2vl4 h LEU 127 CO 1.21 0.83 0.41 -0.22 0.09 0.00 0.00 178.44 180.75 2vl4 s LEU 128 N -6.52 -0.49 -0.60 1.67 2.96 -1.21 -5.02 118.68 109.48 2vl4 s LEU 128 Ca 0.01 0.86 -0.06 0.00 -0.22 0.00 0.00 54.13 54.72 2vl4 s LEU 128 Cb 0.09 1.83 0.15 0.00 0.50 0.00 0.00 46.19 48.76 2vl4 s LEU 128 CO 0.80 -0.14 0.44 -0.54 -1.32 0.00 0.00 176.35 175.59 2vl4 s LYS 129 N 0.82 2.63 0.58 1.98 1.02 -1.26 -0.98 119.74 124.52 2vl4 s LYS 129 Ca -0.03 -2.27 -0.17 0.00 0.02 0.00 0.00 55.97 53.52 2vl4 s LYS 129 Cb -0.04 -3.86 -0.04 0.00 -0.52 0.00 0.00 37.83 33.37 2vl4 s LYS 129 CO -0.11 -1.18 1.09 0.00 -0.92 0.00 0.00 175.35 174.22 2vl4 s ALA 130 N 0.43 2.68 0.00 5.17 0.00 0.16 -4.90 121.76 125.29 2vl4 s ALA 130 Ca 0.14 0.59 0.01 0.00 0.00 0.00 0.00 51.96 52.69 2vl4 s ALA 130 Cb -0.20 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.64 2vl4 s ALA 130 CO -0.04 -0.84 0.73 -0.40 0.00 0.00 0.00 175.76 175.21 2vl4 n ASP 131 N -1.76 -0.34 -3.33 0.00 5.68 -1.17 -2.58 116.55 113.05 2vl4 n ASP 131 Ca 0.10 -1.45 -0.08 0.00 -0.50 0.00 0.00 54.79 52.86 2vl4 n ASP 131 Cb 0.52 0.09 -0.07 0.00 -1.14 0.00 0.00 41.12 40.52 2vl4 n ASP 131 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 2vl4 s ASN 132 N -0.49 0.14 0.57 -1.12 3.84 -1.25 -4.53 114.94 112.10 2vl4 s ASN 132 Ca 0.01 0.19 0.28 0.00 0.21 0.00 0.00 52.86 53.55 2vl4 s ASN 132 Cb 0.01 1.19 1.49 0.00 -0.55 0.00 0.00 41.25 43.39 2vl4 s ASN 132 CO -0.01 -0.30 1.96 -0.03 -2.79 0.00 0.00 177.10 175.93 2vl4 h MET 133 N 8.17 0.00 -0.36 0.43 1.85 -1.21 -2.83 114.93 120.99 2vl4 h MET 133 Ca -0.18 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.91 2vl4 h MET 133 Cb 1.15 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.18 2vl4 h MET 133 CO 0.27 0.00 0.00 1.19 -0.40 0.00 0.00 176.91 177.97 2vl4 n PHE 134 N -3.97 0.47 -5.13 1.39 3.72 -1.26 -4.38 117.46 108.30 2vl4 n PHE 134 Ca 0.08 -0.23 -0.32 0.00 -0.05 0.00 0.00 57.45 56.93 2vl4 n PHE 134 Cb 0.61 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 39.00 2vl4 n PHE 134 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2vl4 s VAL 135 N -1.53 2.46 0.07 -4.37 1.01 -1.07 -4.74 120.40 112.22 2vl4 s VAL 135 Ca 0.32 -0.94 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 2vl4 s VAL 135 Cb 0.17 -1.91 -0.06 0.00 0.00 0.00 0.00 36.38 34.58 2vl4 s VAL 135 CO 0.24 0.58 0.40 -0.83 0.00 0.00 0.00 175.10 175.48 2vl4 s GLY 136 N -0.50 2.35 -0.11 4.51 0.00 -1.26 -4.45 107.32 107.87 2vl4 s GLY 136 Ca 0.06 -0.36 0.02 0.00 0.00 0.00 0.00 44.72 44.44 2vl4 s GLY 136 CO 0.01 -0.13 -0.19 -0.19 0.00 0.00 0.00 173.10 172.61 2vl4 s TYR 137 N -1.35 2.67 -0.19 1.90 2.02 0.56 -4.98 117.35 117.98 2vl4 s TYR 137 Ca 0.32 -0.79 -0.02 0.00 -0.37 0.00 0.00 57.07 56.21 2vl4 s TYR 137 Cb -0.14 -1.75 -0.01 0.00 -0.40 0.00 0.00 41.96 39.66 2vl4 s TYR 137 CO 0.17 -0.27 -0.09 0.99 -1.57 0.00 0.00 175.55 174.78 2vl4 s THR 138 N 0.24 3.09 -0.10 -0.71 2.01 -1.26 -0.58 115.64 118.33 2vl4 s THR 138 Ca -0.12 -0.60 0.03 0.00 0.31 0.00 0.00 61.69 61.30 2vl4 s THR 138 Cb -0.16 -2.37 0.01 0.00 0.01 0.00 0.00 72.50 69.99 2vl4 s THR 138 CO 0.07 0.47 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.51 2vl4 s LEU 139 N 1.11 1.91 -0.06 4.42 1.43 0.14 -4.98 118.68 122.66 2vl4 s LEU 139 Ca 0.01 -0.47 -0.30 0.00 -1.03 0.00 0.00 54.13 52.34 2vl4 s LEU 139 Cb -0.14 -1.20 -0.03 0.00 0.03 0.00 0.00 46.19 44.84 2vl4 s LEU 139 CO -0.02 0.09 1.23 -2.16 0.23 0.00 0.00 176.35 175.72 2vl4 s PRO 140 N 0.59 4.33 0.00 1.29 0.04 -1.26 -0.34 135.00 139.64 2vl4 s PRO 140 Ca -0.14 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.60 2vl4 s PRO 140 Cb -0.17 -3.58 0.00 0.00 0.04 0.00 0.00 34.50 30.79 2vl4 s PRO 140 CO 0.05 -0.49 0.31 1.33 0.04 0.00 0.00 177.00 178.24 2vl4 n VAL 141 N 4.70 0.04 -0.19 -0.36 0.24 0.87 -4.84 118.33 118.78 2vl4 n VAL 141 Ca 0.12 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 2vl4 n VAL 141 Cb 0.46 1.39 0.09 0.00 -1.47 0.00 0.00 33.84 34.31 2vl4 n VAL 141 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 2vl4 h LYS 142 N 0.00 0.15 0.00 7.34 3.64 -1.87 -0.50 116.57 125.33 2vl4 h LYS 142 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2vl4 h LYS 142 Cb 0.25 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 2vl4 h LYS 142 CO 0.00 0.10 0.00 -1.13 -2.27 0.00 0.00 179.45 176.15 2vl4 n SER 143 N -5.23 0.34 -0.01 4.20 3.41 -1.26 -2.64 113.62 112.43 2vl4 n SER 143 Ca 0.08 0.59 0.08 0.00 -0.26 0.00 0.00 58.87 59.36 2vl4 n SER 143 Cb 0.33 -0.66 -0.15 0.00 -0.26 0.00 0.00 64.21 63.47 2vl4 n SER 143 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2vl4 n VAL 144 N -1.88 0.25 -2.29 -3.33 0.31 -0.25 -4.98 118.33 106.16 2vl4 n VAL 144 Ca 0.03 -0.55 -0.33 0.00 -0.01 0.00 0.00 64.34 63.48 2vl4 n VAL 144 Cb 0.19 -0.10 -0.01 0.00 -0.91 0.00 0.00 33.84 33.01 2vl4 n VAL 144 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2vl4 s LEU 145 N -4.74 3.65 0.08 7.52 1.43 -0.87 -4.79 118.68 120.95 2vl4 s LEU 145 Ca -0.07 1.83 0.07 0.00 -1.03 0.00 0.00 54.13 54.92 2vl4 s LEU 145 Cb 0.13 -4.54 -0.03 0.00 0.03 0.00 0.00 46.19 41.78 2vl4 s LEU 145 CO 0.89 -0.94 -0.20 -0.13 0.23 0.00 0.00 176.35 176.20 2vl4 s ARG 146 N -3.75 1.16 0.29 1.70 0.52 -1.26 -5.03 118.95 112.59 2vl4 s ARG 146 Ca 0.64 -1.04 -0.30 0.00 -0.52 0.00 0.00 55.73 54.52 2vl4 s ARG 146 Cb -0.15 -1.34 -0.11 0.00 0.52 0.00 0.00 34.95 33.87 2vl4 s ARG 146 CO 0.29 0.32 1.53 0.21 0.02 0.00 0.00 175.30 177.68 2vl4 s LYS 147 N -1.59 4.16 1.53 3.54 2.20 -1.26 -4.45 119.74 123.87 2vl4 s LYS 147 Ca 0.06 2.50 0.00 0.00 -0.36 0.00 0.00 55.97 58.16 2vl4 s LYS 147 Cb -0.09 -3.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.19 2vl4 s LYS 147 CO 0.03 -0.55 0.00 0.41 -0.36 0.00 0.00 175.35 174.88 2vl4 n GLY 148 N 1.92 0.67 3.75 5.54 0.00 0.16 -4.93 105.19 112.31 2vl4 n GLY 148 Ca 0.07 -1.38 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 2vl4 n GLY 148 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vl4 s GLU 149 N 0.00 4.49 -0.00 1.61 0.41 -1.26 -1.30 118.70 122.64 2vl4 s GLU 149 Ca 0.00 1.95 0.04 0.00 -0.41 0.00 0.00 54.97 56.54 2vl4 s GLU 149 Cb 0.00 -3.19 -0.01 0.00 -1.78 0.00 0.00 34.13 29.15 2vl4 s GLU 149 CO 0.00 -0.06 -0.12 -0.80 -0.49 0.00 0.00 175.26 173.79 2vl4 s ASN 150 N -0.19 1.44 -0.23 -0.19 0.01 0.61 -4.76 114.94 111.62 2vl4 s ASN 150 Ca 0.51 -0.25 0.02 0.00 -0.71 0.00 0.00 52.86 52.43 2vl4 s ASN 150 Cb -0.34 -0.15 0.05 0.00 0.41 0.00 0.00 41.25 41.21 2vl4 s ASN 150 CO 0.41 0.13 -0.14 -1.00 -1.51 0.00 0.00 177.10 174.99 2vl4 s HIS 151 N -0.35 3.02 -0.15 2.20 3.76 -1.26 -1.47 115.29 121.04 2vl4 s HIS 151 Ca 0.04 -2.03 -0.07 0.00 -0.15 0.00 0.00 55.06 52.85 2vl4 s HIS 151 Cb -0.05 -1.89 -0.04 0.00 1.11 0.00 0.00 32.58 31.71 2vl4 s HIS 151 CO -0.00 -0.84 0.10 -1.17 -0.85 0.00 0.00 174.74 171.97 2vl4 s LEU 152 N 1.19 4.10 -0.09 0.89 2.96 -0.20 -1.43 118.68 126.11 2vl4 s LEU 152 Ca -0.04 0.28 -0.04 0.00 -0.22 0.00 0.00 54.13 54.11 2vl4 s LEU 152 Cb -0.17 -2.02 0.05 0.00 0.50 0.00 0.00 46.19 44.55 2vl4 s LEU 152 CO -0.08 0.29 0.19 -0.47 -1.32 0.00 0.00 176.35 174.97 2vl4 s TYR 153 N -0.34 -0.25 -0.11 5.38 5.04 -0.14 -1.21 117.35 125.72 2vl4 s TYR 153 Ca 0.10 0.68 0.02 0.00 -2.44 0.00 0.00 57.07 55.44 2vl4 s TYR 153 Cb -0.12 -0.13 0.01 0.00 0.35 0.00 0.00 41.96 42.07 2vl4 s TYR 153 CO 0.01 -0.26 -0.18 0.42 -1.34 0.00 0.00 175.55 174.20 2vl4 s ILE 154 N 1.94 1.68 -0.27 3.14 1.01 0.10 -0.55 121.20 128.24 2vl4 s ILE 154 Ca -0.02 -0.77 -0.08 0.00 0.00 0.00 0.00 60.65 59.79 2vl4 s ILE 154 Cb -0.12 -1.50 -0.02 0.00 0.01 0.00 0.00 42.46 40.84 2vl4 s ILE 154 CO -0.07 0.48 0.10 -0.47 0.00 0.00 0.00 174.94 174.98 2vl4 s TYR 155 N 0.75 3.12 -0.45 3.97 5.04 0.09 -0.83 117.35 129.05 2vl4 s TYR 155 Ca -0.11 -0.53 -0.16 0.00 -2.44 0.00 0.00 57.07 53.83 2vl4 s TYR 155 Cb -0.16 -2.28 0.05 0.00 0.35 0.00 0.00 41.96 39.92 2vl4 s TYR 155 CO 0.02 -0.41 0.38 -0.06 -1.34 0.00 0.00 175.55 174.13 2vl4 s PHE 156 N 1.60 3.22 0.22 4.97 0.08 0.65 -0.46 117.98 128.27 2vl4 s PHE 156 Ca 0.05 -0.74 -0.30 0.00 0.12 0.00 0.00 56.93 56.07 2vl4 s PHE 156 Cb -0.16 -2.97 -0.09 0.00 -0.57 0.00 0.00 43.02 39.23 2vl4 s PHE 156 CO 0.04 -0.73 1.35 -1.01 -0.10 0.00 0.00 175.22 174.77 2vl4 s HIS 157 N 1.76 3.18 0.03 0.36 3.76 -0.08 -1.49 115.29 122.82 2vl4 s HIS 157 Ca 0.06 1.18 -0.36 0.00 -0.15 0.00 0.00 55.06 55.79 2vl4 s HIS 157 Cb -0.21 -3.67 -0.15 0.00 1.11 0.00 0.00 32.58 29.66 2vl4 s HIS 157 CO 0.09 -2.10 1.53 0.45 -0.85 0.00 0.00 174.74 173.86 2vl4 n SER 158 N 2.39 2.39 0.26 1.40 2.88 -1.26 -4.48 113.62 117.21 2vl4 n SER 158 Ca 0.06 1.09 0.15 0.00 -1.33 0.00 0.00 58.87 58.83 2vl4 n SER 158 Cb 0.42 -1.27 0.67 0.00 -0.75 0.00 0.00 64.21 63.27 2vl4 n SER 158 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2vl4 h PRO 159 N 5.88 0.00 0.15 -1.46 0.13 -1.90 0.17 132.00 134.98 2vl4 h PRO 159 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 2vl4 h PRO 159 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2vl4 h PRO 159 CO 0.86 0.09 -0.07 0.82 -0.23 0.00 0.00 178.00 179.47 2vl4 h ILE 160 N 0.00 0.91 0.00 -3.56 1.08 -1.89 -3.06 117.51 110.98 2vl4 h ILE 160 Ca -0.00 -1.13 -0.07 0.00 -0.39 0.00 0.00 64.86 63.27 2vl4 h ILE 160 Cb 0.51 1.51 -0.01 0.00 -3.07 0.00 0.00 36.82 35.76 2vl4 h ILE 160 CO 0.01 0.23 -0.33 0.08 -0.69 0.00 0.00 178.15 177.45 2vl4 h ARG 161 N -0.83 0.00 -0.54 2.37 -0.00 -1.78 0.91 114.38 114.51 2vl4 h ARG 161 Ca -0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 59.94 2vl4 h ARG 161 Cb 0.53 0.00 -0.03 0.00 -0.00 0.00 0.00 29.97 30.48 2vl4 h ARG 161 CO 0.03 0.33 0.26 0.37 -0.00 0.00 0.00 179.97 180.97 2vl4 h GLN 162 N 0.00 0.75 0.00 0.08 5.75 -1.08 -3.28 115.11 117.34 2vl4 h GLN 162 Ca -0.00 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.41 2vl4 h GLN 162 Cb 0.82 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 29.22 2vl4 h GLN 162 CO 0.04 0.59 -0.87 0.25 -2.65 0.00 0.00 178.83 176.19 2vl4 n THR 163 N -4.37 0.00 -0.33 2.39 -2.24 -0.46 -4.42 114.28 104.85 2vl4 n THR 163 Ca 0.05 -0.13 0.07 0.00 -2.27 0.00 0.00 64.05 61.77 2vl4 n THR 163 Cb 0.13 0.93 0.23 0.00 -2.10 0.00 0.00 70.33 69.51 2vl4 n THR 163 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2vl4 h LEU 164 N 0.00 0.76 -1.04 3.22 3.38 -0.93 -0.39 115.31 120.30 2vl4 h LEU 164 Ca 0.00 0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 2vl4 h LEU 164 Cb 0.43 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2vl4 h LEU 164 CO 0.00 0.38 -0.45 1.55 0.09 0.00 0.00 178.44 180.02 2vl4 h PRO 165 N 0.84 0.07 -0.26 1.13 0.13 -1.77 -0.29 132.00 131.84 2vl4 h PRO 165 Ca 0.47 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 65.49 2vl4 h PRO 165 Cb 0.54 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.66 2vl4 h PRO 165 CO -0.30 0.50 -0.17 0.37 -0.23 0.00 0.00 178.00 178.18 2vl4 h GLN 166 N 0.06 0.58 -0.44 0.86 4.15 -1.62 -1.83 115.11 116.86 2vl4 h GLN 166 Ca 0.00 -0.27 -0.01 0.00 0.77 0.00 0.00 58.65 59.14 2vl4 h GLN 166 Cb 0.82 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.48 2vl4 h GLN 166 CO 0.06 0.85 0.25 -0.92 -1.93 0.00 0.00 178.83 177.14 2vl4 h TYR 167 N 0.30 0.60 -0.54 3.99 3.20 -0.97 -2.74 116.97 120.81 2vl4 h TYR 167 Ca 0.05 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.97 2vl4 h TYR 167 Cb 0.70 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.75 2vl4 h TYR 167 CO 0.07 0.44 0.36 0.00 -1.64 0.00 0.00 178.16 177.39 2vl4 h ALA 168 N 1.10 1.87 0.00 1.82 0.00 -0.92 -1.15 119.26 121.99 2vl4 h ALA 168 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2vl4 h ALA 168 Cb 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2vl4 h ALA 168 CO -0.03 0.04 0.00 0.66 0.00 0.00 0.00 179.25 179.92 2vl4 h SER 169 N 0.49 0.00 0.94 0.00 4.64 -1.06 -3.36 113.55 115.20 2vl4 h SER 169 Ca 0.23 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.34 2vl4 h SER 169 Cb 0.29 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.35 2vl4 h SER 169 CO -0.06 0.00 -1.10 -1.13 -0.87 0.00 0.00 176.83 173.66 2vl4 h ASN 170 N 0.00 0.00 0.00 4.97 -1.24 -0.92 -3.48 115.58 114.91 2vl4 h ASN 170 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2vl4 h ASN 170 Cb 0.62 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.67 2vl4 h ASN 170 CO 0.00 0.95 0.00 0.61 -1.29 0.00 0.00 177.43 177.70 2vl4 n GLY 171 N 1.38 0.83 3.35 1.57 0.00 -1.25 -4.97 105.19 106.10 2vl4 n GLY 171 Ca -0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.89 2vl4 n GLY 171 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2vl4 s PHE 172 N -3.20 0.22 -0.24 1.61 -0.12 -1.26 -5.15 117.98 109.84 2vl4 s PHE 172 Ca 0.00 -0.58 -0.07 0.00 -0.05 0.00 0.00 56.93 56.23 2vl4 s PHE 172 Cb 0.00 0.05 -0.03 0.00 -0.63 0.00 0.00 43.02 42.42 2vl4 s PHE 172 CO 0.00 -0.73 0.06 1.21 -0.05 0.00 0.00 175.22 175.70 2vl4 s ASN 173 N -2.92 5.05 0.46 1.98 2.47 -1.26 -5.03 114.94 115.69 2vl4 s ASN 173 Ca 0.13 -0.22 -0.24 0.00 0.42 0.00 0.00 52.86 52.95 2vl4 s ASN 173 Cb 0.03 -1.90 -0.09 0.00 -1.45 0.00 0.00 41.25 37.84 2vl4 s ASN 173 CO -0.03 -0.02 1.24 -1.22 -3.72 0.00 0.00 177.10 173.35 2vl4 n TYR 174 N 4.84 1.99 -1.54 0.43 4.01 -1.26 -4.87 117.16 120.75 2vl4 n TYR 174 Ca -0.16 0.48 -0.34 0.00 -0.16 0.00 0.00 57.90 57.72 2vl4 n TYR 174 Cb 0.51 -2.34 -0.04 0.00 -0.31 0.00 0.00 39.34 37.15 2vl4 n TYR 174 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2vl4 n PRO 175 N -0.23 3.61 -3.13 -0.72 -0.04 -1.26 -4.73 135.00 128.50 2vl4 n PRO 175 Ca 0.08 -2.52 -0.44 0.00 -0.04 0.00 0.00 63.50 60.58 2vl4 n PRO 175 Cb 0.41 -2.53 -0.00 0.00 -0.04 0.00 0.00 33.50 31.34 2vl4 n PRO 175 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2vl4 s ALA 176 N 0.21 4.35 0.61 0.55 0.00 -1.26 -4.73 121.76 121.49 2vl4 s ALA 176 Ca 0.62 -3.59 0.32 0.00 0.00 0.00 0.00 51.96 49.32 2vl4 s ALA 176 Cb 0.23 -3.87 1.85 0.00 0.00 0.00 0.00 23.12 21.34 2vl4 s ALA 176 CO -0.09 -2.51 2.17 -0.44 0.00 0.00 0.00 175.76 174.89 2vl4 h ASP 177 N 6.93 0.00 0.93 0.00 3.32 -1.89 -1.48 116.42 124.23 2vl4 h ASP 177 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 2vl4 h ASP 177 Cb 0.87 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.42 2vl4 h ASP 177 CO 1.14 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 179.25 2vl4 n ASN 178 N -3.56 0.03 -4.56 6.45 3.02 -1.26 -4.61 115.26 110.77 2vl4 n ASN 178 Ca -0.01 0.50 -0.43 0.00 -0.03 0.00 0.00 54.58 54.62 2vl4 n ASN 178 Cb 0.23 -0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 38.85 2vl4 n ASN 178 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2vl4 s ASP 179 N -3.06 6.43 -1.25 6.41 -1.08 -0.56 -3.47 116.67 120.09 2vl4 s ASP 179 Ca 0.13 -0.03 -0.11 0.00 -0.52 0.00 0.00 52.55 52.02 2vl4 s ASP 179 Cb 0.17 -2.49 0.18 0.00 -1.46 0.00 0.00 42.92 39.31 2vl4 s ASP 179 CO 0.49 -1.29 1.71 1.41 0.52 0.00 0.00 175.17 178.00 2vl4 n HIS 180 N 7.81 3.60 -3.53 -5.34 8.25 -0.74 -4.81 115.22 120.47 2vl4 n HIS 180 Ca 0.06 -2.98 -0.14 0.00 -0.26 0.00 0.00 57.72 54.40 2vl4 n HIS 180 Cb 0.48 -2.00 -0.04 0.00 1.12 0.00 0.00 29.99 29.55 2vl4 n HIS 180 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2vl4 s HIS 181 N 0.62 -0.49 0.23 4.41 5.04 -1.26 -5.00 115.29 118.84 2vl4 s HIS 181 Ca 0.40 0.53 -0.07 0.00 -1.54 0.00 0.00 55.06 54.38 2vl4 s HIS 181 Cb 0.05 0.41 0.21 0.00 0.04 0.00 0.00 32.58 33.29 2vl4 s HIS 181 CO 0.01 -0.70 1.84 1.49 -2.34 0.00 0.00 174.74 175.05 2vl4 h GLU 182 N 2.59 1.25 -5.29 2.88 4.81 -2.02 -3.40 114.58 115.40 2vl4 h GLU 182 Ca -0.31 -0.16 -0.60 0.00 -0.13 0.00 0.00 59.36 58.15 2vl4 h GLU 182 Cb 1.23 -0.24 -0.12 0.00 0.63 0.00 0.00 28.75 30.25 2vl4 h GLU 182 CO 0.40 0.93 -0.40 0.15 -0.73 0.00 0.00 179.01 179.36 2vl4 s LYS 183 N -5.78 4.16 -1.20 1.92 1.02 -1.26 -5.01 119.74 113.59 2vl4 s LYS 183 Ca -0.13 -0.09 -0.12 0.00 0.02 0.00 0.00 55.97 55.66 2vl4 s LYS 183 Cb 0.17 -3.48 0.19 0.00 -0.52 0.00 0.00 37.83 34.19 2vl4 s LYS 183 CO 0.83 0.14 1.44 0.72 -0.92 0.00 0.00 175.35 177.56 2vl4 n HIS 184 N 3.98 4.68 0.43 3.18 8.25 -1.26 -4.79 115.22 129.69 2vl4 n HIS 184 Ca -0.13 -3.36 0.13 0.00 -0.26 0.00 0.00 57.72 54.09 2vl4 n HIS 184 Cb 0.52 -2.04 0.29 0.00 1.12 0.00 0.00 29.99 29.88 2vl4 n HIS 184 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2vl4 h LEU 185 N 8.79 0.00 -0.91 2.41 3.38 -1.95 -3.33 115.31 123.71 2vl4 h LEU 185 Ca 0.30 -0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.44 2vl4 h LEU 185 Cb 0.83 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.48 2vl4 h LEU 185 CO 1.26 0.00 0.49 0.77 0.09 0.00 0.00 178.44 181.05 2vl4 h SER 186 N 0.00 0.60 0.56 -0.43 4.64 -1.93 -1.79 113.55 115.20 2vl4 h SER 186 Ca 0.00 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2vl4 h SER 186 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2vl4 h SER 186 CO 0.00 0.22 0.00 -0.37 -0.87 0.00 0.00 176.83 175.81 2vl4 h VAL 187 N 0.65 0.00 0.00 0.95 -1.51 -1.96 -2.03 116.25 112.35 2vl4 h VAL 187 Ca 0.51 -0.23 0.00 0.00 -1.23 0.00 0.00 66.70 65.75 2vl4 h VAL 187 Cb 0.77 1.04 0.00 0.00 -2.13 0.00 0.00 31.29 30.97 2vl4 h VAL 187 CO -0.39 0.00 -0.43 0.49 -1.23 0.00 0.00 177.57 176.02 2vl4 n PHE 188 N -2.62 0.50 -5.08 5.19 3.72 -0.67 -4.52 117.46 113.98 2vl4 n PHE 188 Ca 0.00 0.15 -0.32 0.00 -0.05 0.00 0.00 57.45 57.23 2vl4 n PHE 188 Cb 0.19 -0.64 -0.15 0.00 -0.94 0.00 0.00 39.48 37.94 2vl4 n PHE 188 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2vl4 s SER 189 N -4.00 3.53 -1.28 4.37 0.01 -0.76 -5.03 113.70 110.53 2vl4 s SER 189 Ca 0.08 -0.36 -0.16 0.00 1.31 0.00 0.00 55.95 56.83 2vl4 s SER 189 Cb 0.14 -0.78 0.10 0.00 0.21 0.00 0.00 66.02 65.69 2vl4 s SER 189 CO 0.68 0.30 1.69 0.54 0.41 0.00 0.00 173.24 176.86 2vl4 n ARG 190 N 2.62 3.25 -3.87 12.44 5.12 -1.26 -4.87 116.66 130.09 2vl4 n ARG 190 Ca -0.17 -3.42 -0.11 0.00 -1.93 0.00 0.00 57.85 52.22 2vl4 n ARG 190 Cb 0.52 -3.31 -0.11 0.00 -1.16 0.00 0.00 32.46 28.40 2vl4 n ARG 190 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2vl4 s LYS 191 N 3.10 0.30 -0.38 5.56 2.20 -1.26 -1.13 119.74 128.13 2vl4 s LYS 191 Ca 0.49 -0.18 -0.41 0.00 -0.36 0.00 0.00 55.97 55.51 2vl4 s LYS 191 Cb 0.03 0.13 -0.16 0.00 -1.51 0.00 0.00 37.83 36.32 2vl4 s LYS 191 CO 0.04 -0.06 1.90 0.00 -0.36 0.00 0.00 175.35 176.86 2vl4 n ALA 192 N 2.17 -0.03 -0.26 3.13 0.00 -1.26 -4.85 120.51 119.41 2vl4 n ALA 192 Ca -0.18 0.27 0.03 0.00 0.00 0.00 0.00 53.44 53.56 2vl4 n ALA 192 Cb 0.57 -2.21 0.16 0.00 0.00 0.00 0.00 19.45 17.96 2vl4 n ALA 192 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2vl4 h PRO 193 N 8.32 0.58 0.00 0.00 0.11 -1.70 -1.84 132.00 137.46 2vl4 h PRO 193 Ca -0.35 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.73 2vl4 h PRO 193 Cb 1.35 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 2vl4 h PRO 193 CO 1.00 0.38 -0.00 0.10 -0.21 0.00 0.00 178.00 179.27 2vl4 h TYR 194 N 0.60 0.00 0.00 0.65 -0.00 -1.15 -2.28 116.97 114.79 2vl4 h TYR 194 Ca 0.38 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 59.09 2vl4 h TYR 194 Cb 0.44 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.17 2vl4 h TYR 194 CO -0.11 0.00 -0.07 0.66 -0.00 0.00 0.00 178.16 178.64 2vl4 h SER 195 N 0.00 0.00 0.03 0.10 4.64 -1.61 0.60 113.55 117.31 2vl4 h SER 195 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2vl4 h SER 195 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2vl4 h SER 195 CO 0.00 0.07 -0.00 -1.22 -0.87 0.00 0.00 176.83 174.81 2vl4 n TYR 196 N -3.70 0.00 0.00 4.77 4.01 -0.86 -1.69 117.16 119.69 2vl4 n TYR 196 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 2vl4 n TYR 196 Cb 0.18 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 2vl4 n TYR 196 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2vl4 n GLY 197 N 1.03 3.11 3.73 2.72 0.00 0.20 -1.78 105.19 114.19 2vl4 n GLY 197 Ca 0.23 -1.92 -0.10 0.00 0.00 0.00 0.00 46.02 44.23 2vl4 n GLY 197 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2vl4 s TRP 198 N -2.78 0.37 -2.00 1.61 -0.11 -1.18 -4.44 118.94 110.42 2vl4 s TRP 198 Ca 0.00 -0.96 0.10 0.00 1.22 0.00 0.00 56.10 56.46 2vl4 s TRP 198 Cb 0.00 0.63 0.59 0.00 -1.50 0.00 0.00 33.47 33.19 2vl4 s TRP 198 CO 0.00 -1.50 1.33 -0.40 -4.62 0.00 0.00 176.95 171.76 2vl4 n ASP 199 N -1.50 0.00 -0.11 5.86 5.68 -1.26 -2.00 116.55 123.21 2vl4 n ASP 199 Ca -0.06 -1.56 0.01 0.00 -0.50 0.00 0.00 54.79 52.68 2vl4 n ASP 199 Cb 0.60 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.59 2vl4 n ASP 199 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 2vl4 n TRP 200 N -0.67 0.00 -4.23 2.11 4.27 -1.26 -3.50 117.44 114.16 2vl4 n TRP 200 Ca 0.07 -0.16 -0.18 0.00 -3.89 0.00 0.00 57.50 53.34 2vl4 n TRP 200 Cb 0.03 -0.03 -0.13 0.00 -1.36 0.00 0.00 31.31 29.83 2vl4 n TRP 200 CO 0.00 0.00 0.00 0.20 -2.29 0.00 0.00 177.69 175.60 2vl4 s GLY 201 N -0.59 0.77 0.33 -1.67 0.00 -0.85 -4.80 107.32 100.51 2vl4 s GLY 201 Ca 0.02 -0.87 -0.26 0.00 0.00 0.00 0.00 44.72 43.61 2vl4 s GLY 201 CO 0.00 -0.88 1.00 -1.50 0.00 0.00 0.00 173.10 171.72 2vl4 s ILE 202 N -1.07 3.95 -0.35 0.90 2.07 -1.26 -3.08 121.20 122.36 2vl4 s ILE 202 Ca -0.01 1.67 -0.29 0.00 -1.41 0.00 0.00 60.65 60.61 2vl4 s ILE 202 Cb -0.09 -3.95 0.02 0.00 0.13 0.00 0.00 42.46 38.57 2vl4 s ILE 202 CO 0.02 0.18 1.11 -0.60 -1.91 0.00 0.00 174.94 173.73 2vl4 s ARG 203 N -1.98 3.98 -0.40 3.50 3.52 -1.26 -4.09 118.95 122.22 2vl4 s ARG 203 Ca 0.50 0.98 0.03 0.00 -0.13 0.00 0.00 55.73 57.11 2vl4 s ARG 203 Cb -0.22 -3.79 0.16 0.00 -1.56 0.00 0.00 34.95 29.54 2vl4 s ARG 203 CO 0.28 -1.02 0.38 -1.64 -0.81 0.00 0.00 175.30 172.49 2vl4 s MET 204 N 3.87 0.78 -0.98 5.12 -1.94 -0.68 -4.90 119.30 120.57 2vl4 s MET 204 Ca 0.47 -1.44 -0.23 0.00 -1.71 0.00 0.00 55.69 52.78 2vl4 s MET 204 Cb -0.11 -0.99 0.06 0.00 2.01 0.00 0.00 34.83 35.80 2vl4 s MET 204 CO 0.20 -1.29 1.39 0.08 -0.01 0.00 0.00 175.02 175.39 2vl4 s VAL 205 N 0.78 4.00 0.58 -6.03 1.01 -1.20 -4.79 120.40 114.75 2vl4 s VAL 205 Ca 0.25 -0.75 0.07 0.00 0.00 0.00 0.00 61.98 61.55 2vl4 s VAL 205 Cb -0.08 -5.01 0.08 0.00 0.00 0.00 0.00 36.38 31.38 2vl4 s VAL 205 CO -0.09 -1.88 0.80 0.28 0.00 0.00 0.00 175.10 174.22 2vl4 s THR 206 N 4.77 2.29 0.16 3.92 -1.32 -1.26 -4.42 115.64 119.77 2vl4 s THR 206 Ca 0.43 -0.91 -0.07 0.00 -1.21 0.00 0.00 61.69 59.93 2vl4 s THR 206 Cb -0.01 -2.38 -0.02 0.00 -1.51 0.00 0.00 72.50 68.58 2vl4 s THR 206 CO -0.08 0.00 0.24 -0.44 -2.21 0.00 0.00 174.62 172.13 2vl4 s SER 207 N -4.63 0.10 0.00 8.08 0.01 -1.26 -4.80 113.70 111.20 2vl4 s SER 207 Ca 0.62 -0.95 0.00 0.00 1.31 0.00 0.00 55.95 56.93 2vl4 s SER 207 Cb -0.06 0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.57 2vl4 s SER 207 CO 0.39 -0.86 0.00 0.61 0.41 0.00 0.00 173.24 173.79 2vl4 n GLY 208 N -0.19 0.66 3.47 3.44 0.00 0.04 -1.38 105.19 111.24 2vl4 n GLY 208 Ca -0.07 -1.88 -0.43 0.00 0.00 0.00 0.00 46.02 43.64 2vl4 n GLY 208 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vl4 s VAL 209 N -1.24 4.49 -1.04 1.61 1.01 -1.25 -1.02 120.40 122.97 2vl4 s VAL 209 Ca 0.00 -1.20 0.26 0.00 0.00 0.00 0.00 61.98 61.04 2vl4 s VAL 209 Cb 0.00 -4.82 0.08 0.00 0.00 0.00 0.00 36.38 31.63 2vl4 s VAL 209 CO 0.00 -1.59 1.55 -2.67 0.00 0.00 0.00 175.10 172.39 2vl4 n TRP 210 N 7.24 0.00 -4.20 5.22 4.27 -0.99 -1.21 117.44 127.77 2vl4 n TRP 210 Ca 0.21 0.00 -0.12 0.00 -3.89 0.00 0.00 57.50 53.71 2vl4 n TRP 210 Cb 0.49 -0.30 -0.10 0.00 -1.36 0.00 0.00 31.31 30.04 2vl4 n TRP 210 CO 0.00 0.00 0.00 1.03 -2.29 0.00 0.00 177.69 176.43 2vl4 s ARG 211 N -2.97 1.13 0.76 -2.67 0.52 -1.22 -4.54 118.95 109.97 2vl4 s ARG 211 Ca 0.13 -1.58 -0.14 0.00 -0.52 0.00 0.00 55.73 53.62 2vl4 s ARG 211 Cb 0.18 0.16 0.06 0.00 0.52 0.00 0.00 34.95 35.87 2vl4 s ARG 211 CO 0.65 -0.32 1.17 -2.14 0.02 0.00 0.00 175.30 174.68 2vl4 s PRO 212 N -4.09 2.00 -0.18 3.54 0.02 -1.26 -4.21 135.00 130.81 2vl4 s PRO 212 Ca 0.33 1.62 0.00 0.00 0.02 0.00 0.00 61.00 62.97 2vl4 s PRO 212 Cb 0.07 -1.83 0.01 0.00 0.02 0.00 0.00 34.50 32.77 2vl4 s PRO 212 CO 0.08 -1.91 -0.17 0.08 -0.33 0.00 0.00 177.00 174.75 2vl4 s VAL 213 N -2.24 2.36 0.09 3.83 1.01 -1.26 -1.71 120.40 122.48 2vl4 s VAL 213 Ca 0.71 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.91 2vl4 s VAL 213 Cb -0.26 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 2vl4 s VAL 213 CO 0.48 0.52 -0.18 0.42 0.00 0.00 0.00 175.10 176.34 2vl4 s THR 214 N 1.24 1.48 -0.16 3.92 -4.23 -0.58 -1.01 115.64 116.29 2vl4 s THR 214 Ca 0.03 -1.44 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 2vl4 s THR 214 Cb -0.14 -1.37 0.00 0.00 1.34 0.00 0.00 72.50 72.34 2vl4 s THR 214 CO -0.09 -0.12 -0.16 -0.22 -0.54 0.00 0.00 174.62 173.50 2vl4 s LEU 215 N -1.82 2.43 -0.13 4.79 2.96 -0.02 -0.57 118.68 126.31 2vl4 s LEU 215 Ca 0.03 -0.49 0.01 0.00 -0.22 0.00 0.00 54.13 53.46 2vl4 s LEU 215 Cb -0.10 -1.55 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 2vl4 s LEU 215 CO 0.03 0.07 -0.17 -0.60 -1.32 0.00 0.00 176.35 174.37 2vl4 s ARG 216 N 0.88 3.24 -0.25 1.98 3.52 0.72 -0.10 118.95 128.94 2vl4 s ARG 216 Ca -0.04 -0.76 -0.04 0.00 -0.13 0.00 0.00 55.73 54.76 2vl4 s ARG 216 Cb -0.15 -2.54 0.00 0.00 -1.56 0.00 0.00 34.95 30.70 2vl4 s ARG 216 CO -0.01 0.14 -0.00 -0.06 -0.81 0.00 0.00 175.30 174.55 2vl4 s PHE 217 N 0.50 3.05 0.20 5.12 0.08 -0.09 -0.83 117.98 126.01 2vl4 s PHE 217 Ca -0.11 -1.08 -0.06 0.00 0.12 0.00 0.00 56.93 55.79 2vl4 s PHE 217 Cb -0.16 -2.14 -0.02 0.00 -0.57 0.00 0.00 43.02 40.12 2vl4 s PHE 217 CO 0.05 -0.59 0.27 1.52 -0.10 0.00 0.00 175.22 176.36 2vl4 s TYR 218 N 1.45 0.73 0.06 0.36 -0.85 -0.42 -0.89 117.35 117.80 2vl4 s TYR 218 Ca 0.03 -1.03 0.07 0.00 -0.52 0.00 0.00 57.07 55.62 2vl4 s TYR 218 Cb -0.16 -0.21 -0.04 0.00 0.38 0.00 0.00 41.96 41.94 2vl4 s TYR 218 CO -0.02 -0.77 -0.14 -0.51 -1.52 0.00 0.00 175.55 172.60 2vl4 s ASP 219 N -3.07 4.12 0.00 -0.18 1.01 -1.26 -1.48 116.67 115.81 2vl4 s ASP 219 Ca 0.28 -0.39 0.00 0.00 0.71 0.00 0.00 52.55 53.15 2vl4 s ASP 219 Cb 0.04 -0.74 0.00 0.00 1.01 0.00 0.00 42.92 43.23 2vl4 s ASP 219 CO 0.08 0.23 0.00 -0.38 0.21 0.00 0.00 175.17 175.31 2vl4 n ILE 220 N 1.19 0.00 -3.67 0.77 2.08 -1.26 -4.78 119.36 113.70 2vl4 n ILE 220 Ca -0.15 0.00 -0.09 0.00 0.56 0.00 0.00 62.75 63.06 2vl4 n ILE 220 Cb 0.52 0.00 -0.02 0.00 -0.75 0.00 0.00 39.64 39.39 2vl4 n ILE 220 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2vl4 s ALA 221 N 0.00 -1.33 0.18 -1.39 0.00 -1.26 -0.94 121.76 117.02 2vl4 s ALA 221 Ca 0.00 0.02 0.10 0.00 0.00 0.00 0.00 51.96 52.08 2vl4 s ALA 221 Cb 0.00 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.95 2vl4 s ALA 221 CO 0.00 -0.90 -0.21 0.95 0.00 0.00 0.00 175.76 175.60 2vl4 s THR 222 N -3.85 2.08 -0.49 0.00 -4.23 -0.77 -4.60 115.64 103.79 2vl4 s THR 222 Ca 0.07 -1.98 -0.26 0.00 -1.18 0.00 0.00 61.69 58.34 2vl4 s THR 222 Cb -0.03 -1.98 0.03 0.00 1.34 0.00 0.00 72.50 71.86 2vl4 s THR 222 CO -0.02 -0.22 0.98 -0.63 -0.54 0.00 0.00 174.62 174.18 2vl4 s ILE 223 N -1.88 4.38 0.18 2.99 1.01 -1.26 -0.83 121.20 125.79 2vl4 s ILE 223 Ca 0.18 0.75 0.05 0.00 0.00 0.00 0.00 60.65 61.63 2vl4 s ILE 223 Cb -0.07 -4.50 -0.13 0.00 0.01 0.00 0.00 42.46 37.77 2vl4 s ILE 223 CO 0.08 -0.95 1.42 0.28 0.00 0.00 0.00 174.94 175.77 2vl4 h SER 224 N 9.18 0.15 -4.25 3.58 0.02 -0.79 -3.46 113.55 117.98 2vl4 h SER 224 Ca -0.24 -0.12 -0.09 0.00 -0.84 0.00 0.00 61.79 60.49 2vl4 h SER 224 Cb 1.07 -0.05 -0.22 0.00 0.14 0.00 0.00 62.40 63.35 2vl4 h SER 224 CO 1.07 0.91 -0.10 -0.62 -1.14 0.00 0.00 176.83 176.95 2vl4 s ASP 225 N -6.87 -0.49 -0.13 3.07 2.15 -1.07 -4.98 116.67 108.34 2vl4 s ASP 225 Ca -0.02 0.83 -0.01 0.00 0.43 0.00 0.00 52.55 53.78 2vl4 s ASP 225 Cb 0.11 0.85 0.04 0.00 -0.30 0.00 0.00 42.92 43.62 2vl4 s ASP 225 CO 0.81 -0.28 -0.03 -0.47 -0.17 0.00 0.00 175.17 175.02 2vl4 s TYR 226 N -0.20 1.31 -0.22 -5.34 5.04 -1.26 -1.38 117.35 115.30 2vl4 s TYR 226 Ca -0.04 -0.75 -0.02 0.00 -2.44 0.00 0.00 57.07 53.82 2vl4 s TYR 226 Cb -0.03 -1.13 0.01 0.00 0.35 0.00 0.00 41.96 41.16 2vl4 s TYR 226 CO 0.03 -0.52 -0.09 -0.47 -1.34 0.00 0.00 175.55 173.15 2vl4 s TYR 227 N 1.76 2.95 -0.55 4.97 5.04 -0.10 -4.96 117.35 126.46 2vl4 s TYR 227 Ca 0.03 -1.35 -0.19 0.00 -2.44 0.00 0.00 57.07 53.12 2vl4 s TYR 227 Cb -0.14 -2.04 0.08 0.00 0.35 0.00 0.00 41.96 40.21 2vl4 s TYR 227 CO -0.07 -0.68 0.67 0.08 -1.34 0.00 0.00 175.55 174.20 2vl4 s VAL 228 N 1.37 4.84 -0.27 3.14 1.01 -1.26 -0.81 120.40 128.42 2vl4 s VAL 228 Ca 0.04 -0.74 -0.12 0.00 0.00 0.00 0.00 61.98 61.16 2vl4 s VAL 228 Cb -0.15 -4.40 -0.05 0.00 0.00 0.00 0.00 36.38 31.79 2vl4 s VAL 228 CO -0.06 -0.97 0.24 -0.60 0.00 0.00 0.00 175.10 173.70 2vl4 s ARG 229 N 2.68 3.99 -0.24 2.72 3.52 -0.04 -4.93 118.95 126.65 2vl4 s ARG 229 Ca 0.13 -0.21 -0.25 0.00 -0.13 0.00 0.00 55.73 55.27 2vl4 s ARG 229 Cb -0.22 -3.64 -0.00 0.00 -1.56 0.00 0.00 34.95 29.53 2vl4 s ARG 229 CO 0.09 -0.17 0.87 -1.14 -0.81 0.00 0.00 175.30 174.14 2vl4 s GLN 230 N 1.73 4.20 -0.06 5.12 0.74 -1.26 -0.14 119.66 129.99 2vl4 s GLN 230 Ca 0.09 1.01 -0.10 0.00 0.05 0.00 0.00 55.36 56.41 2vl4 s GLN 230 Cb -0.16 -3.64 -0.30 0.00 1.10 0.00 0.00 33.01 30.01 2vl4 s GLN 230 CO 0.10 -0.54 0.61 -0.07 -0.55 0.00 0.00 175.29 174.84 2vl4 h LEU 231 N 9.23 0.58 -7.13 3.68 3.38 -0.40 -3.48 115.31 121.16 2vl4 h LEU 231 Ca -0.22 -0.94 -0.02 0.00 0.09 0.00 0.00 57.88 56.79 2vl4 h LEU 231 Cb 1.09 -0.19 -0.12 0.00 0.09 0.00 0.00 40.66 41.53 2vl4 h LEU 231 CO 0.89 1.81 0.17 -0.94 0.09 0.00 0.00 178.44 180.46 2vl4 s SER 232 N -7.25 -0.50 -0.14 -0.43 1.04 -1.11 -4.99 113.70 100.33 2vl4 s SER 232 Ca -0.17 -0.09 -0.06 0.00 0.48 0.00 0.00 55.95 56.11 2vl4 s SER 232 Cb 0.06 0.59 0.06 0.00 0.10 0.00 0.00 66.02 66.83 2vl4 s SER 232 CO 0.84 -0.98 0.30 -0.22 0.98 0.00 0.00 173.24 174.15 2vl4 s LEU 233 N -2.77 -0.15 0.33 2.42 2.96 -1.26 -1.45 118.68 118.76 2vl4 s LEU 233 Ca 0.02 0.67 0.03 0.00 -0.22 0.00 0.00 54.13 54.64 2vl4 s LEU 233 Cb -0.01 0.88 -0.05 0.00 0.50 0.00 0.00 46.19 47.51 2vl4 s LEU 233 CO -0.11 -0.21 0.09 0.42 -1.32 0.00 0.00 176.35 175.21 2vl4 s THR 234 N 2.04 0.84 0.55 3.68 -4.23 -0.06 -4.99 115.64 113.46 2vl4 s THR 234 Ca -0.03 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 58.75 2vl4 s THR 234 Cb -0.11 -2.62 0.40 0.00 1.34 0.00 0.00 72.50 71.51 2vl4 s THR 234 CO -0.10 0.00 1.98 0.44 -0.54 0.00 0.00 174.62 176.40 2vl4 h ASP 235 N 2.09 0.00 0.61 3.99 3.32 -2.01 -2.87 116.42 121.54 2vl4 h ASP 235 Ca -0.38 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.39 2vl4 h ASP 235 Cb 1.25 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.76 2vl4 h ASP 235 CO 0.63 0.00 -1.51 -0.33 -1.72 0.00 0.00 179.24 176.32 2vl4 h GLU 236 N 0.00 0.04 -2.00 3.56 3.07 -1.95 -3.35 114.58 113.96 2vl4 h GLU 236 Ca 0.25 -0.06 -0.04 0.00 -0.50 0.00 0.00 59.36 59.01 2vl4 h GLU 236 Cb 1.06 0.02 -0.21 0.00 -0.84 0.00 0.00 28.75 28.78 2vl4 h GLU 236 CO -0.00 0.73 0.13 1.21 -1.40 0.00 0.00 179.01 179.68 2vl4 s ASN 237 N -6.39 -0.75 -0.16 1.42 2.47 -1.09 -0.90 114.94 109.53 2vl4 s ASN 237 Ca -0.04 1.45 -0.03 0.00 0.42 0.00 0.00 52.86 54.66 2vl4 s ASN 237 Cb 0.08 1.47 -0.02 0.00 -1.45 0.00 0.00 41.25 41.33 2vl4 s ASN 237 CO 0.82 -0.25 -0.07 0.00 -3.72 0.00 0.00 177.10 173.89 2vl4 s ALA 238 N 0.39 2.82 -0.19 1.71 0.00 0.00 -0.89 121.76 125.61 2vl4 s ALA 238 Ca -0.00 -0.94 -0.04 0.00 0.00 0.00 0.00 51.96 50.98 2vl4 s ALA 238 Cb -0.05 -1.49 -0.02 0.00 0.00 0.00 0.00 23.12 21.56 2vl4 s ALA 238 CO 0.01 0.05 -0.02 1.03 0.00 0.00 0.00 175.76 176.82 2vl4 s ARG 239 N 0.66 3.56 0.12 0.00 0.52 -0.53 -1.12 118.95 122.16 2vl4 s ARG 239 Ca -0.04 -0.55 0.10 0.00 -0.52 0.00 0.00 55.73 54.71 2vl4 s ARG 239 Cb -0.15 -3.01 -0.04 0.00 0.52 0.00 0.00 34.95 32.28 2vl4 s ARG 239 CO 0.02 0.02 -0.24 -0.51 0.02 0.00 0.00 175.30 174.62 2vl4 s LEU 240 N 0.95 2.31 -0.20 2.53 2.01 0.09 0.40 118.68 126.77 2vl4 s LEU 240 Ca 0.01 -0.72 0.01 0.00 0.01 0.00 0.00 54.13 53.44 2vl4 s LEU 240 Cb -0.14 -1.04 0.03 0.00 0.01 0.00 0.00 46.19 45.05 2vl4 s LEU 240 CO 0.01 0.12 -0.15 -0.55 1.01 0.00 0.00 176.35 176.79 2vl4 s SER 241 N -1.98 3.46 -0.47 2.29 0.15 0.80 -1.12 113.70 116.84 2vl4 s SER 241 Ca 0.10 -0.86 -0.22 0.00 0.70 0.00 0.00 55.95 55.66 2vl4 s SER 241 Cb -0.10 -1.42 0.03 0.00 -1.71 0.00 0.00 66.02 62.82 2vl4 s SER 241 CO 0.05 -0.08 0.76 0.20 1.20 0.00 0.00 173.24 175.37 2vl4 s ASN 242 N 1.28 6.36 -0.30 5.45 -0.87 0.25 -0.86 114.94 126.26 2vl4 s ASN 242 Ca 0.00 -0.28 -0.06 0.00 -1.57 0.00 0.00 52.86 50.95 2vl4 s ASN 242 Cb -0.15 -2.37 0.02 0.00 -0.02 0.00 0.00 41.25 38.72 2vl4 s ASN 242 CO -0.10 -0.93 0.07 -1.61 -2.57 0.00 0.00 177.10 171.96 2vl4 s GLU 243 N 3.22 2.99 0.01 -0.60 2.02 0.01 -0.74 118.70 125.61 2vl4 s GLU 243 Ca 0.27 -0.92 0.05 0.00 0.02 0.00 0.00 54.97 54.39 2vl4 s GLU 243 Cb -0.13 -3.34 -0.03 0.00 0.10 0.00 0.00 34.13 30.72 2vl4 s GLU 243 CO 0.20 -0.47 -0.14 -0.51 0.02 0.00 0.00 175.26 174.36 2vl4 s LEU 244 N 1.47 2.77 -0.19 1.80 1.43 0.59 -0.92 118.68 125.63 2vl4 s LEU 244 Ca 0.02 -0.30 -0.01 0.00 -1.03 0.00 0.00 54.13 52.81 2vl4 s LEU 244 Cb -0.17 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.45 2vl4 s LEU 244 CO 0.02 0.29 -0.13 -0.63 0.23 0.00 0.00 176.35 176.12 2vl4 s ILE 245 N -0.89 2.68 -0.14 -0.59 1.01 -0.48 -1.09 121.20 121.71 2vl4 s ILE 245 Ca 0.14 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 60.07 2vl4 s ILE 245 Cb -0.11 -2.17 -0.00 0.00 0.01 0.00 0.00 42.46 40.19 2vl4 s ILE 245 CO 0.04 0.49 -0.17 -0.69 0.00 0.00 0.00 174.94 174.62 2vl4 s VAL 246 N 1.25 2.63 -0.36 2.92 1.01 -0.14 -0.01 120.40 127.70 2vl4 s VAL 246 Ca 0.03 -0.80 -0.09 0.00 0.00 0.00 0.00 61.98 61.13 2vl4 s VAL 246 Cb -0.14 -2.09 0.03 0.00 0.00 0.00 0.00 36.38 34.19 2vl4 s VAL 246 CO -0.06 0.53 0.15 0.21 0.00 0.00 0.00 175.10 175.93 2vl4 s ASN 247 N 0.58 5.51 -0.13 3.32 2.47 -0.01 -0.35 114.94 126.34 2vl4 s ASN 247 Ca -0.10 -1.08 -0.17 0.00 0.42 0.00 0.00 52.86 51.94 2vl4 s ASN 247 Cb -0.16 -1.94 -0.04 0.00 -1.45 0.00 0.00 41.25 37.65 2vl4 s ASN 247 CO 0.03 -0.36 0.42 -1.58 -3.72 0.00 0.00 177.10 171.90 2vl4 s GLN 248 N 1.47 4.31 0.00 0.43 0.74 0.48 -1.85 119.66 125.23 2vl4 s GLN 248 Ca 0.00 0.35 0.18 0.00 0.05 0.00 0.00 55.36 55.94 2vl4 s GLN 248 Cb -0.19 -3.43 0.00 0.00 1.10 0.00 0.00 33.01 30.49 2vl4 s GLN 248 CO 0.05 0.19 0.94 1.51 -0.55 0.00 0.00 175.29 177.43 2vl4 n ILE 249 N 3.60 0.00 -4.00 -2.34 0.13 -0.11 -1.22 119.36 115.41 2vl4 n ILE 249 Ca -0.09 -0.32 -0.22 0.00 -1.10 0.00 0.00 62.75 61.02 2vl4 n ILE 249 Cb 0.52 1.22 -0.03 0.00 -0.84 0.00 0.00 39.64 40.51 2vl4 n ILE 249 CO 0.00 0.00 0.00 0.68 2.80 0.00 0.00 176.55 180.03 2vl4 s VAL 250 N -2.06 5.05 -0.36 9.51 -7.23 -1.25 -4.94 120.40 119.12 2vl4 s VAL 250 Ca 0.15 -1.04 0.26 0.00 -1.81 0.00 0.00 61.98 59.55 2vl4 s VAL 250 Cb 0.15 -3.71 0.34 0.00 0.56 0.00 0.00 36.38 33.72 2vl4 s VAL 250 CO 0.45 -0.28 1.74 1.55 -0.31 0.00 0.00 175.10 178.25 2vl4 h PRO 251 N 1.47 0.00 -7.01 4.82 0.13 -1.98 -3.40 132.00 126.03 2vl4 h PRO 251 Ca -0.50 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.14 2vl4 h PRO 251 Cb 1.22 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.40 2vl4 h PRO 251 CO 0.62 0.00 0.14 -0.65 -0.23 0.00 0.00 178.00 177.88 2vl4 s GLN 252 N -3.31 3.32 -0.02 0.86 1.11 -1.26 -4.75 119.66 115.61 2vl4 s GLN 252 Ca 0.06 0.14 -0.27 0.00 0.01 0.00 0.00 55.36 55.30 2vl4 s GLN 252 Cb 0.08 -2.33 -0.04 0.00 -1.01 0.00 0.00 33.01 29.71 2vl4 s GLN 252 CO 0.60 -0.39 0.84 0.15 0.01 0.00 0.00 175.29 176.50 2vl4 s LYS 253 N -4.84 4.51 -0.23 2.91 1.02 -1.26 -4.38 119.74 117.47 2vl4 s LYS 253 Ca 0.50 1.16 0.01 0.00 0.02 0.00 0.00 55.97 57.65 2vl4 s LYS 253 Cb -0.10 -3.44 0.06 0.00 -0.52 0.00 0.00 37.83 33.82 2vl4 s LYS 253 CO 0.45 0.04 -0.05 0.42 -0.92 0.00 0.00 175.35 175.30 2vl4 s ILE 254 N 0.78 1.47 0.25 2.17 -1.09 -0.06 -4.93 121.20 119.79 2vl4 s ILE 254 Ca 0.44 -1.20 -0.31 0.00 -2.23 0.00 0.00 60.65 57.36 2vl4 s ILE 254 Cb -0.20 -1.76 -0.12 0.00 -1.58 0.00 0.00 42.46 38.80 2vl4 s ILE 254 CO 0.23 -0.12 1.61 -2.65 -1.23 0.00 0.00 174.94 172.79 2vl4 n PRO 255 N 4.69 2.60 -3.85 2.79 -0.02 -1.26 0.66 135.00 140.62 2vl4 n PRO 255 Ca -0.12 0.93 -0.10 0.00 -2.02 0.00 0.00 63.50 62.19 2vl4 n PRO 255 Cb 0.44 -2.72 -0.08 0.00 -0.02 0.00 0.00 33.50 31.12 2vl4 n PRO 255 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vl4 s ALA 256 N 0.42 -0.35 -0.17 3.55 0.00 -0.08 -4.62 121.76 120.52 2vl4 s ALA 256 Ca 0.69 -0.33 -0.00 0.00 0.00 0.00 0.00 51.96 52.32 2vl4 s ALA 256 Cb -0.53 0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.90 2vl4 s ALA 256 CO 0.43 -0.38 -0.15 -2.00 0.00 0.00 0.00 175.76 173.65 2vl4 s GLU 257 N -2.76 3.17 -0.12 0.00 2.12 0.38 -1.03 118.70 120.46 2vl4 s GLU 257 Ca -0.04 -0.76 -0.19 0.00 0.36 0.00 0.00 54.97 54.35 2vl4 s GLU 257 Cb -0.00 -2.66 -0.04 0.00 0.26 0.00 0.00 34.13 31.69 2vl4 s GLU 257 CO -0.05 -0.07 0.52 0.08 -0.54 0.00 0.00 175.26 175.20 2vl4 s VAL 258 N 1.02 5.16 -0.03 3.70 1.01 -0.32 -0.98 120.40 129.95 2vl4 s VAL 258 Ca -0.01 1.03 0.05 0.00 0.00 0.00 0.00 61.98 63.04 2vl4 s VAL 258 Cb -0.15 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.37 2vl4 s VAL 258 CO -0.04 0.29 -0.17 -0.13 0.00 0.00 0.00 175.10 175.06 2vl4 s ARG 259 N 0.80 1.66 -0.11 2.72 0.52 -0.61 -0.41 118.95 123.51 2vl4 s ARG 259 Ca 0.27 -0.60 0.03 0.00 -0.52 0.00 0.00 55.73 54.91 2vl4 s ARG 259 Cb -0.15 -1.48 0.01 0.00 0.52 0.00 0.00 34.95 33.84 2vl4 s ARG 259 CO 0.11 0.27 -0.21 0.08 0.02 0.00 0.00 175.30 175.57 2vl4 s VAL 260 N -0.07 1.89 -0.13 3.52 1.01 0.03 -1.02 120.40 125.63 2vl4 s VAL 260 Ca -0.01 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.07 2vl4 s VAL 260 Cb -0.10 -1.66 -0.01 0.00 0.00 0.00 0.00 36.38 34.61 2vl4 s VAL 260 CO 0.01 0.52 -0.16 0.21 0.00 0.00 0.00 175.10 175.69 2vl4 s ASN 261 N 0.58 3.75 -0.20 3.32 3.84 -0.05 -1.27 114.94 124.91 2vl4 s ASN 261 Ca -0.14 -0.41 -0.03 0.00 0.21 0.00 0.00 52.86 52.49 2vl4 s ASN 261 Cb -0.17 -1.56 -0.01 0.00 -0.55 0.00 0.00 41.25 38.96 2vl4 s ASN 261 CO 0.04 0.14 -0.06 -0.69 -2.79 0.00 0.00 177.10 173.75 2vl4 s VAL 262 N 0.47 3.37 0.15 -5.21 1.01 0.45 -1.14 120.40 119.49 2vl4 s VAL 262 Ca -0.11 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.40 2vl4 s VAL 262 Cb -0.16 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 2vl4 s VAL 262 CO 0.05 0.45 -0.08 -0.44 0.00 0.00 0.00 175.10 175.08 2vl4 s SER 263 N 1.16 1.69 -0.07 3.32 0.01 -0.06 0.77 113.70 120.53 2vl4 s SER 263 Ca 0.02 -1.04 -0.01 0.00 1.31 0.00 0.00 55.95 56.23 2vl4 s SER 263 Cb -0.14 0.01 0.03 0.00 0.21 0.00 0.00 66.02 66.12 2vl4 s SER 263 CO -0.01 -0.38 -0.00 -0.22 0.41 0.00 0.00 173.24 173.04 2vl4 s LEU 264 N -3.17 0.66 -1.35 2.44 2.96 -0.34 -0.39 118.68 119.49 2vl4 s LEU 264 Ca 0.18 -0.08 -0.06 0.00 -0.22 0.00 0.00 54.13 53.94 2vl4 s LEU 264 Cb 0.03 -0.43 0.04 0.00 0.50 0.00 0.00 46.19 46.33 2vl4 s LEU 264 CO 0.01 -0.18 0.45 0.59 -1.32 0.00 0.00 176.35 175.90 2vl4 n ASN 265 N 5.03 -4.52 0.00 3.68 3.02 -1.26 -1.48 115.26 119.73 2vl4 n ASN 265 Ca -0.09 -0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.19 2vl4 n ASN 265 Cb 0.50 -3.71 0.00 0.00 -0.61 0.00 0.00 39.78 35.96 2vl4 n ASN 265 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vl4 n GLY 266 N -1.23 0.77 3.34 7.41 0.00 -1.26 -5.04 105.19 109.18 2vl4 n GLY 266 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 2vl4 n GLY 266 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vl4 s THR 267 N -2.93 3.16 0.23 2.61 2.01 -0.55 -5.09 115.64 115.08 2vl4 s THR 267 Ca 0.00 -0.60 -0.32 0.00 0.31 0.00 0.00 61.69 61.08 2vl4 s THR 267 Cb 0.00 -2.37 -0.12 0.00 0.01 0.00 0.00 72.50 70.02 2vl4 s THR 267 CO 0.00 0.49 1.66 0.41 -0.69 0.00 0.00 174.62 176.49 2vl4 n THR 268 N 4.02 0.31 -0.11 -0.82 -1.04 -1.26 -1.20 114.28 114.18 2vl4 n THR 268 Ca -0.18 -0.08 -0.17 0.00 -2.04 0.00 0.00 64.05 61.58 2vl4 n THR 268 Cb 0.52 -1.91 -0.09 0.00 -1.82 0.00 0.00 70.33 67.03 2vl4 n THR 268 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2vl4 n VAL 269 N 3.34 1.19 -3.63 12.58 0.31 0.23 -4.90 118.33 127.45 2vl4 n VAL 269 Ca 0.14 -0.42 -0.14 0.00 -0.01 0.00 0.00 64.34 63.91 2vl4 n VAL 269 Cb 0.35 -1.37 -0.06 0.00 -0.91 0.00 0.00 33.84 31.85 2vl4 n VAL 269 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2vl4 s THR 270 N -2.41 0.04 -0.04 2.52 -1.32 -1.00 -5.02 115.64 108.41 2vl4 s THR 270 Ca -0.29 -0.35 -0.03 0.00 -1.21 0.00 0.00 61.69 59.82 2vl4 s THR 270 Cb 0.08 -0.92 0.02 0.00 -1.51 0.00 0.00 72.50 70.17 2vl4 s THR 270 CO 0.46 -0.19 0.10 -0.70 -2.21 0.00 0.00 174.62 172.08 2vl4 s GLU 271 N -2.21 0.09 0.09 7.08 2.12 -1.26 -0.41 118.70 124.20 2vl4 s GLU 271 Ca -0.07 0.21 0.03 0.00 0.36 0.00 0.00 54.97 55.50 2vl4 s GLU 271 Cb -0.01 -0.05 -0.04 0.00 0.26 0.00 0.00 34.13 34.29 2vl4 s GLU 271 CO -0.00 -0.08 -0.09 0.14 -0.54 0.00 0.00 175.26 174.70 2vl4 s VAL 272 N 0.51 0.81 0.15 3.70 -7.23 -0.40 -5.00 120.40 112.94 2vl4 s VAL 272 Ca -0.04 -1.70 -0.08 0.00 -1.81 0.00 0.00 61.98 58.35 2vl4 s VAL 272 Cb -0.05 -1.40 -0.01 0.00 0.56 0.00 0.00 36.38 35.48 2vl4 s VAL 272 CO -0.02 -0.66 0.25 -1.59 -0.31 0.00 0.00 175.10 172.77 2vl4 s LYS 273 N -3.06 1.09 -0.17 4.82 -2.85 -1.26 -0.79 119.74 117.53 2vl4 s LYS 273 Ca 0.06 -1.16 -0.09 0.00 -1.00 0.00 0.00 55.97 53.79 2vl4 s LYS 273 Cb -0.01 0.36 0.06 0.00 -2.06 0.00 0.00 37.83 36.19 2vl4 s LYS 273 CO -0.02 -0.39 0.41 -1.14 0.10 0.00 0.00 175.35 174.32 2vl4 s GLN 274 N -3.96 0.38 0.12 1.78 0.74 0.45 -4.99 119.66 114.19 2vl4 s GLN 274 Ca 0.16 0.82 -0.29 0.00 0.05 0.00 0.00 55.36 56.09 2vl4 s GLN 274 Cb 0.04 0.01 -0.06 0.00 1.10 0.00 0.00 33.01 34.10 2vl4 s GLN 274 CO -0.02 -0.17 0.94 -0.65 -0.55 0.00 0.00 175.29 174.84 2vl4 s GLN 275 N 1.55 4.70 0.13 1.67 -1.52 -1.26 -1.18 119.66 123.75 2vl4 s GLN 275 Ca -0.09 1.42 -0.04 0.00 -1.95 0.00 0.00 55.36 54.70 2vl4 s GLN 275 Cb -0.09 -3.36 -0.03 0.00 -0.22 0.00 0.00 33.01 29.31 2vl4 s GLN 275 CO -0.13 0.27 0.12 0.14 -0.25 0.00 0.00 175.29 175.45 2vl4 s VAL 276 N -0.20 0.10 -0.27 1.09 -7.23 -0.20 -4.97 120.40 108.72 2vl4 s VAL 276 Ca 0.45 -1.73 0.01 0.00 -1.81 0.00 0.00 61.98 58.90 2vl4 s VAL 276 Cb -0.23 -1.93 0.05 0.00 0.56 0.00 0.00 36.38 34.83 2vl4 s VAL 276 CO 0.29 -0.46 -0.07 -0.89 -0.31 0.00 0.00 175.10 173.67 2vl4 s THR 277 N -4.01 2.55 0.03 5.32 2.01 -1.26 -0.90 115.64 119.38 2vl4 s THR 277 Ca 0.20 -1.44 -0.30 0.00 0.31 0.00 0.00 61.69 60.46 2vl4 s THR 277 Cb 0.06 -2.45 -0.06 0.00 0.01 0.00 0.00 72.50 70.06 2vl4 s THR 277 CO 0.00 -0.01 1.39 -0.76 -0.69 0.00 0.00 174.62 174.56 2vl4 s LEU 278 N 1.19 4.33 0.29 4.42 1.43 0.21 -4.76 118.68 125.80 2vl4 s LEU 278 Ca -0.06 2.16 -0.11 0.00 -1.03 0.00 0.00 54.13 55.09 2vl4 s LEU 278 Cb -0.19 -3.57 -0.07 0.00 0.03 0.00 0.00 46.19 42.39 2vl4 s LEU 278 CO -0.04 -0.69 0.65 -1.10 0.23 0.00 0.00 176.35 175.40 2vl4 s GLN 279 N 2.03 3.85 0.26 1.70 -1.52 -1.26 -0.88 119.66 123.84 2vl4 s GLN 279 Ca 0.64 0.41 -0.29 0.00 -1.95 0.00 0.00 55.36 54.18 2vl4 s GLN 279 Cb -0.33 -2.53 -0.15 0.00 -0.22 0.00 0.00 33.01 29.79 2vl4 s GLN 279 CO 0.28 0.20 0.98 -2.30 -0.25 0.00 0.00 175.29 174.19 2vl4 n PRO 280 N -0.48 1.18 0.00 2.91 -0.02 -1.26 -4.50 135.00 132.83 2vl4 n PRO 280 Ca 0.02 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2vl4 n PRO 280 Cb 0.53 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 2vl4 n PRO 280 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vl4 n GLY 281 N 1.43 -0.38 3.73 -1.23 0.00 -0.36 -4.91 105.19 103.48 2vl4 n GLY 281 Ca 0.11 -1.28 -0.41 0.00 0.00 0.00 0.00 46.02 44.44 2vl4 n GLY 281 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vl4 s ILE 282 N 0.00 3.94 -0.03 -0.61 -1.09 -1.26 -0.39 121.20 121.76 2vl4 s ILE 282 Ca 0.00 1.59 0.05 0.00 -2.23 0.00 0.00 60.65 60.06 2vl4 s ILE 282 Cb 0.00 -4.02 -0.01 0.00 -1.58 0.00 0.00 42.46 36.86 2vl4 s ILE 282 CO 0.00 0.23 -0.17 0.20 -1.23 0.00 0.00 174.94 173.97 2vl4 s ASN 283 N 0.22 2.10 -0.22 3.58 0.01 0.53 -4.93 114.94 116.23 2vl4 s ASN 283 Ca 0.52 -0.34 -0.05 0.00 -0.71 0.00 0.00 52.86 52.28 2vl4 s ASN 283 Cb -0.29 -0.47 -0.02 0.00 0.41 0.00 0.00 41.25 40.88 2vl4 s ASN 283 CO 0.33 0.17 -0.00 -1.00 -1.51 0.00 0.00 177.10 175.09 2vl4 s HIS 284 N -0.10 3.01 -0.06 2.20 3.76 -1.26 -0.97 115.29 121.88 2vl4 s HIS 284 Ca -0.00 -0.66 0.05 0.00 -0.15 0.00 0.00 55.06 54.29 2vl4 s HIS 284 Cb -0.10 -2.13 -0.00 0.00 1.11 0.00 0.00 32.58 31.46 2vl4 s HIS 284 CO 0.01 -0.40 -0.21 0.42 -0.85 0.00 0.00 174.74 173.71 2vl4 s ILE 285 N 1.36 1.75 -0.14 0.60 1.09 -0.25 -5.00 121.20 120.60 2vl4 s ILE 285 Ca 0.04 -0.88 -0.00 0.00 -1.10 0.00 0.00 60.65 58.71 2vl4 s ILE 285 Cb -0.15 -1.50 0.03 0.00 -1.06 0.00 0.00 42.46 39.79 2vl4 s ILE 285 CO 0.00 0.49 -0.08 -0.89 -0.10 0.00 0.00 174.94 174.37 2vl4 s THR 286 N 0.04 1.16 -0.17 2.92 2.01 -1.26 -0.30 115.64 120.04 2vl4 s THR 286 Ca -0.06 -0.49 0.01 0.00 0.31 0.00 0.00 61.69 61.45 2vl4 s THR 286 Cb -0.14 -1.22 0.03 0.00 0.01 0.00 0.00 72.50 71.18 2vl4 s THR 286 CO 0.04 0.29 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.34 2vl4 s LEU 287 N 1.64 2.00 0.50 4.42 1.02 0.08 -4.96 118.68 123.39 2vl4 s LEU 287 Ca 0.03 -0.63 -0.20 0.00 0.02 0.00 0.00 54.13 53.35 2vl4 s LEU 287 Cb -0.14 -1.32 -0.08 0.00 0.02 0.00 0.00 46.19 44.68 2vl4 s LEU 287 CO -0.08 -0.05 1.07 -2.16 0.02 0.00 0.00 176.35 175.15 2vl4 s PRO 288 N 1.38 3.65 0.00 1.29 0.05 -1.26 -0.58 135.00 139.54 2vl4 s PRO 288 Ca 0.04 1.46 -0.12 0.00 0.05 0.00 0.00 61.00 62.43 2vl4 s PRO 288 Cb -0.14 -2.08 0.01 0.00 0.05 0.00 0.00 34.50 32.35 2vl4 s PRO 288 CO -0.11 -0.57 0.24 0.00 0.05 0.00 0.00 177.00 176.61 2vl4 s ALA 289 N -1.89 -0.58 0.11 8.56 0.00 -0.27 -4.91 121.76 122.78 2vl4 s ALA 289 Ca 0.69 0.07 0.07 0.00 0.00 0.00 0.00 51.96 52.79 2vl4 s ALA 289 Cb -0.19 0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 2vl4 s ALA 289 CO 0.23 -0.27 -0.16 -1.21 0.00 0.00 0.00 175.76 174.34 2vl4 s GLU 290 N -1.64 1.03 -0.24 0.00 2.02 -1.26 -0.73 118.70 117.88 2vl4 s GLU 290 Ca -0.12 -1.18 0.00 0.00 0.02 0.00 0.00 54.97 53.70 2vl4 s GLU 290 Cb -0.05 -1.06 0.06 0.00 0.10 0.00 0.00 34.13 33.19 2vl4 s GLU 290 CO 0.02 0.22 -0.02 0.08 0.02 0.00 0.00 175.26 175.58 2vl4 s VAL 291 N -1.69 1.31 0.46 2.63 1.01 -0.28 -4.84 120.40 119.00 2vl4 s VAL 291 Ca 0.07 -1.14 -0.21 0.00 0.00 0.00 0.00 61.98 60.70 2vl4 s VAL 291 Cb -0.07 -1.66 -0.09 0.00 0.00 0.00 0.00 36.38 34.55 2vl4 s VAL 291 CO 0.04 -0.18 1.01 0.42 0.00 0.00 0.00 175.10 176.39 2vl4 s THR 292 N 1.49 3.97 -1.24 3.92 -4.23 -1.26 -0.82 115.64 117.47 2vl4 s THR 292 Ca -0.03 1.25 -0.31 0.00 -1.18 0.00 0.00 61.69 61.41 2vl4 s THR 292 Cb -0.18 -3.51 0.04 0.00 1.34 0.00 0.00 72.50 70.18 2vl4 s THR 292 CO -0.08 -0.25 0.63 0.59 -0.54 0.00 0.00 174.62 174.97 2vl4 n ASN 293 N -0.81 -3.71 -4.76 3.99 4.13 -0.08 -4.83 115.26 109.19 2vl4 n ASN 293 Ca 0.08 -1.29 -0.39 0.00 1.68 0.00 0.00 54.58 54.67 2vl4 n ASN 293 Cb 0.53 -1.76 0.01 0.00 -1.54 0.00 0.00 39.78 37.02 2vl4 n ASN 293 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 2vl4 s PRO 294 N -7.37 3.66 -0.41 3.52 0.04 -1.25 -4.97 135.00 128.22 2vl4 s PRO 294 Ca 0.45 2.15 -0.21 0.00 0.04 0.00 0.00 61.00 63.43 2vl4 s PRO 294 Cb -0.24 -2.54 0.02 0.00 0.04 0.00 0.00 34.50 31.77 2vl4 s PRO 294 CO 0.97 -0.74 0.67 0.08 0.04 0.00 0.00 177.00 178.02 2vl4 s VAL 295 N -1.31 4.81 0.37 -0.36 1.01 -1.26 -4.99 120.40 118.67 2vl4 s VAL 295 Ca 0.63 0.34 -0.26 0.00 0.00 0.00 0.00 61.98 62.69 2vl4 s VAL 295 Cb -0.38 -4.19 -0.09 0.00 0.00 0.00 0.00 36.38 31.72 2vl4 s VAL 295 CO 0.47 -0.53 1.10 -0.13 0.00 0.00 0.00 175.10 176.01 2vl4 s ARG 296 N 2.88 4.25 -0.07 2.72 0.52 -1.26 -4.58 118.95 123.40 2vl4 s ARG 296 Ca 0.25 1.68 -0.30 0.00 -0.52 0.00 0.00 55.73 56.84 2vl4 s ARG 296 Cb -0.14 -2.74 -0.04 0.00 0.52 0.00 0.00 34.95 32.55 2vl4 s ARG 296 CO 0.18 -0.11 1.37 -0.46 0.02 0.00 0.00 175.30 176.30 2vl4 s TRP 297 N -1.46 2.75 0.11 -0.53 -0.00 -0.31 -4.27 118.94 115.22 2vl4 s TRP 297 Ca 0.54 0.83 0.09 0.00 -0.00 0.00 0.00 56.10 57.56 2vl4 s TRP 297 Cb -0.27 -3.62 -0.04 0.00 -0.00 0.00 0.00 33.47 29.54 2vl4 s TRP 297 CO 0.34 -2.28 -0.18 -1.64 -0.00 0.00 0.00 176.95 173.19 2vl4 s MET 298 N 3.02 1.82 0.70 5.86 -1.94 -0.28 -4.73 119.30 123.75 2vl4 s MET 298 Ca 0.61 -1.16 -0.11 0.00 -1.71 0.00 0.00 55.69 53.33 2vl4 s MET 298 Cb -0.27 -2.12 0.01 0.00 2.01 0.00 0.00 34.83 34.45 2vl4 s MET 298 CO 0.22 0.49 1.06 -1.25 -0.01 0.00 0.00 175.02 175.53 2vl4 s PRO 299 N -2.09 2.92 -0.13 2.03 0.04 -1.26 -3.63 135.00 132.88 2vl4 s PRO 299 Ca 0.18 0.96 -0.38 0.00 0.04 0.00 0.00 61.00 61.80 2vl4 s PRO 299 Cb -0.11 -1.99 -0.15 0.00 0.04 0.00 0.00 34.50 32.30 2vl4 s PRO 299 CO 0.10 -1.12 1.68 -1.71 0.04 0.00 0.00 177.00 176.00 2vl4 n ASN 300 N -3.14 2.55 0.00 6.66 5.15 0.11 -0.71 115.26 125.88 2vl4 n ASN 300 Ca 0.08 1.06 0.00 0.00 -0.60 0.00 0.00 54.58 55.12 2vl4 n ASN 300 Cb 0.54 -1.23 0.00 0.00 -0.53 0.00 0.00 39.78 38.56 2vl4 n ASN 300 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2vl4 n GLY 301 N 3.86 2.33 0.51 8.20 0.00 -1.26 -4.69 105.19 114.13 2vl4 n GLY 301 Ca 0.23 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.31 2vl4 n GLY 301 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2vl4 n TRP 302 N -0.40 0.17 -0.69 1.61 7.02 0.12 -4.88 117.44 120.40 2vl4 n TRP 302 Ca 0.00 -0.19 0.00 0.00 -1.02 0.00 0.00 57.50 56.29 2vl4 n TRP 302 Cb 0.00 -0.01 0.00 0.00 -2.42 0.00 0.00 31.31 28.88 2vl4 n TRP 302 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2vl4 n GLY 303 N 0.57 0.37 3.80 6.99 0.00 -1.23 -4.87 105.19 110.82 2vl4 n GLY 303 Ca 0.08 -1.44 -0.39 0.00 0.00 0.00 0.00 46.02 44.27 2vl4 n GLY 303 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vl4 s THR 304 N -3.52 4.84 -1.33 2.61 2.01 -1.26 -4.73 115.64 114.26 2vl4 s THR 304 Ca 0.00 1.15 -0.09 0.00 0.31 0.00 0.00 61.69 63.06 2vl4 s THR 304 Cb 0.00 -3.87 0.13 0.00 0.01 0.00 0.00 72.50 68.77 2vl4 s THR 304 CO 0.00 0.52 2.09 -0.81 -0.69 0.00 0.00 174.62 175.73 2vl4 n PRO 305 N 2.06 3.77 -1.82 4.92 -0.04 -1.24 -1.12 135.00 141.53 2vl4 n PRO 305 Ca -0.10 -3.34 -0.42 0.00 -0.04 0.00 0.00 63.50 59.60 2vl4 n PRO 305 Cb 0.51 -2.89 -0.03 0.00 -0.04 0.00 0.00 33.50 31.05 2vl4 n PRO 305 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2vl4 s THR 306 N 0.42 2.38 -0.12 0.52 2.01 -1.26 -4.76 115.64 114.83 2vl4 s THR 306 Ca 0.45 0.21 0.01 0.00 0.31 0.00 0.00 61.69 62.68 2vl4 s THR 306 Cb 0.13 -3.14 0.02 0.00 0.01 0.00 0.00 72.50 69.52 2vl4 s THR 306 CO -0.03 0.01 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.00 2vl4 s LEU 307 N 1.48 1.72 0.52 4.42 1.43 -1.26 -4.19 118.68 122.80 2vl4 s LEU 307 Ca 0.74 -0.45 -0.16 0.00 -1.03 0.00 0.00 54.13 53.23 2vl4 s LEU 307 Cb -0.46 -1.12 -0.08 0.00 0.03 0.00 0.00 46.19 44.55 2vl4 s LEU 307 CO 0.32 -0.00 0.99 -0.31 0.23 0.00 0.00 176.35 177.58 2vl4 s TYR 308 N 1.11 3.45 -0.31 0.29 2.02 0.13 -4.78 117.35 119.26 2vl4 s TYR 308 Ca -0.04 1.46 -0.10 0.00 -0.37 0.00 0.00 57.07 58.02 2vl4 s TYR 308 Cb -0.14 -2.79 -0.02 0.00 -0.40 0.00 0.00 41.96 38.60 2vl4 s TYR 308 CO -0.04 -0.39 0.17 -0.51 -1.57 0.00 0.00 175.55 173.21 2vl4 s ASP 309 N -3.09 5.70 -0.26 2.29 1.01 0.47 -0.31 116.67 122.48 2vl4 s ASP 309 Ca 0.59 -0.40 -0.08 0.00 0.71 0.00 0.00 52.55 53.37 2vl4 s ASP 309 Cb -0.10 -2.05 -0.02 0.00 1.01 0.00 0.00 42.92 41.76 2vl4 s ASP 309 CO 0.32 -0.17 0.08 -0.36 0.21 0.00 0.00 175.17 175.25 2vl4 s PHE 310 N 1.66 3.10 -0.16 4.23 0.40 -0.30 -0.88 117.98 126.04 2vl4 s PHE 310 Ca 0.05 -0.46 0.01 0.00 -0.60 0.00 0.00 56.93 55.93 2vl4 s PHE 310 Cb -0.17 -2.26 0.00 0.00 0.51 0.00 0.00 43.02 41.11 2vl4 s PHE 310 CO 0.08 -0.38 -0.17 0.45 0.70 0.00 0.00 175.22 175.89 2vl4 s SER 311 N 1.61 3.46 -0.14 1.36 0.15 -0.29 -0.94 113.70 118.92 2vl4 s SER 311 Ca 0.06 -0.53 -0.04 0.00 0.70 0.00 0.00 55.95 56.14 2vl4 s SER 311 Cb -0.15 -1.53 -0.03 0.00 -1.71 0.00 0.00 66.02 62.60 2vl4 s SER 311 CO 0.04 0.07 -0.01 0.00 1.20 0.00 0.00 173.24 174.54 2vl4 s ALA 312 N 0.91 3.15 0.01 5.45 0.00 0.57 -0.87 121.76 130.97 2vl4 s ALA 312 Ca -0.04 -0.80 0.05 0.00 0.00 0.00 0.00 51.96 51.17 2vl4 s ALA 312 Cb -0.15 -1.60 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 2vl4 s ALA 312 CO -0.02 0.31 -0.17 -0.65 0.00 0.00 0.00 175.76 175.23 2vl4 s GLN 313 N 0.03 1.28 -0.29 0.00 -0.21 -0.19 -0.87 119.66 119.42 2vl4 s GLN 313 Ca 0.02 -0.67 -0.10 0.00 0.02 0.00 0.00 55.36 54.63 2vl4 s GLN 313 Cb -0.13 -1.27 -0.02 0.00 1.00 0.00 0.00 33.01 32.58 2vl4 s GLN 313 CO 0.02 0.34 0.14 0.42 -2.12 0.00 0.00 175.29 174.09 2vl4 s ILE 314 N -0.53 4.74 -0.19 1.08 -1.09 0.26 -1.57 121.20 123.90 2vl4 s ILE 314 Ca 0.06 -0.19 -0.03 0.00 -2.23 0.00 0.00 60.65 58.26 2vl4 s ILE 314 Cb -0.07 -3.32 -0.01 0.00 -1.58 0.00 0.00 42.46 37.48 2vl4 s ILE 314 CO 0.00 0.19 -0.06 0.00 -1.23 0.00 0.00 174.94 173.83 2vl4 s ALA 315 N 1.66 2.79 -0.46 9.38 0.00 -0.15 -1.29 121.76 133.69 2vl4 s ALA 315 Ca 0.06 -1.06 -0.02 0.00 0.00 0.00 0.00 51.96 50.95 2vl4 s ALA 315 Cb -0.16 -1.56 0.12 0.00 0.00 0.00 0.00 23.12 21.52 2vl4 s ALA 315 CO 0.07 -0.18 0.24 0.00 0.00 0.00 0.00 175.76 175.89 2vl4 n GLY 317 N 4.22 2.77 0.23 0.00 0.00 -1.26 -2.86 105.19 108.29 2vl4 n GLY 317 Ca 0.01 -0.25 -0.16 0.00 0.00 0.00 0.00 46.02 45.62 2vl4 n GLY 317 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2vl4 h ASP 318 N 0.00 0.94 -3.47 1.61 2.03 -2.02 -3.47 116.42 112.05 2vl4 h ASP 318 Ca 0.00 -0.59 -0.54 0.00 -0.73 0.00 0.00 57.03 55.18 2vl4 h ASP 318 Cb 0.00 -0.28 -0.03 0.00 -0.83 0.00 0.00 39.33 38.19 2vl4 h ASP 318 CO 0.00 1.39 0.15 0.00 -1.03 0.00 0.00 179.24 179.75 2vl4 s ARG 319 N -3.85 4.51 -0.55 4.15 1.70 -1.13 -5.01 118.95 118.76 2vl4 s ARG 319 Ca -0.10 1.09 -0.22 0.00 -0.47 0.00 0.00 55.73 56.02 2vl4 s ARG 319 Cb 0.09 -3.29 0.05 0.00 -0.57 0.00 0.00 34.95 31.23 2vl4 s ARG 319 CO 0.90 0.49 0.85 0.42 -1.08 0.00 0.00 175.30 176.88 2vl4 s ILE 320 N -0.82 4.53 -0.20 4.99 -1.09 -1.26 -1.20 121.20 126.15 2vl4 s ILE 320 Ca 0.36 -0.06 0.17 0.00 -2.23 0.00 0.00 60.65 58.89 2vl4 s ILE 320 Cb -0.22 -4.49 0.06 0.00 -1.58 0.00 0.00 42.46 36.23 2vl4 s ILE 320 CO 0.25 -1.07 1.30 -0.37 -1.23 0.00 0.00 174.94 173.82 2vl4 h VAL 321 N 5.97 0.57 -2.75 2.92 -1.51 -1.52 0.20 116.25 120.12 2vl4 h VAL 321 Ca -0.27 -1.86 -0.12 0.00 -1.23 0.00 0.00 66.70 63.22 2vl4 h VAL 321 Cb 1.08 2.19 -0.24 0.00 -2.13 0.00 0.00 31.29 32.18 2vl4 h VAL 321 CO 1.06 0.32 -0.25 0.00 -1.23 0.00 0.00 177.57 177.48 2vl4 s ALA 322 N -3.03 -1.00 -0.01 5.19 0.00 -1.22 -4.24 121.76 117.44 2vl4 s ALA 322 Ca 0.03 1.17 -0.05 0.00 0.00 0.00 0.00 51.96 53.10 2vl4 s ALA 322 Cb 0.08 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.52 2vl4 s ALA 322 CO 0.75 -0.20 0.10 -2.00 0.00 0.00 0.00 175.76 174.42 2vl4 s GLU 323 N 0.30 0.33 -0.09 0.00 -6.30 -1.26 -0.57 118.70 111.11 2vl4 s GLU 323 Ca -0.01 -0.24 -0.07 0.00 -2.50 0.00 0.00 54.97 52.16 2vl4 s GLU 323 Cb -0.03 0.14 0.03 0.00 0.00 0.00 0.00 34.13 34.26 2vl4 s GLU 323 CO -0.00 -0.07 0.22 -1.14 0.02 0.00 0.00 175.26 174.29 2vl4 s GLN 324 N -0.88 0.24 0.12 4.30 2.00 -0.05 -4.91 119.66 120.48 2vl4 s GLN 324 Ca -0.10 0.35 0.09 0.00 -2.00 0.00 0.00 55.36 53.71 2vl4 s GLN 324 Cb -0.06 0.06 -0.04 0.00 0.80 0.00 0.00 33.01 33.78 2vl4 s GLN 324 CO 0.01 -0.06 -0.22 -1.12 -0.50 0.00 0.00 175.29 173.39 2vl4 s SER 325 N 0.40 2.80 0.04 6.67 0.01 -1.26 -0.32 113.70 122.05 2vl4 s SER 325 Ca -0.02 -0.73 0.04 0.00 1.31 0.00 0.00 55.95 56.54 2vl4 s SER 325 Cb -0.04 -0.17 -0.02 0.00 0.21 0.00 0.00 66.02 66.00 2vl4 s SER 325 CO -0.02 0.08 -0.11 -1.00 0.41 0.00 0.00 173.24 172.61 2vl4 s HIS 326 N -1.26 0.92 -0.00 2.43 3.76 -0.11 -5.01 115.29 116.02 2vl4 s HIS 326 Ca 0.10 -0.41 -0.25 0.00 -0.15 0.00 0.00 55.06 54.35 2vl4 s HIS 326 Cb -0.09 -0.54 -0.04 0.00 1.11 0.00 0.00 32.58 33.01 2vl4 s HIS 326 CO 0.05 -0.01 0.78 1.03 -0.85 0.00 0.00 174.74 175.74 2vl4 s ARG 327 N -1.36 4.49 -0.08 1.40 0.52 -1.26 -1.15 118.95 121.50 2vl4 s ARG 327 Ca -0.04 1.06 0.02 0.00 -0.52 0.00 0.00 55.73 56.25 2vl4 s ARG 327 Cb -0.09 -3.41 0.01 0.00 0.52 0.00 0.00 34.95 31.99 2vl4 s ARG 327 CO 0.01 0.15 -0.14 0.42 0.02 0.00 0.00 175.30 175.76 2vl4 s ILE 328 N 0.43 1.34 -0.15 1.52 -1.09 0.58 -4.68 121.20 119.14 2vl4 s ILE 328 Ca 0.40 -0.58 -0.06 0.00 -2.23 0.00 0.00 60.65 58.18 2vl4 s ILE 328 Cb -0.20 -1.22 -0.04 0.00 -1.58 0.00 0.00 42.46 39.43 2vl4 s ILE 328 CO 0.22 0.40 0.05 -0.83 -1.23 0.00 0.00 174.94 173.56 2vl4 s GLY 329 N 0.73 1.91 -0.38 6.18 0.00 -1.26 0.19 107.32 114.69 2vl4 s GLY 329 Ca -0.13 -0.75 -0.13 0.00 0.00 0.00 0.00 44.72 43.71 2vl4 s GLY 329 CO 0.03 -0.13 0.26 1.08 0.00 0.00 0.00 173.10 174.34 2vl4 s LEU 330 N -0.06 4.83 0.14 0.66 1.43 -1.26 -4.78 118.68 119.64 2vl4 s LEU 330 Ca 0.06 -0.77 -0.24 0.00 -1.03 0.00 0.00 54.13 52.14 2vl4 s LEU 330 Cb -0.12 -2.12 0.07 0.00 0.03 0.00 0.00 46.19 44.05 2vl4 s LEU 330 CO 0.01 -0.37 0.71 0.00 0.23 0.00 0.00 176.35 176.94 2vl4 s ARG 331 N 1.66 1.24 -0.07 1.70 3.03 -1.26 -1.16 118.95 124.09 2vl4 s ARG 331 Ca 0.05 -0.52 0.01 0.00 2.03 0.00 0.00 55.73 57.29 2vl4 s ARG 331 Cb -0.18 0.53 -0.03 0.00 -1.03 0.00 0.00 34.95 34.23 2vl4 s ARG 331 CO 0.09 -0.55 -0.07 0.95 -1.13 0.00 0.00 175.30 174.59 2vl4 s THR 332 N -3.59 3.69 -0.16 4.99 -4.23 -1.26 -4.97 115.64 110.11 2vl4 s THR 332 Ca 0.04 -0.48 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 2vl4 s THR 332 Cb -0.02 -2.51 0.03 0.00 1.34 0.00 0.00 72.50 71.34 2vl4 s THR 332 CO -0.08 0.60 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.85 2vl4 s ILE 333 N -0.77 1.48 -0.09 2.99 1.01 -1.26 -0.25 121.20 124.31 2vl4 s ILE 333 Ca 0.12 -0.68 0.04 0.00 0.00 0.00 0.00 60.65 60.12 2vl4 s ILE 333 Cb -0.11 -1.47 -0.01 0.00 0.01 0.00 0.00 42.46 40.89 2vl4 s ILE 333 CO 0.01 0.35 -0.22 -0.60 0.00 0.00 0.00 174.94 174.48 2vl4 s ARG 334 N 1.50 2.92 -0.24 2.79 3.52 -0.43 -4.92 118.95 124.10 2vl4 s ARG 334 Ca 0.03 -0.86 -0.16 0.00 -0.13 0.00 0.00 55.73 54.62 2vl4 s ARG 334 Cb -0.14 -2.30 -0.04 0.00 -1.56 0.00 0.00 34.95 30.91 2vl4 s ARG 334 CO -0.10 0.26 0.39 0.08 -0.81 0.00 0.00 175.30 175.13 2vl4 s VAL 335 N 0.14 5.18 -0.37 7.11 1.01 -1.26 -0.67 120.40 131.54 2vl4 s VAL 335 Ca -0.12 0.66 -0.12 0.00 0.00 0.00 0.00 61.98 62.40 2vl4 s VAL 335 Cb -0.16 -3.72 0.02 0.00 0.00 0.00 0.00 36.38 32.52 2vl4 s VAL 335 CO 0.07 0.20 0.22 -0.69 0.00 0.00 0.00 175.10 174.90 2vl4 s VAL 336 N 1.70 4.78 -0.42 2.92 1.01 0.63 -4.96 120.40 126.05 2vl4 s VAL 336 Ca 0.17 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.46 2vl4 s VAL 336 Cb -0.15 -3.62 0.15 0.00 0.00 0.00 0.00 36.38 32.75 2vl4 s VAL 336 CO 0.09 -0.20 0.27 0.21 0.00 0.00 0.00 175.10 175.47 2vl4 s ASN 337 N 1.60 3.11 -0.00 3.32 3.04 -1.26 -1.23 114.94 123.52 2vl4 s ASN 337 Ca 0.03 -2.65 0.01 0.00 0.04 0.00 0.00 52.86 50.29 2vl4 s ASN 337 Cb -0.19 -0.76 -0.00 0.00 -1.54 0.00 0.00 41.25 38.76 2vl4 s ASN 337 CO 0.08 -0.25 -0.03 -1.61 -3.04 0.00 0.00 177.10 172.25 2vl4 s GLU 338 N 0.41 0.23 0.15 0.43 2.02 -1.23 -4.91 118.70 115.80 2vl4 s GLU 338 Ca 0.21 -0.10 -0.33 0.00 0.02 0.00 0.00 54.97 54.77 2vl4 s GLU 338 Cb -0.17 -0.23 -0.16 0.00 0.10 0.00 0.00 34.13 33.67 2vl4 s GLU 338 CO -0.04 0.06 1.12 1.63 0.02 0.00 0.00 175.26 178.05 2vl4 n LYS 339 N 3.03 0.97 -4.05 1.61 5.02 -1.26 -1.38 118.16 122.09 2vl4 n LYS 339 Ca -0.13 0.35 -0.15 0.00 -2.02 0.00 0.00 58.31 56.36 2vl4 n LYS 339 Cb 0.59 -1.82 -0.03 0.00 -0.02 0.00 0.00 35.03 33.75 2vl4 n LYS 339 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 2vl4 s ASP 340 N -0.04 0.93 0.56 4.39 1.47 0.39 -4.87 116.67 119.51 2vl4 s ASP 340 Ca 0.75 -1.50 0.25 0.00 1.18 0.00 0.00 52.55 53.23 2vl4 s ASP 340 Cb -0.91 0.71 1.60 0.00 -0.34 0.00 0.00 42.92 43.98 2vl4 s ASP 340 CO 0.53 -1.39 2.19 0.07 0.68 0.00 0.00 175.17 177.25 2vl4 h LYS 341 N 2.06 0.00 0.00 2.11 2.10 -2.00 -2.03 116.57 118.80 2vl4 h LYS 341 Ca -0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 2vl4 h LYS 341 Cb 1.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.57 2vl4 h LYS 341 CO 0.39 0.00 -0.76 -0.25 -2.00 0.00 0.00 179.45 176.83 2vl4 n ASP 342 N -4.10 0.64 0.00 7.07 8.00 -1.26 -5.04 116.55 121.86 2vl4 n ASP 342 Ca -0.02 -0.35 0.00 0.00 0.71 0.00 0.00 54.79 55.13 2vl4 n ASP 342 Cb 0.13 0.54 0.00 0.00 -0.02 0.00 0.00 41.12 41.78 2vl4 n ASP 342 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2vl4 n GLY 343 N 1.45 0.73 2.77 0.44 0.00 -0.76 -4.52 105.19 105.30 2vl4 n GLY 343 Ca 0.04 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.43 2vl4 n GLY 343 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vl4 s GLU 344 N 0.00 0.64 0.86 1.61 2.02 0.15 -0.46 118.70 123.52 2vl4 s GLU 344 Ca 0.00 0.07 -0.10 0.00 0.02 0.00 0.00 54.97 54.96 2vl4 s GLU 344 Cb 0.00 -1.05 0.11 0.00 0.10 0.00 0.00 34.13 33.29 2vl4 s GLU 344 CO 0.00 -0.32 1.12 -1.54 0.02 0.00 0.00 175.26 174.54 2vl4 s SER 345 N 1.96 3.58 -0.31 -0.19 1.04 -0.48 -0.80 113.70 118.51 2vl4 s SER 345 Ca 0.05 1.97 0.04 0.00 0.48 0.00 0.00 55.95 58.48 2vl4 s SER 345 Cb -0.12 -2.52 0.17 0.00 0.10 0.00 0.00 66.02 63.65 2vl4 s SER 345 CO -0.06 -2.64 0.46 0.12 0.98 0.00 0.00 173.24 172.10 2vl4 s PHE 346 N -2.77 -1.18 0.19 5.02 5.36 -1.21 -3.50 117.98 119.89 2vl4 s PHE 346 Ca 0.64 0.34 -0.12 0.00 -0.96 0.00 0.00 56.93 56.83 2vl4 s PHE 346 Cb -0.20 -0.04 0.00 0.00 -0.34 0.00 0.00 43.02 42.44 2vl4 s PHE 346 CO 0.57 -1.03 0.39 1.52 -1.46 0.00 0.00 175.22 175.22 2vl4 s TYR 347 N 2.41 0.24 -0.17 10.12 -0.85 -0.37 -4.56 117.35 124.17 2vl4 s TYR 347 Ca 0.11 -0.59 -0.07 0.00 -0.52 0.00 0.00 57.07 56.00 2vl4 s TYR 347 Cb -0.11 0.13 -0.04 0.00 0.38 0.00 0.00 41.96 42.31 2vl4 s TYR 347 CO -0.24 -0.83 0.06 -0.06 -1.52 0.00 0.00 175.55 172.96 2vl4 s PHE 348 N -3.95 3.27 -0.26 -3.49 0.08 -1.26 -0.27 117.98 112.10 2vl4 s PHE 348 Ca 0.16 0.12 -0.06 0.00 0.12 0.00 0.00 56.93 57.27 2vl4 s PHE 348 Cb 0.01 -2.04 -0.01 0.00 -0.57 0.00 0.00 43.02 40.41 2vl4 s PHE 348 CO 0.01 0.23 0.05 -2.00 -0.10 0.00 0.00 175.22 173.41 2vl4 s GLU 349 N 0.15 3.33 -0.20 0.44 2.12 0.15 -0.34 118.70 124.36 2vl4 s GLU 349 Ca 0.05 -0.69 -0.02 0.00 0.36 0.00 0.00 54.97 54.68 2vl4 s GLU 349 Cb -0.12 -3.28 0.00 0.00 0.26 0.00 0.00 34.13 30.99 2vl4 s GLU 349 CO 0.01 -0.31 -0.11 0.08 -0.54 0.00 0.00 175.26 174.38 2vl4 s VAL 350 N 1.53 2.80 -1.54 3.70 1.01 0.55 -1.31 120.40 127.15 2vl4 s VAL 350 Ca 0.04 -0.69 -0.14 0.00 0.00 0.00 0.00 61.98 61.20 2vl4 s VAL 350 Cb -0.16 -2.24 0.09 0.00 0.00 0.00 0.00 36.38 34.07 2vl4 s VAL 350 CO 0.02 0.48 0.97 0.59 0.00 0.00 0.00 175.10 177.15 2vl4 n ASN 351 N 4.62 -4.64 0.00 3.32 3.02 0.65 -1.89 115.26 120.34 2vl4 n ASN 351 Ca -0.19 -0.79 0.00 0.00 -0.03 0.00 0.00 54.58 53.56 2vl4 n ASN 351 Cb 0.51 -3.83 0.00 0.00 -0.61 0.00 0.00 39.78 35.85 2vl4 n ASN 351 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vl4 n GLY 352 N -1.68 0.78 3.15 7.41 0.00 -1.26 -4.99 105.19 108.60 2vl4 n GLY 352 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 2vl4 n GLY 352 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vl4 s ILE 353 N -3.04 1.87 0.07 -0.61 1.01 -0.79 -5.07 121.20 114.64 2vl4 s ILE 353 Ca 0.00 -0.88 -0.34 0.00 0.00 0.00 0.00 60.65 59.43 2vl4 s ILE 353 Cb 0.00 -1.66 -0.13 0.00 0.01 0.00 0.00 42.46 40.69 2vl4 s ILE 353 CO 0.00 0.52 1.71 -2.65 0.00 0.00 0.00 174.94 174.51 2vl4 n PRO 354 N 3.92 2.22 -4.05 2.79 -0.02 -1.26 -0.33 135.00 138.26 2vl4 n PRO 354 Ca -0.20 0.81 -0.32 0.00 -2.02 0.00 0.00 63.50 61.77 2vl4 n PRO 354 Cb 0.52 -2.61 -0.15 0.00 -0.02 0.00 0.00 33.50 31.23 2vl4 n PRO 354 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2vl4 s MET 355 N 2.19 2.20 -0.01 -0.52 1.75 0.53 -4.90 119.30 120.54 2vl4 s MET 355 Ca 0.84 -1.24 -0.30 0.00 -1.25 0.00 0.00 55.69 53.74 2vl4 s MET 355 Cb -0.67 -2.80 -0.08 0.00 2.84 0.00 0.00 34.83 34.12 2vl4 s MET 355 CO 0.43 -0.54 1.96 0.12 -0.65 0.00 0.00 175.02 176.34 2vl4 s PHE 356 N 1.17 1.34 0.15 4.11 5.36 -1.26 -4.30 117.98 124.56 2vl4 s PHE 356 Ca -0.07 -0.26 -0.30 0.00 -0.96 0.00 0.00 56.93 55.33 2vl4 s PHE 356 Cb -0.19 -4.17 -0.07 0.00 -0.34 0.00 0.00 43.02 38.24 2vl4 s PHE 356 CO -0.06 -5.19 1.02 0.00 -1.46 0.00 0.00 175.22 169.53 2vl4 s ALA 357 N 4.91 3.31 -0.12 11.12 0.00 -0.87 -4.95 121.76 135.15 2vl4 s ALA 357 Ca 0.88 0.69 -0.03 0.00 0.00 0.00 0.00 51.96 53.50 2vl4 s ALA 357 Cb -0.40 -3.30 0.04 0.00 0.00 0.00 0.00 23.12 19.46 2vl4 s ALA 357 CO 0.39 -0.08 0.04 0.15 0.00 0.00 0.00 175.76 176.26 2vl4 s LYS 358 N -0.27 0.40 0.00 0.00 1.02 -1.26 -1.34 119.74 118.29 2vl4 s LYS 358 Ca 0.47 -0.02 0.00 0.00 0.02 0.00 0.00 55.97 56.44 2vl4 s LYS 358 Cb -0.26 -1.36 0.00 0.00 -0.52 0.00 0.00 37.83 35.69 2vl4 s LYS 358 CO 0.32 -0.47 0.00 0.41 -0.92 0.00 0.00 175.35 174.69 2vl4 n GLY 359 N 5.17 0.99 3.52 -3.33 0.00 -0.67 -0.61 105.19 110.27 2vl4 n GLY 359 Ca -0.07 -0.20 -0.10 0.00 0.00 0.00 0.00 46.02 45.65 2vl4 n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vl4 s ALA 360 N -1.00 -1.12 -0.06 4.61 0.00 -1.19 -2.09 121.76 120.90 2vl4 s ALA 360 Ca 0.00 -0.05 -0.27 0.00 0.00 0.00 0.00 51.96 51.64 2vl4 s ALA 360 Cb 0.00 0.85 -0.03 0.00 0.00 0.00 0.00 23.12 23.94 2vl4 s ALA 360 CO 0.00 -0.81 0.86 -0.80 0.00 0.00 0.00 175.76 175.01 2vl4 s ASN 361 N -2.84 7.16 -0.17 0.00 0.01 -0.02 -1.55 114.94 117.52 2vl4 s ASN 361 Ca 0.07 1.40 -0.08 0.00 -0.71 0.00 0.00 52.86 53.55 2vl4 s ASN 361 Cb -0.01 -2.50 -0.04 0.00 0.41 0.00 0.00 41.25 39.11 2vl4 s ASN 361 CO -0.05 -0.26 0.09 -0.47 -1.51 0.00 0.00 177.10 174.90 2vl4 s TYR 362 N 1.25 3.34 0.42 2.20 5.04 0.14 -0.87 117.35 128.87 2vl4 s TYR 362 Ca 0.44 0.21 0.07 0.00 -2.44 0.00 0.00 57.07 55.36 2vl4 s TYR 362 Cb -0.19 -2.05 -0.06 0.00 0.35 0.00 0.00 41.96 40.01 2vl4 s TYR 362 CO 0.21 0.30 0.12 0.96 -1.34 0.00 0.00 175.55 175.80 2vl4 s ILE 363 N 0.05 2.13 0.33 3.14 -4.36 -1.26 -2.65 121.20 118.57 2vl4 s ILE 363 Ca 0.07 -1.80 -0.28 0.00 -0.26 0.00 0.00 60.65 58.37 2vl4 s ILE 363 Cb -0.12 -2.93 -0.12 0.00 1.25 0.00 0.00 42.46 40.54 2vl4 s ILE 363 CO 0.00 0.00 1.30 -2.65 0.24 0.00 0.00 174.94 173.83 2vl4 n PRO 364 N -1.17 2.09 0.03 0.37 -0.02 -1.26 -4.88 135.00 130.17 2vl4 n PRO 364 Ca -0.03 0.74 0.11 0.00 -2.02 0.00 0.00 63.50 62.29 2vl4 n PRO 364 Cb 0.65 -2.32 0.46 0.00 -0.02 0.00 0.00 33.50 32.28 2vl4 n PRO 364 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2vl4 n GLN 365 N 0.76 0.06 -3.58 -0.52 6.02 -1.26 -3.70 117.38 115.16 2vl4 n GLN 365 Ca 0.06 0.18 -0.15 0.00 -0.01 0.00 0.00 57.00 57.08 2vl4 n GLN 365 Cb 0.35 -1.59 -0.06 0.00 1.02 0.00 0.00 30.24 29.96 2vl4 n GLN 365 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2vl4 s ASP 366 N -3.38 -0.46 0.49 1.08 -1.08 -1.26 -4.37 116.67 107.69 2vl4 s ASP 366 Ca 0.10 0.27 0.18 0.00 -0.52 0.00 0.00 52.55 52.57 2vl4 s ASP 366 Cb 0.13 0.49 1.22 0.00 -1.46 0.00 0.00 42.92 43.30 2vl4 s ASP 366 CO 0.43 -0.68 2.08 0.00 0.52 0.00 0.00 175.17 177.52 2vl4 h ALA 367 N 2.90 1.74 -3.65 3.66 0.00 -1.74 -3.36 119.26 118.81 2vl4 h ALA 367 Ca -0.30 -0.09 -0.67 0.00 0.00 0.00 0.00 54.91 53.85 2vl4 h ALA 367 Cb 1.20 -0.02 -0.39 0.00 0.00 0.00 0.00 17.79 18.58 2vl4 h ALA 367 CO 0.41 0.12 -0.71 -0.51 0.00 0.00 0.00 179.25 178.56 2vl4 s LEU 368 N -8.55 4.63 0.23 0.00 1.43 -1.26 -4.95 118.68 110.22 2vl4 s LEU 368 Ca -0.04 -2.02 -0.06 0.00 -1.03 0.00 0.00 54.13 50.97 2vl4 s LEU 368 Cb 0.16 -1.64 0.36 0.00 0.03 0.00 0.00 46.19 45.10 2vl4 s LEU 368 CO 0.66 -0.37 1.78 -0.07 0.23 0.00 0.00 176.35 178.58 2vl4 h LEU 369 N 7.69 0.49 -0.20 1.79 3.38 -1.97 -1.90 115.31 124.59 2vl4 h LEU 369 Ca -0.07 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2vl4 h LEU 369 Cb 1.03 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2vl4 h LEU 369 CO 0.53 0.27 0.00 -2.65 0.09 0.00 0.00 178.44 176.68 2vl4 n PRO 370 N -4.85 0.03 0.09 1.13 -0.02 -1.26 -1.71 135.00 128.41 2vl4 n PRO 370 Ca 0.12 0.39 0.13 0.00 -2.02 0.00 0.00 63.50 62.11 2vl4 n PRO 370 Cb 0.29 -1.58 0.45 0.00 -0.02 0.00 0.00 33.50 32.64 2vl4 n PRO 370 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2vl4 n ASN 371 N -1.65 0.61 -4.60 2.55 3.02 -0.71 -4.69 115.26 109.79 2vl4 n ASN 371 Ca 0.02 0.58 -0.43 0.00 -0.03 0.00 0.00 54.58 54.72 2vl4 n ASN 371 Cb 0.11 -0.74 -0.02 0.00 -0.61 0.00 0.00 39.78 38.52 2vl4 n ASN 371 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2vl4 s VAL 372 N -3.13 4.09 0.68 2.41 1.01 -0.69 -5.00 120.40 119.77 2vl4 s VAL 372 Ca 0.10 1.11 -0.09 0.00 0.00 0.00 0.00 61.98 63.09 2vl4 s VAL 372 Cb 0.13 -4.47 0.03 0.00 0.00 0.00 0.00 36.38 32.06 2vl4 s VAL 372 CO 0.52 -0.94 1.03 0.42 0.00 0.00 0.00 175.10 176.14 2vl4 s THR 373 N 4.82 3.16 0.25 3.92 -4.23 -1.26 -4.92 115.64 117.38 2vl4 s THR 373 Ca 0.53 0.15 -0.03 0.00 -1.18 0.00 0.00 61.69 61.15 2vl4 s THR 373 Cb -0.09 -3.33 0.22 0.00 1.34 0.00 0.00 72.50 70.63 2vl4 s THR 373 CO 0.32 -0.40 1.77 0.74 -0.54 0.00 0.00 174.62 176.52 2vl4 h THR 374 N -0.54 0.78 -0.60 3.99 2.02 -1.98 -1.85 112.91 114.72 2vl4 h THR 374 Ca -0.45 -0.22 -0.06 0.00 0.77 0.00 0.00 66.41 66.45 2vl4 h THR 374 Cb 1.27 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 67.75 2vl4 h THR 374 CO 0.63 0.12 0.13 -0.08 0.37 0.00 0.00 175.52 176.68 2vl4 h GLU 375 N 0.63 0.95 -0.49 6.66 4.81 -1.99 -0.43 114.58 124.73 2vl4 h GLU 375 Ca 0.42 -0.22 -0.08 0.00 -0.13 0.00 0.00 59.36 59.35 2vl4 h GLU 375 Cb 0.54 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 2vl4 h GLU 375 CO -0.33 0.86 -0.01 0.00 -0.73 0.00 0.00 179.01 178.80 2vl4 h ARG 376 N 0.91 0.87 -0.33 1.92 3.08 -1.77 -0.47 114.38 118.59 2vl4 h ARG 376 Ca 0.19 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 2vl4 h ARG 376 Cb 0.35 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 2vl4 h ARG 376 CO 0.00 0.91 0.19 1.88 -1.07 0.00 0.00 179.97 181.89 2vl4 h TYR 377 N 0.73 0.44 -0.42 3.04 0.05 -0.92 -1.96 116.97 117.93 2vl4 h TYR 377 Ca 0.14 -0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.97 2vl4 h TYR 377 Cb 0.53 -0.14 -0.05 0.00 1.01 0.00 0.00 36.73 38.08 2vl4 h TYR 377 CO 0.04 0.33 0.13 1.96 -1.05 0.00 0.00 178.16 179.57 2vl4 h GLN 378 N 0.42 0.28 -0.55 4.88 4.20 -0.92 -2.36 115.11 121.06 2vl4 h GLN 378 Ca 0.12 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 2vl4 h GLN 378 Cb 0.03 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.72 2vl4 h GLN 378 CO -0.02 0.18 0.31 1.15 -0.67 0.00 0.00 178.83 179.78 2vl4 h THR 379 N 0.29 1.18 -0.87 -0.54 2.02 -1.00 -0.71 112.91 113.29 2vl4 h THR 379 Ca 0.20 -0.44 0.00 0.00 0.77 0.00 0.00 66.41 66.93 2vl4 h THR 379 Cb 0.20 0.47 -0.04 0.00 -1.74 0.00 0.00 68.15 67.04 2vl4 h THR 379 CO -0.21 0.19 0.55 0.25 0.37 0.00 0.00 175.52 176.66 2vl4 h LEU 380 N 0.74 1.02 -0.42 2.58 5.85 -1.13 0.00 115.31 123.95 2vl4 h LEU 380 Ca 0.19 -0.04 -0.16 0.00 0.84 0.00 0.00 57.88 58.71 2vl4 h LEU 380 Cb 0.03 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.80 2vl4 h LEU 380 CO -0.03 0.76 -0.43 -0.26 -0.34 0.00 0.00 178.44 178.14 2vl4 h PHE 381 N 1.19 1.04 -0.98 1.25 -1.00 -1.07 -1.61 116.94 115.75 2vl4 h PHE 381 Ca 0.31 -0.33 0.12 0.00 2.81 0.00 0.00 57.97 60.89 2vl4 h PHE 381 Cb -0.09 -0.21 -0.08 0.00 3.61 0.00 0.00 35.95 39.18 2vl4 h PHE 381 CO 0.00 1.13 0.62 -0.09 -1.61 0.00 0.00 178.31 178.37 2vl4 h ARG 382 N 0.69 0.93 -0.51 1.51 2.43 -0.63 -0.31 114.38 118.50 2vl4 h ARG 382 Ca 0.05 -0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 59.05 2vl4 h ARG 382 Cb 1.01 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.33 2vl4 h ARG 382 CO 0.10 0.62 -0.12 -0.44 -1.51 0.00 0.00 179.97 178.61 2vl4 h ASP 383 N 0.96 0.95 -0.11 -3.80 3.32 -0.49 -0.81 116.42 116.44 2vl4 h ASP 383 Ca 0.48 -0.31 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 2vl4 h ASP 383 Cb 0.49 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 2vl4 h ASP 383 CO -0.25 1.08 -0.06 0.24 -1.72 0.00 0.00 179.24 178.53 2vl4 h MET 384 N 0.85 0.24 -0.55 3.56 2.86 -0.97 -2.68 114.93 118.24 2vl4 h MET 384 Ca 0.13 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 2vl4 h MET 384 Cb 0.67 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.30 2vl4 h MET 384 CO 0.05 0.60 0.25 -0.22 1.06 0.00 0.00 176.91 178.65 2vl4 h LYS 385 N -0.12 0.80 0.00 1.72 3.64 -1.01 -2.23 116.57 119.37 2vl4 h LYS 385 Ca 0.02 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.25 2vl4 h LYS 385 Cb 0.53 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 2vl4 h LYS 385 CO 0.02 0.66 -0.15 0.93 -2.27 0.00 0.00 179.45 178.64 2vl4 h GLU 386 N 0.74 0.00 -0.59 1.90 5.08 -1.19 -1.31 114.58 119.22 2vl4 h GLU 386 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2vl4 h GLU 386 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2vl4 h GLU 386 CO -0.02 0.15 0.00 0.00 -1.00 0.00 0.00 179.01 178.14 2vl4 n ALA 387 N -2.20 2.84 -1.35 3.43 0.00 -0.88 -4.89 120.51 117.45 2vl4 n ALA 387 Ca -0.00 -0.86 -0.10 0.00 0.00 0.00 0.00 53.44 52.48 2vl4 n ALA 387 Cb 0.36 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 18.75 2vl4 n ALA 387 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2vl4 n ASN 388 N 0.50 -4.13 -4.80 0.00 3.02 -0.49 -4.03 115.26 105.33 2vl4 n ASN 388 Ca 0.14 0.23 -0.34 0.00 -0.03 0.00 0.00 54.58 54.58 2vl4 n ASN 388 Cb 0.55 -2.57 -0.02 0.00 -0.61 0.00 0.00 39.78 37.13 2vl4 n ASN 388 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2vl4 s MET 389 N -2.96 3.65 0.00 3.52 -1.94 -0.94 -4.90 119.30 115.73 2vl4 s MET 389 Ca 0.00 1.31 0.00 0.00 -1.71 0.00 0.00 55.69 55.29 2vl4 s MET 389 Cb 0.00 -2.07 0.00 0.00 2.01 0.00 0.00 34.83 34.77 2vl4 s MET 389 CO 0.00 -0.55 0.46 0.27 -0.01 0.00 0.00 175.02 175.19 2vl4 n ASN 390 N -1.31 0.75 -3.70 3.03 0.23 0.22 -4.64 115.26 109.84 2vl4 n ASN 390 Ca 0.09 -1.20 -0.14 0.00 -0.53 0.00 0.00 54.58 52.80 2vl4 n ASN 390 Cb 0.53 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.14 2vl4 n ASN 390 CO 0.00 0.00 0.00 -0.32 -0.93 0.00 0.00 177.26 176.01 2vl4 s MET 391 N -0.20 0.70 -0.01 -3.83 0.00 -1.10 -0.73 119.30 114.13 2vl4 s MET 391 Ca 0.00 0.14 0.01 0.00 0.00 0.00 0.00 55.69 55.84 2vl4 s MET 391 Cb 0.00 0.33 0.01 0.00 0.00 0.00 0.00 34.83 35.16 2vl4 s MET 391 CO 0.00 -0.18 -0.01 0.54 0.00 0.00 0.00 175.02 175.37 2vl4 s VAL 392 N -0.83 0.17 -0.27 10.11 0.11 0.10 -3.18 120.40 126.61 2vl4 s VAL 392 Ca -0.09 -0.04 -0.10 0.00 -2.93 0.00 0.00 61.98 58.82 2vl4 s VAL 392 Cb -0.04 -0.19 -0.05 0.00 -1.53 0.00 0.00 36.38 34.58 2vl4 s VAL 392 CO 0.04 0.08 0.17 -0.60 -3.33 0.00 0.00 175.10 171.46 2vl4 s ARG 393 N 0.28 3.91 -0.79 1.54 3.52 -0.59 -1.25 118.95 125.57 2vl4 s ARG 393 Ca -0.03 -0.34 -0.20 0.00 -0.13 0.00 0.00 55.73 55.03 2vl4 s ARG 393 Cb -0.05 -3.60 0.10 0.00 -1.56 0.00 0.00 34.95 29.84 2vl4 s ARG 393 CO -0.01 -0.17 1.03 0.42 -0.81 0.00 0.00 175.30 175.76 2vl4 s ILE 394 N 1.71 4.56 0.41 4.11 1.01 0.55 0.28 121.20 133.83 2vl4 s ILE 394 Ca 0.07 -1.02 -0.26 0.00 0.00 0.00 0.00 60.65 59.44 2vl4 s ILE 394 Cb -0.16 -4.72 -0.09 0.00 0.01 0.00 0.00 42.46 37.51 2vl4 s ILE 394 CO 0.10 -1.46 1.34 0.86 0.00 0.00 0.00 174.94 175.77 2vl4 s TRP 395 N 3.28 2.73 -2.00 3.97 -0.00 -1.09 -1.98 118.94 123.85 2vl4 s TRP 395 Ca 0.27 1.37 0.07 0.00 -0.00 0.00 0.00 56.10 57.80 2vl4 s TRP 395 Cb -0.11 -3.74 0.41 0.00 -0.00 0.00 0.00 33.47 30.03 2vl4 s TRP 395 CO -0.00 -2.30 1.07 0.41 -0.00 0.00 0.00 176.95 176.12 2vl4 n GLY 396 N 0.64 -0.77 1.25 5.86 0.00 -1.26 -2.68 105.19 108.23 2vl4 n GLY 396 Ca 0.04 -0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.13 2vl4 n GLY 396 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vl4 n GLY 397 N 0.35 2.14 0.00 -0.02 0.00 -1.26 -1.60 105.19 104.80 2vl4 n GLY 397 Ca 0.05 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.33 2vl4 n GLY 397 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vl4 n GLY 398 N 1.58 0.78 3.31 -0.02 0.00 -1.09 -0.74 105.19 109.01 2vl4 n GLY 398 Ca 0.23 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.08 2vl4 n GLY 398 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vl4 s THR 399 N 3.38 1.31 -0.01 2.61 -4.23 -1.26 -4.17 115.64 113.26 2vl4 s THR 399 Ca 0.00 -2.09 -0.30 0.00 -1.18 0.00 0.00 61.69 58.11 2vl4 s THR 399 Cb 0.00 -2.07 -0.05 0.00 1.34 0.00 0.00 72.50 71.71 2vl4 s THR 399 CO 0.00 -0.56 1.42 -0.31 -0.54 0.00 0.00 174.62 174.63 2vl4 s TYR 400 N -3.24 2.77 0.92 3.99 2.02 -1.26 -4.96 117.35 117.59 2vl4 s TYR 400 Ca 0.22 0.76 -0.12 0.00 -0.37 0.00 0.00 57.07 57.57 2vl4 s TYR 400 Cb 0.03 -3.68 0.14 0.00 -0.40 0.00 0.00 41.96 38.04 2vl4 s TYR 400 CO 0.05 -2.56 1.11 -1.21 -1.57 0.00 0.00 175.55 171.37 2vl4 s GLU 401 N 2.60 1.09 0.92 -0.62 0.41 -1.26 -5.00 118.70 116.85 2vl4 s GLU 401 Ca 0.64 0.54 -0.12 0.00 -0.41 0.00 0.00 54.97 55.63 2vl4 s GLU 401 Cb -0.31 -1.81 0.14 0.00 -1.78 0.00 0.00 34.13 30.37 2vl4 s GLU 401 CO 0.26 -2.29 1.11 0.54 -0.49 0.00 0.00 175.26 174.39 2vl4 s ASN 402 N -3.68 3.31 0.36 -0.19 4.22 -1.26 -4.91 114.94 112.79 2vl4 s ASN 402 Ca 0.64 1.20 0.03 0.00 -2.14 0.00 0.00 52.86 52.59 2vl4 s ASN 402 Cb -0.17 -1.86 0.67 0.00 1.28 0.00 0.00 41.25 41.18 2vl4 s ASN 402 CO 0.56 -2.70 2.02 0.78 -2.04 0.00 0.00 177.10 175.71 2vl4 h ASN 403 N -1.60 0.69 -0.56 3.54 2.35 -1.99 -2.43 115.58 115.59 2vl4 h ASN 403 Ca -0.51 -0.02 0.04 0.00 -0.55 0.00 0.00 56.30 55.26 2vl4 h ASN 403 Cb 1.31 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 39.47 2vl4 h ASN 403 CO 0.58 0.50 0.31 0.25 -1.65 0.00 0.00 177.43 177.42 2vl4 h LEU 404 N 0.81 0.47 -0.52 1.61 5.85 -1.99 -1.04 115.31 120.50 2vl4 h LEU 404 Ca 0.23 0.02 0.10 0.00 0.84 0.00 0.00 57.88 59.07 2vl4 h LEU 404 Cb -0.08 -0.07 -0.09 0.00 0.37 0.00 0.00 40.66 40.79 2vl4 h LEU 404 CO -0.05 0.32 -0.02 0.15 -0.34 0.00 0.00 178.44 178.50 2vl4 h PHE 405 N 0.60 -0.08 -0.09 1.25 3.57 -1.79 -0.85 116.94 119.55 2vl4 h PHE 405 Ca 0.24 0.04 -0.20 0.00 3.53 0.00 0.00 57.97 61.58 2vl4 h PHE 405 Cb 0.11 0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.96 2vl4 h PHE 405 CO -0.08 -0.14 -0.76 1.88 -2.23 0.00 0.00 178.31 176.97 2vl4 h TYR 406 N 0.09 0.70 -0.92 0.41 0.05 -1.49 -1.50 116.97 114.31 2vl4 h TYR 406 Ca 0.26 -0.31 0.10 0.00 0.05 0.00 0.00 58.73 58.82 2vl4 h TYR 406 Cb 0.40 -0.10 -0.08 0.00 1.01 0.00 0.00 36.73 37.96 2vl4 h TYR 406 CO -0.34 1.10 0.56 -0.44 -1.05 0.00 0.00 178.16 177.98 2vl4 h ASP 407 N 0.34 0.83 -0.24 3.88 3.32 -0.76 0.33 116.42 124.13 2vl4 h ASP 407 Ca -0.04 0.04 -0.19 0.00 0.02 0.00 0.00 57.03 56.86 2vl4 h ASP 407 Cb 1.36 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.78 2vl4 h ASP 407 CO 0.14 0.48 -0.57 -0.07 -1.72 0.00 0.00 179.24 177.49 2vl4 h LEU 408 N 0.94 0.92 -0.57 1.55 3.38 -0.99 -1.87 115.31 118.67 2vl4 h LEU 408 Ca 0.44 -0.56 0.06 0.00 0.09 0.00 0.00 57.88 57.91 2vl4 h LEU 408 Cb 0.36 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 2vl4 h LEU 408 CO -0.24 1.31 0.27 0.00 0.09 0.00 0.00 178.44 179.88 2vl4 h ALA 409 N 0.63 0.74 -0.14 1.53 0.00 -0.98 -0.44 119.26 120.60 2vl4 h ALA 409 Ca -0.00 0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.98 2vl4 h ALA 409 Cb 1.19 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 2vl4 h ALA 409 CO 0.13 -0.10 -0.10 -0.44 0.00 0.00 0.00 179.25 178.73 2vl4 h ASP 410 N 0.51 -0.33 0.81 0.00 3.32 -0.73 -1.34 116.42 118.65 2vl4 h ASP 410 Ca 0.26 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.39 2vl4 h ASP 410 Cb 0.22 0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.94 2vl4 h ASP 410 CO -0.21 -0.14 -0.14 -1.84 -1.72 0.00 0.00 179.24 175.19 2vl4 n GLU 411 N -5.25 0.06 0.00 3.56 0.28 -0.72 -3.21 120.64 115.36 2vl4 n GLU 411 Ca -0.03 -0.01 0.10 0.00 -0.16 0.00 0.00 57.16 57.06 2vl4 n GLU 411 Cb 0.17 -1.50 0.08 0.00 1.43 0.00 0.00 31.44 31.62 2vl4 n GLU 411 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2vl4 n ASN 412 N -1.46 2.64 -2.79 -1.84 3.02 -0.20 -4.80 115.26 109.83 2vl4 n ASN 412 Ca 0.07 -1.82 -0.16 0.00 -0.03 0.00 0.00 54.58 52.65 2vl4 n ASN 412 Cb 0.33 0.04 0.06 0.00 -0.61 0.00 0.00 39.78 39.60 2vl4 n ASN 412 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vl4 n GLY 413 N 1.16 -0.15 3.29 7.41 0.00 -0.74 -4.18 105.19 111.97 2vl4 n GLY 413 Ca 0.12 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2vl4 n GLY 413 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vl4 s ILE 414 N -3.25 3.52 0.48 -0.61 -1.09 -0.58 0.07 121.20 119.74 2vl4 s ILE 414 Ca 0.29 -0.76 -0.23 0.00 -2.23 0.00 0.00 60.65 57.72 2vl4 s ILE 414 Cb -0.13 -2.77 -0.07 0.00 -1.58 0.00 0.00 42.46 37.91 2vl4 s ILE 414 CO 0.54 0.18 1.31 -0.76 -1.23 0.00 0.00 174.94 174.97 2vl4 s LEU 415 N 1.44 4.01 -0.18 2.97 1.02 0.09 -4.58 118.68 123.46 2vl4 s LEU 415 Ca 0.02 2.65 0.00 0.00 0.02 0.00 0.00 54.13 56.82 2vl4 s LEU 415 Cb -0.16 -4.13 0.01 0.00 0.02 0.00 0.00 46.19 41.92 2vl4 s LEU 415 CO -0.01 -1.19 -0.17 -0.69 0.02 0.00 0.00 176.35 174.32 2vl4 s VAL 416 N -1.34 2.38 -0.37 -1.59 1.01 0.19 -0.72 120.40 119.97 2vl4 s VAL 416 Ca 0.65 -0.84 -0.19 0.00 0.00 0.00 0.00 61.98 61.60 2vl4 s VAL 416 Cb -0.37 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 33.99 2vl4 s VAL 416 CO 0.46 0.52 0.55 0.86 0.00 0.00 0.00 175.10 177.49 2vl4 s TRP 417 N 1.24 3.16 -0.35 5.22 -0.11 -0.38 -0.97 118.94 126.74 2vl4 s TRP 417 Ca 0.03 0.16 -0.09 0.00 1.22 0.00 0.00 56.10 57.42 2vl4 s TRP 417 Cb -0.14 -3.02 0.03 0.00 -1.50 0.00 0.00 33.47 28.84 2vl4 s TRP 417 CO -0.09 -0.61 0.16 -1.14 -4.62 0.00 0.00 176.95 170.65 2vl4 s GLN 418 N 2.50 2.77 0.47 5.86 2.00 -0.56 -0.33 119.66 132.36 2vl4 s GLN 418 Ca 0.20 -1.10 -0.21 0.00 -2.00 0.00 0.00 55.36 52.25 2vl4 s GLN 418 Cb -0.15 -3.60 -0.09 0.00 0.80 0.00 0.00 33.01 29.97 2vl4 s GLN 418 CO 0.14 -0.66 1.03 -0.51 -0.50 0.00 0.00 175.29 174.79 2vl4 s ASP 419 N 1.49 6.47 0.69 6.67 1.11 -0.84 -0.63 116.67 131.63 2vl4 s ASP 419 Ca 0.01 1.92 -0.12 0.00 0.18 0.00 0.00 52.55 54.54 2vl4 s ASP 419 Cb -0.19 -2.56 0.01 0.00 1.07 0.00 0.00 42.92 41.25 2vl4 s ASP 419 CO 0.05 -0.69 1.07 -0.36 1.18 0.00 0.00 175.17 176.41 2vl4 s PHE 420 N -1.95 2.99 -1.44 4.23 0.08 0.28 -4.75 117.98 117.43 2vl4 s PHE 420 Ca 0.65 1.46 -0.11 0.00 0.12 0.00 0.00 56.93 59.06 2vl4 s PHE 420 Cb -0.16 -2.93 0.05 0.00 -0.57 0.00 0.00 43.02 39.40 2vl4 s PHE 420 CO 0.20 -1.32 2.35 -1.33 -0.10 0.00 0.00 175.22 175.03 2vl4 n MET 421 N -3.00 3.50 -4.20 0.44 2.81 -1.26 -4.38 117.12 111.03 2vl4 n MET 421 Ca 0.08 -2.85 -0.20 0.00 -1.81 0.00 0.00 57.70 52.92 2vl4 n MET 421 Cb 0.53 -2.99 -0.16 0.00 -0.71 0.00 0.00 33.22 29.90 2vl4 n MET 421 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 2vl4 s PHE 422 N 1.63 0.77 -0.17 2.03 0.08 -0.63 -4.87 117.98 116.81 2vl4 s PHE 422 Ca 0.52 -0.21 -0.09 0.00 0.12 0.00 0.00 56.93 57.27 2vl4 s PHE 422 Cb 0.15 -0.66 0.07 0.00 -0.57 0.00 0.00 43.02 42.00 2vl4 s PHE 422 CO -0.06 -0.18 0.41 0.00 -0.10 0.00 0.00 175.22 175.29 2vl4 s ALA 423 N 0.80 -1.06 0.00 5.36 0.00 -1.25 -1.88 121.76 123.73 2vl4 s ALA 423 Ca -0.11 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.35 2vl4 s ALA 423 Cb -0.14 -1.02 0.00 0.00 0.00 0.00 0.00 23.12 21.96 2vl4 s ALA 423 CO 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 175.76 175.38 2vl4 s THR 425 N -2.37 0.25 0.89 0.00 -1.32 -1.26 -4.84 115.64 106.98 2vl4 s THR 425 Ca 0.00 -0.65 -0.10 0.00 -1.21 0.00 0.00 61.69 59.73 2vl4 s THR 425 Cb 0.00 -0.31 0.13 0.00 -1.51 0.00 0.00 72.50 70.81 2vl4 s THR 425 CO 0.00 -0.26 1.12 -2.16 -2.21 0.00 0.00 174.62 171.10 2vl4 s PRO 426 N -0.96 1.24 0.32 7.08 0.04 -1.26 -4.88 135.00 136.56 2vl4 s PRO 426 Ca -0.08 1.34 0.09 0.00 0.04 0.00 0.00 61.00 62.39 2vl4 s PRO 426 Cb -0.07 -1.77 -0.06 0.00 0.04 0.00 0.00 34.50 32.65 2vl4 s PRO 426 CO -0.00 -2.41 -0.09 0.71 0.04 0.00 0.00 177.00 175.25 2vl4 s TYR 427 N -2.73 2.23 0.95 0.56 2.02 -1.26 -4.85 117.35 114.27 2vl4 s TYR 427 Ca 0.65 -0.56 -0.11 0.00 -0.37 0.00 0.00 57.07 56.68 2vl4 s TYR 427 Cb -0.21 -1.26 0.14 0.00 -0.40 0.00 0.00 41.96 40.24 2vl4 s TYR 427 CO 0.58 0.48 0.99 -2.30 -1.57 0.00 0.00 175.55 173.73 2vl4 n PRO 428 N -0.70 -0.64 -0.77 -1.71 -0.02 -1.26 -4.82 135.00 125.08 2vl4 n PRO 428 Ca -0.05 -0.13 0.01 0.00 -2.02 0.00 0.00 63.50 61.30 2vl4 n PRO 428 Cb 0.63 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 2vl4 n PRO 428 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2vl4 n SER 429 N -3.77 0.19 -4.75 2.55 3.41 -1.26 -4.91 113.62 105.08 2vl4 n SER 429 Ca 0.10 -1.88 -0.32 0.00 -0.26 0.00 0.00 58.87 56.50 2vl4 n SER 429 Cb 0.53 -0.18 0.08 0.00 -0.26 0.00 0.00 64.21 64.38 2vl4 n SER 429 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2vl4 s ASP 430 N -1.12 4.55 0.21 4.04 -4.77 -1.26 -4.79 116.67 113.53 2vl4 s ASP 430 Ca 0.08 2.04 -0.09 0.00 -3.30 0.00 0.00 52.55 51.28 2vl4 s ASP 430 Cb 0.09 -2.55 0.29 0.00 -1.09 0.00 0.00 42.92 39.67 2vl4 s ASP 430 CO -0.04 -2.01 1.75 -0.65 0.70 0.00 0.00 175.17 174.92 2vl4 h PRO 431 N -0.54 0.43 -0.19 2.11 0.11 -1.99 -1.37 132.00 130.56 2vl4 h PRO 431 Ca -0.46 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.52 2vl4 h PRO 431 Cb 1.25 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2vl4 h PRO 431 CO 0.51 0.28 -0.34 1.79 -0.21 0.00 0.00 178.00 180.04 2vl4 h THR 432 N 0.44 1.29 -0.34 -1.15 1.35 -1.99 -0.95 112.91 111.56 2vl4 h THR 432 Ca 0.32 -1.40 -0.05 0.00 -0.55 0.00 0.00 66.41 64.72 2vl4 h THR 432 Cb 0.38 1.51 -0.01 0.00 -1.73 0.00 0.00 68.15 68.30 2vl4 h THR 432 CO -0.30 0.43 0.01 0.15 -0.25 0.00 0.00 175.52 175.56 2vl4 h PHE 433 N 0.34 0.64 -0.60 4.73 3.57 -1.73 -2.66 116.94 121.24 2vl4 h PHE 433 Ca 0.04 -0.11 -0.07 0.00 3.53 0.00 0.00 57.97 61.36 2vl4 h PHE 433 Cb 0.76 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.31 2vl4 h PHE 433 CO 0.02 0.70 0.10 -0.07 -2.23 0.00 0.00 178.31 176.83 2vl4 h LEU 434 N 0.40 0.92 -1.11 0.59 3.38 -1.02 -0.58 115.31 117.88 2vl4 h LEU 434 Ca 0.10 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 2vl4 h LEU 434 Cb 0.44 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2vl4 h LEU 434 CO 0.02 0.92 0.23 0.50 0.09 0.00 0.00 178.44 180.20 2vl4 h LYS 435 N 0.91 0.86 -0.12 1.13 1.63 -1.15 0.20 116.57 120.03 2vl4 h LYS 435 Ca 0.19 -0.14 -0.14 0.00 -0.85 0.00 0.00 60.65 59.71 2vl4 h LYS 435 Cb 0.40 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.87 2vl4 h LYS 435 CO 0.01 0.71 -0.52 0.00 -3.45 0.00 0.00 179.45 176.20 2vl4 h ARG 436 N 0.85 0.34 -0.34 1.90 3.08 -1.02 -2.63 114.38 116.57 2vl4 h ARG 436 Ca 0.20 -0.20 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 2vl4 h ARG 436 Cb 0.17 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 2vl4 h ARG 436 CO -0.02 0.78 -0.48 0.28 -1.07 0.00 0.00 179.97 179.47 2vl4 h VAL 437 N 0.27 1.27 -0.42 2.04 2.07 -0.88 -2.87 116.25 117.74 2vl4 h VAL 437 Ca 0.01 -1.65 0.06 0.00 0.82 0.00 0.00 66.70 65.94 2vl4 h VAL 437 Cb 1.00 1.51 -0.06 0.00 -1.52 0.00 0.00 31.29 32.23 2vl4 h VAL 437 CO 0.09 0.55 0.09 -0.08 0.02 0.00 0.00 177.57 178.23 2vl4 h GLU 438 N 0.72 0.21 -0.35 1.57 4.81 -0.48 -0.39 114.58 120.68 2vl4 h GLU 438 Ca 0.04 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.32 2vl4 h GLU 438 Cb 1.08 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 30.34 2vl4 h GLU 438 CO 0.11 0.14 -0.12 0.00 -0.73 0.00 0.00 179.01 178.41 2vl4 h ALA 439 N 1.31 0.18 -0.60 2.92 0.00 -1.48 -0.45 119.26 121.14 2vl4 h ALA 439 Ca 0.20 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 2vl4 h ALA 439 Cb 0.24 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 2vl4 h ALA 439 CO -0.26 -0.49 0.26 1.49 0.00 0.00 0.00 179.25 180.25 2vl4 h GLU 440 N -0.05 0.86 -0.10 0.00 4.81 -1.26 -0.10 114.58 118.74 2vl4 h GLU 440 Ca 0.17 -0.12 -0.05 0.00 -0.13 0.00 0.00 59.36 59.23 2vl4 h GLU 440 Cb 0.31 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.53 2vl4 h GLU 440 CO -0.38 0.69 -0.13 0.00 -0.73 0.00 0.00 179.01 178.45 2vl4 h ALA 441 N 1.44 0.15 -0.30 2.92 0.00 -0.67 -1.85 119.26 120.95 2vl4 h ALA 441 Ca 0.21 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.82 2vl4 h ALA 441 Cb 0.13 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2vl4 h ALA 441 CO -0.02 0.03 0.14 0.28 0.00 0.00 0.00 179.25 179.68 2vl4 h VAL 442 N -0.16 0.98 0.16 0.00 2.07 -1.02 -0.06 116.25 118.23 2vl4 h VAL 442 Ca 0.01 -0.10 0.01 0.00 0.82 0.00 0.00 66.70 67.43 2vl4 h VAL 442 Cb 0.67 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 2vl4 h VAL 442 CO 0.03 0.06 -0.19 0.22 0.02 0.00 0.00 177.57 177.71 2vl4 h TYR 443 N 0.31 -0.49 -0.04 1.57 3.20 -0.97 -1.97 116.97 118.56 2vl4 h TYR 443 Ca 0.13 0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.82 2vl4 h TYR 443 Cb 0.05 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 2vl4 h TYR 443 CO -0.10 -0.28 -0.77 -0.91 -1.64 0.00 0.00 178.16 174.46 2vl4 h ASN 444 N -0.39 0.36 0.19 -2.11 2.35 -1.23 -0.79 115.58 113.97 2vl4 h ASN 444 Ca 0.01 -0.25 -0.00 0.00 -0.55 0.00 0.00 56.30 55.50 2vl4 h ASN 444 Cb 0.38 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 2vl4 h ASN 444 CO -0.06 1.00 -0.14 0.40 -1.65 0.00 0.00 177.43 176.98 2vl4 h ILE 445 N 0.19 0.71 -0.39 2.81 2.04 -0.95 -0.34 117.51 121.58 2vl4 h ILE 445 Ca -0.03 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.78 2vl4 h ILE 445 Cb 1.35 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 2vl4 h ILE 445 CO 0.12 0.00 0.05 0.03 0.00 0.00 0.00 178.15 178.35 2vl4 h ARG 446 N -0.33 0.60 -0.68 2.37 3.08 -1.28 -0.48 114.38 117.66 2vl4 h ARG 446 Ca -0.01 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 2vl4 h ARG 446 Cb 0.29 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 2vl4 h ARG 446 CO 0.00 0.59 0.35 -0.09 -1.07 0.00 0.00 179.97 179.75 2vl4 h ARG 447 N 0.58 0.96 0.00 0.04 2.43 -0.80 -3.35 114.38 114.23 2vl4 h ARG 447 Ca 0.13 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2vl4 h ARG 447 Cb 0.29 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2vl4 h ARG 447 CO 0.00 0.72 -1.19 1.28 -1.51 0.00 0.00 179.97 179.28 2vl4 n LEU 448 N -4.35 0.32 0.04 3.80 4.77 -0.17 -4.62 117.00 116.79 2vl4 n LEU 448 Ca 0.07 -0.24 0.06 0.00 -0.03 0.00 0.00 56.01 55.87 2vl4 n LEU 448 Cb 0.12 0.00 0.28 0.00 -2.33 0.00 0.00 43.42 41.49 2vl4 n LEU 448 CO 0.38 0.08 0.70 -2.11 -1.33 0.00 0.00 177.39 175.11 2vl4 n ARG 449 N -1.69 0.05 0.00 3.23 1.85 -0.23 -1.73 116.66 118.14 2vl4 n ARG 449 Ca -0.00 0.38 0.14 0.00 -1.00 0.00 0.00 57.85 57.37 2vl4 n ARG 449 Cb 0.31 -1.61 0.48 0.00 -1.05 0.00 0.00 32.46 30.59 2vl4 n ARG 449 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2vl4 n ASN 450 N -1.70 1.50 -4.69 2.89 3.02 -1.26 -4.92 115.26 110.09 2vl4 n ASN 450 Ca 0.02 -1.42 -0.41 0.00 -0.03 0.00 0.00 54.58 52.73 2vl4 n ASN 450 Cb 0.12 0.02 -0.04 0.00 -0.61 0.00 0.00 39.78 39.28 2vl4 n ASN 450 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2vl4 s HIS 451 N -2.08 3.53 0.38 3.10 3.76 -0.70 -4.71 115.29 118.56 2vl4 s HIS 451 Ca 0.35 1.42 0.11 0.00 -0.15 0.00 0.00 55.06 56.79 2vl4 s HIS 451 Cb 0.21 -3.02 0.89 0.00 1.11 0.00 0.00 32.58 31.76 2vl4 s HIS 451 CO 0.36 -0.11 1.90 0.00 -0.85 0.00 0.00 174.74 176.05 2vl4 h ALA 452 N 7.03 1.91 0.00 -1.40 0.00 -1.86 -2.21 119.26 122.73 2vl4 h ALA 452 Ca -0.35 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 2vl4 h ALA 452 Cb 1.17 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2vl4 h ALA 452 CO 0.80 -0.12 -0.34 0.66 0.00 0.00 0.00 179.25 180.26 2vl4 h SER 453 N 0.60 0.00 -2.45 0.00 4.64 -1.87 -3.44 113.55 111.03 2vl4 h SER 453 Ca 0.40 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 61.15 2vl4 h SER 453 Cb 0.69 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.77 2vl4 h SER 453 CO -0.16 0.34 1.25 -0.22 -0.87 0.00 0.00 176.83 177.17 2vl4 s LEU 454 N -6.96 3.94 -0.17 5.97 2.96 -0.83 0.56 118.68 124.15 2vl4 s LEU 454 Ca 0.00 2.00 0.05 0.00 -0.22 0.00 0.00 54.13 55.96 2vl4 s LEU 454 Cb 0.11 -3.53 -0.14 0.00 0.50 0.00 0.00 46.19 43.13 2vl4 s LEU 454 CO 0.67 -1.38 -0.10 0.00 -1.32 0.00 0.00 176.35 174.23 2vl4 n ALA 455 N 9.00 1.62 -3.66 5.97 0.00 -0.15 -4.87 120.51 128.42 2vl4 n ALA 455 Ca 0.22 -0.82 -0.06 0.00 0.00 0.00 0.00 53.44 52.78 2vl4 n ALA 455 Cb 0.44 0.04 -0.02 0.00 0.00 0.00 0.00 19.45 19.91 2vl4 n ALA 455 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vl4 s MET 456 N -2.36 1.15 0.03 0.00 0.23 -1.20 -4.31 119.30 112.85 2vl4 s MET 456 Ca -0.19 -0.57 0.08 0.00 -1.03 0.00 0.00 55.69 53.98 2vl4 s MET 456 Cb 0.06 0.44 -0.03 0.00 -1.53 0.00 0.00 34.83 33.77 2vl4 s MET 456 CO 0.47 -0.52 -0.23 -1.58 -2.03 0.00 0.00 175.02 171.12 2vl4 s TRP 457 N -3.34 2.41 -0.07 3.16 0.52 -0.21 -1.50 118.94 119.91 2vl4 s TRP 457 Ca 0.09 -0.36 0.01 0.00 0.02 0.00 0.00 56.10 55.87 2vl4 s TRP 457 Cb -0.02 -1.45 0.02 0.00 -1.15 0.00 0.00 33.47 30.87 2vl4 s TRP 457 CO -0.02 0.14 -0.09 0.00 0.02 0.00 0.00 176.95 176.99 2vl4 h GLY 459 N 7.26 0.57 -2.39 0.00 0.00 -0.63 0.83 103.07 108.70 2vl4 h GLY 459 Ca -0.32 -0.21 0.24 0.00 0.00 0.00 0.00 47.33 47.04 2vl4 h GLY 459 CO 0.46 0.19 0.65 0.54 0.00 0.00 0.00 176.54 178.38 2vl4 s ASN 460 N -6.62 -0.10 -0.36 0.19 2.20 -1.13 -4.06 114.94 105.06 2vl4 s ASN 460 Ca -0.08 -0.32 -0.13 0.00 -0.94 0.00 0.00 52.86 51.38 2vl4 s ASN 460 Cb 0.18 0.35 -0.01 0.00 -2.00 0.00 0.00 41.25 39.77 2vl4 s ASN 460 CO 0.73 -0.65 0.25 0.21 -2.94 0.00 0.00 177.10 174.71 2vl4 s ASN 461 N -3.05 6.04 -0.60 3.54 2.47 -0.79 -1.92 114.94 120.63 2vl4 s ASN 461 Ca 0.15 -0.58 0.00 0.00 0.42 0.00 0.00 52.86 52.85 2vl4 s ASN 461 Cb 0.01 -2.13 0.00 0.00 -1.45 0.00 0.00 41.25 37.68 2vl4 s ASN 461 CO 0.00 -0.30 0.00 -0.62 -3.72 0.00 0.00 177.10 172.46 2vl4 n GLU 462 N 5.11 -1.19 -0.03 0.43 1.02 0.30 -0.06 120.64 126.22 2vl4 n GLU 462 Ca -0.12 0.60 -0.16 0.00 -0.02 0.00 0.00 57.16 57.46 2vl4 n GLU 462 Cb 0.49 -4.64 -0.08 0.00 -0.02 0.00 0.00 31.44 27.19 2vl4 n GLU 462 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2vl4 h ILE 463 N 0.00 1.36 -0.40 -3.67 2.04 -1.85 0.07 117.51 115.05 2vl4 h ILE 463 Ca -0.12 -1.78 -0.14 0.00 1.00 0.00 0.00 64.86 63.82 2vl4 h ILE 463 Cb 0.77 2.13 -0.01 0.00 -0.74 0.00 0.00 36.82 38.96 2vl4 h ILE 463 CO 0.17 0.54 -0.30 0.25 0.00 0.00 0.00 178.15 178.81 2vl4 h LEU 464 N 0.15 0.92 -0.59 1.44 5.85 -1.89 -0.17 115.31 121.02 2vl4 h LEU 464 Ca -0.03 -0.38 0.05 0.00 0.84 0.00 0.00 57.88 58.37 2vl4 h LEU 464 Cb 1.11 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.84 2vl4 h LEU 464 CO 0.10 1.15 0.32 -0.08 -0.34 0.00 0.00 178.44 179.58 2vl4 h GLU 465 N 0.75 0.58 -0.36 1.25 4.81 -1.82 -1.29 114.58 118.50 2vl4 h GLU 465 Ca 0.08 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.32 2vl4 h GLU 465 Cb 0.86 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 30.07 2vl4 h GLU 465 CO 0.08 0.39 0.13 0.00 -0.73 0.00 0.00 179.01 178.87 2vl4 h ALA 466 N 1.31 0.42 -0.47 2.92 0.00 -0.66 0.17 119.26 122.94 2vl4 h ALA 466 Ca 0.26 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.15 2vl4 h ALA 466 Cb 0.15 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2vl4 h ALA 466 CO -0.17 -0.26 0.04 -0.07 0.00 0.00 0.00 179.25 178.80 2vl4 h LEU 467 N 0.28 0.71 0.14 0.00 3.38 -0.59 -1.93 115.31 117.31 2vl4 h LEU 467 Ca 0.16 -0.15 -0.32 0.00 0.09 0.00 0.00 57.88 57.66 2vl4 h LEU 467 Cb 0.13 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 2vl4 h LEU 467 CO -0.16 0.76 -1.62 0.11 0.09 0.00 0.00 178.44 177.61 2vl4 h LYS 468 N 0.72 0.31 0.00 1.13 1.57 -1.08 -3.43 116.57 115.78 2vl4 h LYS 468 Ca 0.15 -0.52 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 2vl4 h LYS 468 Cb 0.38 0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2vl4 h LYS 468 CO 0.01 1.19 -0.08 0.66 -0.57 0.00 0.00 179.45 180.66 2vl4 n TYR 469 N -3.50 0.00 0.11 -1.35 4.01 0.57 -4.71 117.16 112.28 2vl4 n TYR 469 Ca -0.20 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.63 2vl4 n TYR 469 Cb 1.06 0.00 0.26 0.00 -0.31 0.00 0.00 39.34 40.35 2vl4 n TYR 469 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 2vl4 n TRP 470 N -0.87 0.84 -0.73 -0.72 8.01 -0.73 -4.93 117.44 118.32 2vl4 n TRP 470 Ca 0.00 -0.40 0.00 0.00 -1.31 0.00 0.00 57.50 55.79 2vl4 n TRP 470 Cb 0.00 -0.03 0.00 0.00 -2.01 0.00 0.00 31.31 29.27 2vl4 n TRP 470 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2vl4 n GLY 471 N 1.35 0.57 0.29 6.99 0.00 -1.26 -4.96 105.19 108.17 2vl4 n GLY 471 Ca 0.20 -0.64 0.11 0.00 0.00 0.00 0.00 46.02 45.69 2vl4 n GLY 471 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2vl4 h PHE 472 N 0.00 0.00 0.00 1.61 0.04 -1.83 -1.88 116.94 114.87 2vl4 h PHE 472 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2vl4 h PHE 472 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 2vl4 h PHE 472 CO 0.00 0.00 0.00 -1.91 -0.60 0.00 0.00 178.31 175.80 2vl4 n GLU 473 N -4.49 0.17 0.00 1.51 2.13 -1.26 -0.23 120.64 118.46 2vl4 n GLU 473 Ca -0.00 0.53 0.12 0.00 0.66 0.00 0.00 57.16 58.47 2vl4 n GLU 473 Cb 0.21 -1.93 0.21 0.00 0.27 0.00 0.00 31.44 30.20 2vl4 n GLU 473 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 2vl4 n LYS 474 N -2.27 0.84 -0.01 5.31 0.00 -0.71 -4.46 118.16 116.87 2vl4 n LYS 474 Ca 0.00 -0.59 0.10 0.00 -0.00 0.00 0.00 58.31 57.83 2vl4 n LYS 474 Cb 0.14 -1.49 -0.15 0.00 -0.00 0.00 0.00 35.03 33.53 2vl4 n LYS 474 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2vl4 n LYS 475 N -0.57 0.58 -4.22 -1.58 5.02 0.67 -5.00 118.16 113.06 2vl4 n LYS 475 Ca 0.10 -0.15 -0.13 0.00 -2.02 0.00 0.00 58.31 56.11 2vl4 n LYS 475 Cb 0.39 -1.48 -0.10 0.00 -0.02 0.00 0.00 35.03 33.82 2vl4 n LYS 475 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2vl4 s PHE 476 N -3.31 1.13 0.82 2.13 0.08 -1.05 -5.07 117.98 112.71 2vl4 s PHE 476 Ca -0.04 -0.87 -0.12 0.00 0.12 0.00 0.00 56.93 56.01 2vl4 s PHE 476 Cb 0.14 -0.62 0.09 0.00 -0.57 0.00 0.00 43.02 42.06 2vl4 s PHE 476 CO 0.85 -0.06 1.18 0.95 -0.10 0.00 0.00 175.22 178.03 2vl4 s THR 477 N -3.50 2.21 0.38 0.64 -4.23 -1.26 -4.76 115.64 105.12 2vl4 s THR 477 Ca 0.17 0.08 0.11 0.00 -1.18 0.00 0.00 61.69 60.87 2vl4 s THR 477 Cb 0.04 -2.39 0.33 0.00 1.34 0.00 0.00 72.50 71.82 2vl4 s THR 477 CO -0.00 -0.07 1.90 -0.65 -0.54 0.00 0.00 174.62 175.25 2vl4 h PRO 478 N -1.12 0.57 -0.04 3.99 0.11 -1.99 -0.37 132.00 133.14 2vl4 h PRO 478 Ca -0.45 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 2vl4 h PRO 478 Cb 1.28 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 2vl4 h PRO 478 CO 0.46 0.38 0.02 0.93 -0.21 0.00 0.00 178.00 179.58 2vl4 h GLU 479 N 0.59 0.06 -0.52 1.05 3.07 -1.99 -1.18 114.58 115.66 2vl4 h GLU 479 Ca 0.40 -0.01 -0.12 0.00 -0.50 0.00 0.00 59.36 59.13 2vl4 h GLU 479 Cb 0.71 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.59 2vl4 h GLU 479 CO -0.16 0.16 -0.14 0.28 -1.40 0.00 0.00 179.01 177.76 2vl4 h VAL 480 N -0.05 1.27 -0.87 3.13 2.07 -1.85 -1.48 116.25 118.47 2vl4 h VAL 480 Ca 0.02 -1.30 -0.00 0.00 0.82 0.00 0.00 66.70 66.24 2vl4 h VAL 480 Cb 0.12 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 2vl4 h VAL 480 CO -0.00 0.45 0.53 0.22 0.02 0.00 0.00 177.57 178.80 2vl4 h TYR 481 N 0.89 1.14 -0.64 1.57 3.20 -0.99 -0.59 116.97 121.55 2vl4 h TYR 481 Ca 0.13 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.92 2vl4 h TYR 481 Cb 0.71 -0.38 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 2vl4 h TYR 481 CO 0.05 0.75 0.08 1.96 -1.64 0.00 0.00 178.16 179.37 2vl4 h GLN 482 N 1.20 1.08 -0.74 1.82 1.08 -1.03 -1.00 115.11 117.52 2vl4 h GLN 482 Ca 0.31 -0.30 0.01 0.00 -1.45 0.00 0.00 58.65 57.22 2vl4 h GLN 482 Cb -0.06 -0.12 -0.04 0.00 -0.05 0.00 0.00 27.48 27.21 2vl4 h GLN 482 CO -0.06 1.01 0.49 0.78 -0.95 0.00 0.00 178.83 180.10 2vl4 h GLY 483 N 1.00 1.05 1.03 3.46 0.00 -0.79 -0.27 103.07 108.55 2vl4 h GLY 483 Ca 0.19 -0.39 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 2vl4 h GLY 483 CO 0.02 0.38 0.32 1.41 0.00 0.00 0.00 176.54 178.67 2vl4 h LEU 484 N 1.00 1.01 -0.30 3.11 3.38 -0.67 0.17 115.31 123.02 2vl4 h LEU 484 Ca 0.27 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2vl4 h LEU 484 Cb -0.11 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.36 2vl4 h LEU 484 CO -0.06 0.89 0.10 0.24 0.09 0.00 0.00 178.44 179.70 2vl4 h MET 485 N 1.07 0.46 -0.53 1.13 2.86 -0.76 -0.12 114.93 119.04 2vl4 h MET 485 Ca 0.25 -0.10 -0.09 0.00 -2.06 0.00 0.00 59.70 57.71 2vl4 h MET 485 Cb 0.18 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 2vl4 h MET 485 CO -0.02 0.51 -0.02 1.25 1.06 0.00 0.00 176.91 179.68 2vl4 h HIS 486 N 0.32 0.98 -0.46 -0.22 -0.00 -0.99 -3.00 115.15 111.78 2vl4 h HIS 486 Ca 0.10 -0.16 -0.04 0.00 -0.00 0.00 0.00 60.37 60.27 2vl4 h HIS 486 Cb 0.23 -0.26 -0.02 0.00 -0.00 0.00 0.00 27.41 27.36 2vl4 h HIS 486 CO 0.00 0.89 0.11 0.78 -0.00 0.00 0.00 177.93 179.71 2vl4 h GLY 487 N 0.99 0.75 0.46 5.26 0.00 -0.70 -2.52 103.07 107.31 2vl4 h GLY 487 Ca 0.15 -0.42 0.03 0.00 0.00 0.00 0.00 47.33 47.10 2vl4 h GLY 487 CO 0.03 0.39 -0.21 -1.82 0.00 0.00 0.00 176.54 174.93 2vl4 h TYR 488 N 0.68 -0.56 -0.79 5.60 3.20 -0.88 -2.86 116.97 121.35 2vl4 h TYR 488 Ca 0.15 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.07 2vl4 h TYR 488 Cb 0.26 0.25 -0.05 0.00 1.54 0.00 0.00 36.73 38.74 2vl4 h TYR 488 CO 0.01 -0.29 0.51 -0.44 -1.64 0.00 0.00 178.16 176.31 2vl4 h ASP 489 N -0.32 0.84 -0.92 -2.11 3.32 -1.39 0.07 116.42 115.90 2vl4 h ASP 489 Ca 0.07 -0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.13 2vl4 h ASP 489 Cb 0.41 -0.19 -0.05 0.00 0.22 0.00 0.00 39.33 39.73 2vl4 h ASP 489 CO -0.22 0.58 0.61 0.11 -1.72 0.00 0.00 179.24 178.61 2vl4 h LYS 490 N 0.99 1.21 0.00 3.56 1.57 -1.33 -0.44 116.57 122.14 2vl4 h LYS 490 Ca 0.32 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.98 2vl4 h LYS 490 Cb 0.01 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.04 2vl4 h LYS 490 CO -0.11 0.80 -0.39 1.25 -0.57 0.00 0.00 179.45 180.43 2vl4 h LEU 491 N 1.25 0.00 0.00 2.94 5.85 -1.31 -1.45 115.31 122.59 2vl4 h LEU 491 Ca 0.34 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2vl4 h LEU 491 Cb -0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.89 2vl4 h LEU 491 CO -0.08 0.88 -1.27 0.49 -0.34 0.00 0.00 178.44 178.12 2vl4 n PHE 492 N -4.63 0.65 0.60 1.25 3.72 -0.01 -1.30 117.46 117.75 2vl4 n PHE 492 Ca -0.10 0.19 0.07 0.00 -0.05 0.00 0.00 57.45 57.55 2vl4 n PHE 492 Cb 0.31 -0.79 0.01 0.00 -0.94 0.00 0.00 39.48 38.06 2vl4 n PHE 492 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2vl4 n ARG 493 N -2.50 1.73 0.00 -1.08 1.74 -0.27 -4.41 116.66 111.87 2vl4 n ARG 493 Ca -0.01 -0.81 0.00 0.00 -0.77 0.00 0.00 57.85 56.26 2vl4 n ARG 493 Cb 0.54 -1.20 0.00 0.00 -1.02 0.00 0.00 32.46 30.78 2vl4 n ARG 493 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2vl4 n GLU 494 N -0.04 0.00 0.21 5.56 1.02 -0.62 -4.81 120.64 121.96 2vl4 n GLU 494 Ca 0.06 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 57.05 2vl4 n GLU 494 Cb 0.29 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.64 2vl4 n GLU 494 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2vl4 h LEU 495 N 0.00 -0.69 -0.01 -4.62 5.85 -1.22 -1.70 115.31 112.92 2vl4 h LEU 495 Ca 0.00 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 2vl4 h LEU 495 Cb 0.00 0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 2vl4 h LEU 495 CO 0.00 -0.40 -0.00 -0.07 -0.34 0.00 0.00 178.44 177.63 2vl4 h LEU 496 N -0.60 0.02 -1.32 2.25 3.38 -1.46 -1.08 115.31 116.50 2vl4 h LEU 496 Ca -0.02 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.64 2vl4 h LEU 496 Cb 0.53 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 2vl4 h LEU 496 CO -0.02 0.35 0.47 1.55 0.09 0.00 0.00 178.44 180.88 2vl4 h PRO 497 N -0.31 0.88 -0.29 1.13 0.13 -1.77 -0.41 132.00 131.36 2vl4 h PRO 497 Ca 0.00 -0.05 -0.09 0.00 -0.87 0.00 0.00 66.00 64.99 2vl4 h PRO 497 Cb 0.34 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.26 2vl4 h PRO 497 CO 0.00 0.58 -0.19 0.66 -0.23 0.00 0.00 178.00 178.83 2vl4 h SER 498 N 0.91 0.52 -0.20 1.44 4.64 -1.03 0.86 113.55 120.67 2vl4 h SER 498 Ca 0.28 -0.16 -0.19 0.00 -0.47 0.00 0.00 61.79 61.25 2vl4 h SER 498 Cb -0.01 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 2vl4 h SER 498 CO -0.07 0.72 -0.58 0.74 -0.87 0.00 0.00 176.83 176.77 2vl4 h THR 499 N 0.47 1.28 -0.59 2.95 2.02 -0.47 -1.40 112.91 117.18 2vl4 h THR 499 Ca 0.08 -1.78 -0.06 0.00 0.77 0.00 0.00 66.41 65.42 2vl4 h THR 499 Cb 0.60 1.70 -0.02 0.00 -1.74 0.00 0.00 68.15 68.68 2vl4 h THR 499 CO 0.04 0.57 0.15 0.58 0.37 0.00 0.00 175.52 177.24 2vl4 h VAL 500 N 0.61 1.25 -0.68 3.16 2.07 -0.73 -1.64 116.25 120.29 2vl4 h VAL 500 Ca 0.00 -0.88 0.04 0.00 0.82 0.00 0.00 66.70 66.68 2vl4 h VAL 500 Cb 1.18 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.60 2vl4 h VAL 500 CO 0.12 0.33 0.41 0.50 0.02 0.00 0.00 177.57 178.96 2vl4 h LYS 501 N 0.85 0.77 -0.27 1.57 3.64 -0.53 0.17 116.57 122.77 2vl4 h LYS 501 Ca 0.19 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.46 2vl4 h LYS 501 Cb 0.34 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 2vl4 h LYS 501 CO 0.00 0.51 -0.05 1.49 -2.27 0.00 0.00 179.45 179.13 2vl4 h GLU 502 N 0.80 0.51 0.00 1.90 4.81 -1.06 -3.30 114.58 118.24 2vl4 h GLU 502 Ca 0.28 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2vl4 h GLU 502 Cb 0.06 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.41 2vl4 h GLU 502 CO -0.13 0.71 -1.03 1.19 -0.73 0.00 0.00 179.01 179.03 2vl4 n PHE 503 N -4.54 0.00 -2.98 0.92 3.72 -0.63 -4.66 117.46 109.28 2vl4 n PHE 503 Ca -0.03 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.22 2vl4 n PHE 503 Cb 0.30 -0.11 0.02 0.00 -0.94 0.00 0.00 39.48 38.75 2vl4 n PHE 503 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2vl4 n ASP 504 N -1.57 -0.73 0.12 4.37 2.03 0.03 -4.87 116.55 115.93 2vl4 n ASP 504 Ca 0.01 -3.28 0.12 0.00 0.52 0.00 0.00 54.79 52.16 2vl4 n ASP 504 Cb 0.29 0.56 0.48 0.00 -0.72 0.00 0.00 41.12 41.73 2vl4 n ASP 504 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2vl4 n SER 505 N 0.50 0.69 -1.28 1.67 3.41 -1.22 -1.69 113.62 115.70 2vl4 n SER 505 Ca 0.16 0.65 0.09 0.00 -0.26 0.00 0.00 58.87 59.51 2vl4 n SER 505 Cb 0.66 -0.80 0.30 0.00 -0.26 0.00 0.00 64.21 64.11 2vl4 n SER 505 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2vl4 n ASP 506 N -2.24 4.18 -4.70 4.04 8.00 -1.26 -4.94 116.55 119.63 2vl4 n ASP 506 Ca 0.03 -2.35 -0.35 0.00 0.71 0.00 0.00 54.79 52.83 2vl4 n ASP 506 Cb 0.27 -0.49 -0.09 0.00 -0.02 0.00 0.00 41.12 40.79 2vl4 n ASP 506 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2vl4 s ARG 507 N -1.66 3.00 0.37 -1.24 0.52 -0.68 -5.00 118.95 114.27 2vl4 s ARG 507 Ca 0.44 -0.41 -0.27 0.00 -0.52 0.00 0.00 55.73 54.98 2vl4 s ARG 507 Cb 0.28 -2.82 -0.09 0.00 0.52 0.00 0.00 34.95 32.84 2vl4 s ARG 507 CO 0.22 0.70 1.27 0.12 0.02 0.00 0.00 175.30 177.64 2vl4 s PHE 508 N -0.93 2.97 -0.02 -0.53 5.36 -1.26 -4.89 117.98 118.69 2vl4 s PHE 508 Ca 0.14 1.45 0.05 0.00 -0.96 0.00 0.00 56.93 57.62 2vl4 s PHE 508 Cb -0.11 -3.61 -0.01 0.00 -0.34 0.00 0.00 43.02 38.94 2vl4 s PHE 508 CO 0.04 -1.81 -0.18 -0.47 -1.46 0.00 0.00 175.22 171.33 2vl4 s TYR 509 N -1.24 1.60 0.02 10.12 5.04 -1.26 -1.05 117.35 130.58 2vl4 s TYR 509 Ca 0.54 -0.32 0.06 0.00 -2.44 0.00 0.00 57.07 54.91 2vl4 s TYR 509 Cb -0.37 -1.03 -0.02 0.00 0.35 0.00 0.00 41.96 40.89 2vl4 s TYR 509 CO 0.48 -0.04 -0.17 0.54 -1.34 0.00 0.00 175.55 175.02 2vl4 s VAL 510 N -0.38 1.37 0.35 3.14 0.11 -0.84 -5.00 120.40 119.15 2vl4 s VAL 510 Ca 0.06 -0.92 0.19 0.00 -2.93 0.00 0.00 61.98 58.38 2vl4 s VAL 510 Cb -0.07 -1.18 0.18 0.00 -1.53 0.00 0.00 36.38 33.78 2vl4 s VAL 510 CO -0.00 0.24 1.90 1.12 -3.33 0.00 0.00 175.10 175.03 2vl4 h HIS 511 N 5.29 0.00 -2.44 1.54 2.07 -1.90 0.14 115.15 119.86 2vl4 h HIS 511 Ca -0.38 0.00 0.01 0.00 -2.85 0.00 0.00 60.37 57.15 2vl4 h HIS 511 Cb 1.16 0.00 -0.16 0.00 2.57 0.00 0.00 27.41 30.98 2vl4 h HIS 511 CO 0.46 0.27 0.31 0.45 -3.07 0.00 0.00 177.93 176.34 2vl4 s SER 512 N -6.57 -0.52 -0.14 3.10 0.15 -1.26 -2.85 113.70 105.61 2vl4 s SER 512 Ca -0.02 0.22 0.01 0.00 0.70 0.00 0.00 55.95 56.86 2vl4 s SER 512 Cb 0.13 0.50 0.02 0.00 -1.71 0.00 0.00 66.02 64.97 2vl4 s SER 512 CO 0.67 -0.73 -0.15 -0.55 1.20 0.00 0.00 173.24 173.67 2vl4 s SER 513 N -2.13 2.62 0.33 5.45 0.15 -0.81 -2.51 113.70 116.81 2vl4 s SER 513 Ca -0.01 -0.47 -0.27 0.00 0.70 0.00 0.00 55.95 55.89 2vl4 s SER 513 Cb -0.01 -1.16 -0.09 0.00 -1.71 0.00 0.00 66.02 63.05 2vl4 s SER 513 CO -0.05 -0.03 1.09 -2.16 1.20 0.00 0.00 173.24 173.29 2vl4 s PRO 514 N 1.31 4.44 0.22 5.44 0.04 -1.26 -0.54 135.00 144.65 2vl4 s PRO 514 Ca 0.01 1.70 0.09 0.00 0.04 0.00 0.00 61.00 62.84 2vl4 s PRO 514 Cb -0.14 -2.93 0.16 0.00 0.04 0.00 0.00 34.50 31.64 2vl4 s PRO 514 CO -0.08 0.06 1.50 0.10 0.04 0.00 0.00 177.00 178.62 2vl4 h TYR 515 N 3.28 0.03 0.00 0.56 -0.00 -1.69 -3.43 116.97 115.72 2vl4 h TYR 515 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 58.73 58.24 2vl4 h TYR 515 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.94 2vl4 h TYR 515 CO 0.58 0.76 -0.06 -0.11 -0.00 0.00 0.00 178.16 179.33 2vl4 n LEU 516 N -3.67 0.12 -4.77 0.10 -0.00 -1.26 -4.93 117.00 102.59 2vl4 n LEU 516 Ca -0.01 0.00 -0.40 0.00 -0.00 0.00 0.00 56.01 55.60 2vl4 n LEU 516 Cb 0.72 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 44.15 2vl4 n LEU 516 CO 0.44 -0.13 1.06 0.00 -0.00 0.00 0.00 177.39 178.76 2vl4 s ALA 517 N -1.35 3.34 -0.02 1.96 0.00 -1.25 -5.01 121.76 119.44 2vl4 s ALA 517 Ca 0.00 1.43 0.03 0.00 0.00 0.00 0.00 51.96 53.43 2vl4 s ALA 517 Cb 0.00 -3.57 -0.01 0.00 0.00 0.00 0.00 23.12 19.55 2vl4 s ALA 517 CO 0.00 -1.05 -0.12 1.21 0.00 0.00 0.00 175.76 175.81 2vl4 s ASN 518 N -0.46 1.44 0.55 0.00 3.84 -1.26 -4.73 114.94 114.31 2vl4 s ASN 518 Ca 0.57 -0.22 0.32 0.00 0.21 0.00 0.00 52.86 53.74 2vl4 s ASN 518 Cb -0.43 -0.24 1.53 0.00 -0.55 0.00 0.00 41.25 41.56 2vl4 s ASN 518 CO 0.56 0.13 2.07 4.11 -2.79 0.00 0.00 177.10 181.18 2vl4 h TRP 519 N 6.01 0.00 -0.02 0.43 5.08 -1.96 -1.78 115.95 123.72 2vl4 h TRP 519 Ca -0.33 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.64 2vl4 h TRP 519 Cb 1.17 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.33 2vl4 h TRP 519 CO 0.41 0.08 0.00 0.41 -1.28 0.00 0.00 178.44 178.06 2vl4 n GLY 520 N -0.42 -0.46 2.59 11.11 0.00 -1.26 -4.67 105.19 112.08 2vl4 n GLY 520 Ca -0.01 -0.32 -0.28 0.00 0.00 0.00 0.00 46.02 45.41 2vl4 n GLY 520 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vl4 s ARG 521 N -1.99 1.30 0.61 1.61 0.52 -0.67 -4.97 118.95 115.37 2vl4 s ARG 521 Ca 0.42 -2.26 0.30 0.00 -0.52 0.00 0.00 55.73 53.67 2vl4 s ARG 521 Cb 0.21 -2.08 1.69 0.00 0.52 0.00 0.00 34.95 35.29 2vl4 s ARG 521 CO 0.34 -1.29 2.06 -1.35 0.02 0.00 0.00 175.30 175.08 2vl4 h PRO 522 N 6.03 0.00 0.00 3.54 0.11 -1.83 0.25 132.00 140.10 2vl4 h PRO 522 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2vl4 h PRO 522 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 2vl4 h PRO 522 CO 0.46 0.00 0.00 1.05 -0.21 0.00 0.00 178.00 179.30 2vl4 h GLU 523 N 0.00 0.00 -0.00 1.05 9.09 -1.93 -2.76 114.58 120.03 2vl4 h GLU 523 Ca 0.09 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.50 2vl4 h GLU 523 Cb 0.60 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.70 2vl4 h GLU 523 CO -0.00 0.00 -0.85 -1.13 0.05 0.00 0.00 179.01 177.08 2vl4 n SER 524 N -2.65 0.91 0.26 3.06 3.41 0.08 -4.50 113.62 114.18 2vl4 n SER 524 Ca 0.01 -0.83 0.14 0.00 -0.26 0.00 0.00 58.87 57.93 2vl4 n SER 524 Cb 0.25 0.79 0.66 0.00 -0.26 0.00 0.00 64.21 65.65 2vl4 n SER 524 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 2vl4 h TRP 525 N 0.09 0.00 -0.02 7.33 6.55 -1.58 -1.57 115.95 126.74 2vl4 h TRP 525 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 2vl4 h TRP 525 Cb 0.51 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.81 2vl4 h TRP 525 CO 0.00 0.10 0.00 0.41 -1.05 0.00 0.00 178.44 177.90 2vl4 n GLY 526 N -0.15 -0.84 3.14 1.49 0.00 -1.26 -3.51 105.19 104.06 2vl4 n GLY 526 Ca -0.00 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 2vl4 n GLY 526 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vl4 s THR 527 N -1.97 3.35 0.00 2.61 2.01 -0.59 -0.68 115.64 120.37 2vl4 s THR 527 Ca 0.25 -1.89 0.00 0.00 0.31 0.00 0.00 61.69 60.36 2vl4 s THR 527 Cb 0.12 -3.22 0.00 0.00 0.01 0.00 0.00 72.50 69.41 2vl4 s THR 527 CO 0.19 -0.59 0.00 0.61 -0.69 0.00 0.00 174.62 174.14 2vl4 n GLY 528 N 4.64 0.29 3.89 4.40 0.00 0.02 -3.78 105.19 114.65 2vl4 n GLY 528 Ca -0.05 -0.87 -0.29 0.00 0.00 0.00 0.00 46.02 44.81 2vl4 n GLY 528 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2vl4 s ASP 529 N -4.00 6.49 0.02 1.61 -4.77 -1.26 -3.82 116.67 110.94 2vl4 s ASP 529 Ca 0.00 0.92 0.08 0.00 -3.30 0.00 0.00 52.55 50.25 2vl4 s ASP 529 Cb 0.00 -2.23 -0.02 0.00 -1.09 0.00 0.00 42.92 39.58 2vl4 s ASP 529 CO 0.00 -0.29 -0.23 -0.44 0.70 0.00 0.00 175.17 174.91 2vl4 s SER 530 N -3.14 2.75 -0.80 2.11 0.01 0.04 -4.16 113.70 110.52 2vl4 s SER 530 Ca 0.47 -0.50 -0.11 0.00 1.31 0.00 0.00 55.95 57.12 2vl4 s SER 530 Cb -0.10 -0.27 0.21 0.00 0.21 0.00 0.00 66.02 66.07 2vl4 s SER 530 CO 0.30 0.24 0.71 -1.00 0.41 0.00 0.00 173.24 173.90 2vl4 s HIS 531 N -0.70 3.71 -0.89 2.43 3.76 -1.26 -1.53 115.29 120.82 2vl4 s HIS 531 Ca 0.09 -2.18 -0.24 0.00 -0.15 0.00 0.00 55.06 52.58 2vl4 s HIS 531 Cb -0.09 -3.69 0.05 0.00 1.11 0.00 0.00 32.58 29.97 2vl4 s HIS 531 CO 0.01 -0.95 1.32 1.21 -0.85 0.00 0.00 174.74 175.47 2vl4 s ASN 532 N 1.79 6.37 -0.32 1.40 2.47 -0.51 -4.47 114.94 121.67 2vl4 s ASN 532 Ca 0.18 -1.13 0.08 0.00 0.42 0.00 0.00 52.86 52.41 2vl4 s ASN 532 Cb -0.12 -2.54 0.69 0.00 -1.45 0.00 0.00 41.25 37.83 2vl4 s ASN 532 CO -0.08 -1.57 1.76 0.79 -3.72 0.00 0.00 177.10 174.28 2vl4 n TRP 533 N 8.72 2.41 -0.01 0.43 7.02 -1.26 -4.19 117.44 130.56 2vl4 n TRP 533 Ca 0.19 -1.23 -0.11 0.00 -1.02 0.00 0.00 57.50 55.33 2vl4 n TRP 533 Cb 0.50 -0.70 -0.05 0.00 -2.42 0.00 0.00 31.31 28.64 2vl4 n TRP 533 CO 0.00 0.00 0.00 0.78 -2.02 0.00 0.00 177.69 176.45 2vl4 h GLY 534 N 2.63 0.17 -4.11 6.99 0.00 -1.86 -1.10 103.07 105.78 2vl4 h GLY 534 Ca 0.30 -0.07 -0.52 0.00 0.00 0.00 0.00 47.33 47.05 2vl4 h GLY 534 CO 0.75 0.07 0.60 0.14 0.00 0.00 0.00 176.54 178.10 2vl4 s VAL 535 N -6.04 3.27 0.00 4.60 1.01 -1.26 -1.10 120.40 120.88 2vl4 s VAL 535 Ca -0.13 1.11 0.00 0.00 0.00 0.00 0.00 61.98 62.95 2vl4 s VAL 535 Cb 0.07 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.75 2vl4 s VAL 535 CO 0.68 0.20 0.00 1.87 0.00 0.00 0.00 175.10 177.85 2vl4 n TRP 536 N 2.13 0.00 -0.30 5.22 -0.00 -1.26 -4.52 117.44 118.71 2vl4 n TRP 536 Ca 0.04 0.00 0.03 0.00 -0.00 0.00 0.00 57.50 57.57 2vl4 n TRP 536 Cb 0.43 0.00 0.23 0.00 -0.00 0.00 0.00 31.31 31.97 2vl4 n TRP 536 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 177.69 179.57 2vl4 h TYR 537 N 0.00 1.05 -0.22 5.87 0.05 -1.67 -1.75 116.97 120.30 2vl4 h TYR 537 Ca 0.00 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.81 2vl4 h TYR 537 Cb 0.00 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 37.39 2vl4 h TYR 537 CO 0.00 0.58 0.00 0.41 -1.05 0.00 0.00 178.16 178.10 2vl4 n GLY 538 N -1.40 0.52 2.77 3.88 0.00 -0.45 -4.93 105.19 105.58 2vl4 n GLY 538 Ca 0.13 -0.46 -0.06 0.00 0.00 0.00 0.00 46.02 45.63 2vl4 n GLY 538 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2vl4 n LYS 539 N 0.50 -1.82 -2.06 1.61 5.02 -0.66 -4.89 118.16 115.86 2vl4 n LYS 539 Ca 0.16 0.66 -0.39 0.00 -2.02 0.00 0.00 58.31 56.72 2vl4 n LYS 539 Cb 0.36 -4.98 -0.00 0.00 -0.02 0.00 0.00 35.03 30.38 2vl4 n LYS 539 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2vl4 s LYS 540 N -2.37 3.96 0.79 1.97 1.02 -0.26 -4.87 119.74 119.99 2vl4 s LYS 540 Ca 0.00 2.14 -0.11 0.00 0.02 0.00 0.00 55.97 58.02 2vl4 s LYS 540 Cb 0.00 -2.75 0.07 0.00 -0.52 0.00 0.00 37.83 34.63 2vl4 s LYS 540 CO 0.00 -0.49 1.11 -1.25 -0.92 0.00 0.00 175.35 173.79 2vl4 s PRO 541 N -2.25 2.04 0.59 -1.68 0.04 -1.26 -4.42 135.00 128.05 2vl4 s PRO 541 Ca 0.57 1.27 0.29 0.00 0.04 0.00 0.00 61.00 63.18 2vl4 s PRO 541 Cb -0.38 -1.86 1.78 0.00 0.04 0.00 0.00 34.50 34.08 2vl4 s PRO 541 CO 0.48 -1.82 2.22 0.74 0.04 0.00 0.00 177.00 178.66 2vl4 h PHE 542 N -1.18 0.00 0.00 0.56 0.04 -1.94 -0.29 116.94 114.13 2vl4 h PHE 542 Ca -0.44 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.32 2vl4 h PHE 542 Cb 1.24 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.39 2vl4 h PHE 542 CO 0.56 0.00 -0.07 0.93 -0.60 0.00 0.00 178.31 179.13 2vl4 h GLU 543 N 0.00 0.00 -0.10 1.51 3.07 -1.93 -1.68 114.58 115.45 2vl4 h GLU 543 Ca 0.02 0.00 0.03 0.00 -0.50 0.00 0.00 59.36 58.91 2vl4 h GLU 543 Cb 0.10 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.01 2vl4 h GLU 543 CO -0.00 0.07 0.13 0.66 -1.40 0.00 0.00 179.01 178.47 2vl4 h SER 544 N 0.00 0.00 1.06 1.42 4.64 -1.38 -1.91 113.55 117.38 2vl4 h SER 544 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2vl4 h SER 544 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 2vl4 h SER 544 CO 0.01 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 175.90 2vl4 h LEU 545 N 0.00 0.00 -0.44 5.97 3.38 -1.48 0.88 115.31 123.63 2vl4 h LEU 545 Ca 0.05 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 2vl4 h LEU 545 Cb 0.31 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2vl4 h LEU 545 CO -0.00 0.00 -0.51 0.44 0.09 0.00 0.00 178.44 178.46 2vl4 h ASP 546 N 0.00 0.00 0.00 -0.43 3.32 -1.53 -3.37 116.42 114.42 2vl4 h ASP 546 Ca 0.00 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.82 2vl4 h ASP 546 Cb 0.53 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.04 2vl4 h ASP 546 CO 0.00 0.51 -1.94 0.35 -1.72 0.00 0.00 179.24 176.43 2vl4 n THR 547 N -3.39 0.86 -3.26 0.35 -2.24 -0.81 -4.83 114.28 100.96 2vl4 n THR 547 Ca 0.01 -0.57 -0.45 0.00 -2.27 0.00 0.00 64.05 60.77 2vl4 n THR 547 Cb 0.65 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 2vl4 n THR 547 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2vl4 n ASP 548 N -2.47 5.57 -4.81 3.42 8.00 0.24 -5.03 116.55 121.48 2vl4 n ASP 548 Ca -0.21 -3.06 -0.38 0.00 0.71 0.00 0.00 54.79 51.85 2vl4 n ASP 548 Cb 0.89 -1.39 -0.06 0.00 -0.02 0.00 0.00 41.12 40.54 2vl4 n ASP 548 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2vl4 s LEU 549 N -1.10 4.42 0.41 0.64 1.43 -1.26 -4.84 118.68 118.37 2vl4 s LEU 549 Ca 0.32 0.90 0.08 0.00 -1.03 0.00 0.00 54.13 54.40 2vl4 s LEU 549 Cb -0.08 -2.58 0.01 0.00 0.03 0.00 0.00 46.19 43.56 2vl4 s LEU 549 CO -0.06 0.26 0.56 -2.16 0.23 0.00 0.00 176.35 175.18 2vl4 s PRO 550 N -0.68 2.88 0.24 1.29 0.04 -1.26 -4.68 135.00 132.83 2vl4 s PRO 550 Ca 0.23 -1.18 0.11 0.00 0.04 0.00 0.00 61.00 60.20 2vl4 s PRO 550 Cb -0.16 -2.76 0.20 0.00 0.04 0.00 0.00 34.50 31.81 2vl4 s PRO 550 CO 0.12 -0.22 1.51 0.00 0.04 0.00 0.00 177.00 178.45 2vl4 h ARG 551 N 0.67 0.00 -1.98 4.56 2.47 -1.66 -3.34 114.38 115.11 2vl4 h ARG 551 Ca -0.41 0.00 0.04 0.00 -1.26 0.00 0.00 59.98 58.35 2vl4 h ARG 551 Cb 1.28 0.00 -0.21 0.00 -1.65 0.00 0.00 29.97 29.39 2vl4 h ARG 551 CO 0.47 0.68 -0.00 0.12 0.56 0.00 0.00 179.97 181.80 2vl4 s PHE 552 N -3.24 -1.12 -0.62 3.04 5.36 -1.25 -1.02 117.98 119.14 2vl4 s PHE 552 Ca 0.00 2.15 -0.20 0.00 -0.96 0.00 0.00 56.93 57.93 2vl4 s PHE 552 Cb 0.11 0.67 0.10 0.00 -0.34 0.00 0.00 43.02 43.56 2vl4 s PHE 552 CO 0.77 -0.55 0.77 1.41 -1.46 0.00 0.00 175.22 176.15 2vl4 s MET 553 N 1.94 3.08 0.24 10.12 -2.45 0.27 -0.78 119.30 131.71 2vl4 s MET 553 Ca -0.09 -1.26 0.24 0.00 -1.25 0.00 0.00 55.69 53.33 2vl4 s MET 553 Cb -0.07 -4.28 0.39 0.00 1.25 0.00 0.00 34.83 32.12 2vl4 s MET 553 CO -0.20 -1.60 1.45 0.66 1.05 0.00 0.00 175.02 176.38 2vl4 h SER 554 N 9.23 0.00 -3.60 1.11 4.64 -1.51 0.24 113.55 123.66 2vl4 h SER 554 Ca -0.27 -0.07 -0.11 0.00 -0.47 0.00 0.00 61.79 60.87 2vl4 h SER 554 Cb 1.08 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.92 2vl4 h SER 554 CO 1.11 0.03 -0.22 -1.61 -0.87 0.00 0.00 176.83 175.27 2vl4 s GLU 555 N -3.20 0.48 0.10 4.77 2.02 -1.06 -4.63 118.70 117.17 2vl4 s GLU 555 Ca 0.06 0.71 -0.25 0.00 0.02 0.00 0.00 54.97 55.51 2vl4 s GLU 555 Cb 0.10 0.14 0.08 0.00 0.10 0.00 0.00 34.13 34.55 2vl4 s GLU 555 CO 0.69 -0.10 0.66 -0.59 0.02 0.00 0.00 175.26 175.94 2vl4 s PHE 556 N 0.74 -0.53 0.04 1.61 -0.12 -1.25 -1.43 117.98 117.04 2vl4 s PHE 556 Ca -0.04 0.46 -0.28 0.00 -0.05 0.00 0.00 56.93 57.01 2vl4 s PHE 556 Cb -0.05 0.53 0.10 0.00 -0.63 0.00 0.00 43.02 42.97 2vl4 s PHE 556 CO -0.05 -0.76 1.19 0.20 -0.05 0.00 0.00 175.22 175.75 2vl4 s GLY 557 N -2.41 -0.33 -0.24 1.99 0.00 -1.26 -0.07 107.32 105.00 2vl4 s GLY 557 Ca -0.01 0.46 -0.20 0.00 0.00 0.00 0.00 44.72 44.97 2vl4 s GLY 557 CO -0.08 0.48 0.62 -0.12 0.00 0.00 0.00 173.10 174.00 2vl4 s PHE 558 N -2.62 -0.73 0.50 1.90 5.36 -1.26 -4.46 117.98 116.67 2vl4 s PHE 558 Ca 0.15 1.71 -0.16 0.00 -0.96 0.00 0.00 56.93 57.67 2vl4 s PHE 558 Cb 0.03 0.28 -0.08 0.00 -0.34 0.00 0.00 43.02 42.91 2vl4 s PHE 558 CO -0.02 -0.35 0.96 -0.65 -1.46 0.00 0.00 175.22 173.70 2vl4 s GLN 559 N 0.54 3.95 -0.02 10.12 -0.21 -1.26 -4.32 119.66 128.46 2vl4 s GLN 559 Ca -0.02 0.92 -0.06 0.00 0.02 0.00 0.00 55.36 56.22 2vl4 s GLN 559 Cb -0.05 -2.16 0.01 0.00 1.00 0.00 0.00 33.01 31.81 2vl4 s GLN 559 CO -0.02 -0.23 0.13 -1.54 -2.12 0.00 0.00 175.29 171.51 2vl4 s SER 560 N -3.02 -0.04 0.32 5.90 1.04 -0.17 -4.73 113.70 113.00 2vl4 s SER 560 Ca 0.58 -0.02 -0.29 0.00 0.48 0.00 0.00 55.95 56.70 2vl4 s SER 560 Cb -0.10 0.24 -0.11 0.00 0.10 0.00 0.00 66.02 66.16 2vl4 s SER 560 CO 0.30 -0.24 1.47 -0.36 0.98 0.00 0.00 173.24 175.39 2vl4 s PHE 561 N -0.80 2.81 0.87 5.02 0.08 -1.26 -2.89 117.98 121.81 2vl4 s PHE 561 Ca -0.09 1.09 -0.11 0.00 0.12 0.00 0.00 56.93 57.94 2vl4 s PHE 561 Cb -0.05 -3.92 0.11 0.00 -0.57 0.00 0.00 43.02 38.59 2vl4 s PHE 561 CO 0.01 -2.85 1.09 -1.25 -0.10 0.00 0.00 175.22 172.12 2vl4 s PRO 562 N -1.28 1.45 1.11 0.24 0.04 -1.26 -4.70 135.00 130.59 2vl4 s PRO 562 Ca 0.56 0.99 -0.13 0.00 0.04 0.00 0.00 61.00 62.47 2vl4 s PRO 562 Cb -0.44 -1.82 0.25 0.00 0.04 0.00 0.00 34.50 32.53 2vl4 s PRO 562 CO 0.53 -2.16 1.05 -1.83 0.04 0.00 0.00 177.00 174.64 2vl4 s GLU 563 N -4.88 -0.47 0.28 4.56 -1.05 -1.26 -4.58 118.70 111.30 2vl4 s GLU 563 Ca 0.63 0.78 -0.02 0.00 -0.15 0.00 0.00 54.97 56.21 2vl4 s GLU 563 Cb -0.18 -1.61 0.42 0.00 -0.44 0.00 0.00 34.13 32.32 2vl4 s GLU 563 CO 0.57 -3.41 1.93 0.52 0.95 0.00 0.00 175.26 175.83 2vl4 h MET 564 N -2.39 1.12 0.00 -4.83 2.86 -1.95 -1.26 114.93 108.49 2vl4 h MET 564 Ca -0.59 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 56.96 2vl4 h MET 564 Cb 1.33 -0.25 -0.00 0.00 0.06 0.00 0.00 31.60 32.73 2vl4 h MET 564 CO 0.52 0.74 -0.09 1.57 1.06 0.00 0.00 176.91 180.71 2vl4 h LYS 565 N 1.16 0.00 0.07 1.72 2.10 -1.91 0.16 116.57 119.87 2vl4 h LYS 565 Ca 0.36 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.87 2vl4 h LYS 565 Cb -0.00 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.34 2vl4 h LYS 565 CO -0.11 0.09 -0.59 1.15 -2.00 0.00 0.00 179.45 178.00 2vl4 h THR 566 N 0.00 1.54 -0.79 0.07 2.02 -1.59 -2.96 112.91 111.20 2vl4 h THR 566 Ca -0.00 -2.33 0.15 0.00 0.77 0.00 0.00 66.41 65.00 2vl4 h THR 566 Cb 0.19 3.03 -0.10 0.00 -1.74 0.00 0.00 68.15 69.54 2vl4 h THR 566 CO 0.01 0.65 0.35 0.40 0.37 0.00 0.00 175.52 177.30 2vl4 h ILE 567 N -0.41 0.67 0.00 3.11 2.04 -1.07 -1.37 117.51 120.48 2vl4 h ILE 567 Ca -0.09 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 2vl4 h ILE 567 Cb 1.40 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.61 2vl4 h ILE 567 CO 0.11 0.09 -0.04 0.00 0.00 0.00 0.00 178.15 178.32 2vl4 h ALA 568 N 1.56 1.32 0.00 1.87 0.00 -0.71 -0.44 119.26 122.87 2vl4 h ALA 568 Ca 0.44 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2vl4 h ALA 568 Cb 0.66 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2vl4 h ALA 568 CO -0.40 0.05 0.00 0.00 0.00 0.00 0.00 179.25 178.90 2vl4 h ALA 569 N 1.96 1.00 -0.00 0.00 0.00 -1.07 -3.30 119.26 117.85 2vl4 h ALA 569 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2vl4 h ALA 569 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2vl4 h ALA 569 CO 0.00 0.00 -0.04 1.97 0.00 0.00 0.00 179.25 181.19 2vl4 n PHE 570 N -2.93 0.00 -4.11 0.00 1.16 -0.75 -4.74 117.46 106.08 2vl4 n PHE 570 Ca 0.02 0.00 -0.15 0.00 -1.87 0.00 0.00 57.45 55.45 2vl4 n PHE 570 Cb 0.36 0.00 -0.14 0.00 -1.61 0.00 0.00 39.48 38.09 2vl4 n PHE 570 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2vl4 s ALA 571 N -0.91 0.41 0.61 1.98 0.00 -0.25 0.13 121.76 123.74 2vl4 s ALA 571 Ca 0.01 -0.29 -0.12 0.00 0.00 0.00 0.00 51.96 51.55 2vl4 s ALA 571 Cb 0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 2vl4 s ALA 571 CO 0.04 0.07 1.03 0.00 0.00 0.00 0.00 175.76 176.90 2vl4 s ALA 572 N -0.32 2.98 0.55 0.00 0.00 -1.26 -4.45 121.76 119.26 2vl4 s ALA 572 Ca -0.00 0.03 0.21 0.00 0.00 0.00 0.00 51.96 52.20 2vl4 s ALA 572 Cb -0.03 -3.12 1.47 0.00 0.00 0.00 0.00 23.12 21.44 2vl4 s ALA 572 CO -0.00 -0.72 2.18 -1.35 0.00 0.00 0.00 175.76 175.86 2vl4 h PRO 573 N -0.12 0.00 0.00 0.00 0.11 -1.98 0.15 132.00 130.16 2vl4 h PRO 573 Ca -0.45 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 2vl4 h PRO 573 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 2vl4 h PRO 573 CO 0.61 0.00 -0.00 0.93 -0.21 0.00 0.00 178.00 179.32 2vl4 h GLU 574 N 0.00 0.00 -0.15 1.05 3.07 -2.05 -3.15 114.58 113.34 2vl4 h GLU 574 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2vl4 h GLU 574 Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 2vl4 h GLU 574 CO -0.00 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.36 2vl4 n ASP 575 N -3.09 2.40 -2.91 1.42 8.00 0.53 -4.53 116.55 118.38 2vl4 n ASP 575 Ca -0.02 -1.70 0.00 0.00 0.71 0.00 0.00 54.79 53.78 2vl4 n ASP 575 Cb 0.14 -0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 2vl4 n ASP 575 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2vl4 n TYR 576 N 0.67 0.00 -4.54 1.24 4.02 -1.19 -4.11 117.16 113.26 2vl4 n TYR 576 Ca 0.09 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.71 2vl4 n TYR 576 Cb 0.36 -0.17 -0.10 0.00 -0.02 0.00 0.00 39.34 39.41 2vl4 n TYR 576 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 2vl4 s GLN 577 N 0.30 2.02 0.20 -0.72 -1.52 -1.26 -4.84 119.66 113.84 2vl4 s GLN 577 Ca 0.00 -2.08 -0.12 0.00 -1.95 0.00 0.00 55.36 51.21 2vl4 s GLN 577 Cb 0.00 -1.70 0.12 0.00 -0.22 0.00 0.00 33.01 31.22 2vl4 s GLN 577 CO 0.00 -0.08 1.86 0.82 -0.25 0.00 0.00 175.29 177.64 2vl4 h ILE 578 N 1.68 1.17 -0.29 1.08 2.04 -1.98 -2.96 117.51 118.25 2vl4 h ILE 578 Ca -0.44 -0.32 -0.14 0.00 1.00 0.00 0.00 64.86 64.97 2vl4 h ILE 578 Cb 1.25 0.19 -0.08 0.00 -0.74 0.00 0.00 36.82 37.43 2vl4 h ILE 578 CO 0.79 0.17 -0.11 -0.62 0.00 0.00 0.00 178.15 178.37 2vl4 n GLU 579 N -4.61 1.91 -0.86 2.37 -0.58 -1.26 -4.39 120.64 113.22 2vl4 n GLU 579 Ca 0.06 -3.14 -0.31 0.00 -0.42 0.00 0.00 57.16 53.35 2vl4 n GLU 579 Cb 0.02 -1.79 0.15 0.00 -0.57 0.00 0.00 31.44 29.25 2vl4 n GLU 579 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2vl4 s SER 580 N -2.56 3.30 0.01 1.62 1.04 -1.12 -4.77 113.70 111.21 2vl4 s SER 580 Ca 0.43 2.05 -0.25 0.00 0.48 0.00 0.00 55.95 58.67 2vl4 s SER 580 Cb 0.39 -2.54 -0.18 0.00 0.10 0.00 0.00 66.02 63.79 2vl4 s SER 580 CO 0.00 -2.84 1.31 -0.08 0.98 0.00 0.00 173.24 172.61 2vl4 h GLU 581 N -1.69 -0.16 0.00 4.02 4.81 -1.92 0.30 114.58 119.94 2vl4 h GLU 581 Ca -0.44 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 2vl4 h GLU 581 Cb 1.26 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.68 2vl4 h GLU 581 CO 0.45 0.18 0.00 0.28 -0.73 0.00 0.00 179.01 179.19 2vl4 n VAL 582 N -5.00 0.00 0.00 0.32 0.31 -1.26 -1.46 118.33 111.24 2vl4 n VAL 582 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 2vl4 n VAL 582 Cb 0.22 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.15 2vl4 n VAL 582 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 2vl4 n MET 583 N 0.00 0.00 -0.29 5.55 0.00 -1.24 -2.91 117.12 118.23 2vl4 n MET 583 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.70 57.78 2vl4 n MET 583 Cb 0.00 0.00 0.23 0.00 0.00 0.00 0.00 33.22 33.45 2vl4 n MET 583 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 2vl4 n ASN 584 N 0.00 2.83 0.07 6.12 5.03 0.11 -0.54 115.26 128.87 2vl4 n ASN 584 Ca 0.00 -2.06 0.08 0.00 0.87 0.00 0.00 54.58 53.47 2vl4 n ASN 584 Cb 0.00 -0.36 0.36 0.00 -1.02 0.00 0.00 39.78 38.76 2vl4 n ASN 584 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2vl4 n ALA 585 N 0.92 1.46 -1.39 5.41 0.00 -0.53 -3.53 120.51 122.85 2vl4 n ALA 585 Ca 0.17 0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.73 2vl4 n ALA 585 Cb 0.47 -1.26 0.15 0.00 0.00 0.00 0.00 19.45 18.81 2vl4 n ALA 585 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2vl4 n HIS 586 N -1.86 0.00 -3.73 0.00 8.25 0.29 -4.85 115.22 113.32 2vl4 n HIS 586 Ca 0.02 -1.11 -0.29 0.00 -0.26 0.00 0.00 57.72 56.08 2vl4 n HIS 586 Cb 0.14 -0.18 -0.16 0.00 1.12 0.00 0.00 29.99 30.91 2vl4 n HIS 586 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2vl4 s GLN 587 N -2.73 0.69 0.00 -0.41 2.00 -1.22 -1.13 119.66 116.86 2vl4 s GLN 587 Ca 0.33 -0.70 0.24 0.00 -2.00 0.00 0.00 55.36 53.23 2vl4 s GLN 587 Cb 0.30 -2.02 0.53 0.00 0.80 0.00 0.00 33.01 32.63 2vl4 s GLN 587 CO -0.02 -0.80 1.45 1.63 -0.50 0.00 0.00 175.29 177.05 2vl4 n LYS 588 N 4.97 2.13 -4.23 1.67 4.76 -1.26 -4.81 118.16 121.39 2vl4 n LYS 588 Ca -0.06 -1.66 -0.20 0.00 -2.87 0.00 0.00 58.31 53.51 2vl4 n LYS 588 Cb 0.45 -1.47 -0.12 0.00 -1.84 0.00 0.00 35.03 32.05 2vl4 n LYS 588 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2vl4 s SER 589 N -1.82 2.09 0.00 4.39 1.04 -1.23 -4.67 113.70 113.50 2vl4 s SER 589 Ca 0.33 -0.69 0.11 0.00 0.48 0.00 0.00 55.95 56.19 2vl4 s SER 589 Cb 0.20 -0.09 -0.03 0.00 0.10 0.00 0.00 66.02 66.21 2vl4 s SER 589 CO 0.31 -0.04 0.65 -1.54 0.98 0.00 0.00 173.24 173.59 2vl4 n SER 590 N 1.02 1.16 0.00 7.02 3.41 -1.26 -2.36 113.62 122.61 2vl4 n SER 590 Ca -0.19 -1.08 0.00 0.00 -0.26 0.00 0.00 58.87 57.34 2vl4 n SER 590 Cb 0.55 0.57 0.00 0.00 -0.26 0.00 0.00 64.21 65.07 2vl4 n SER 590 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2vl4 n ILE 591 N -0.42 0.00 -0.00 -1.33 3.06 -1.26 -4.88 119.36 114.53 2vl4 n ILE 591 Ca 0.04 0.00 -0.13 0.00 -2.50 0.00 0.00 62.75 60.16 2vl4 n ILE 591 Cb 0.23 0.00 -0.10 0.00 0.54 0.00 0.00 39.64 40.31 2vl4 n ILE 591 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 2vl4 h GLY 592 N 0.00 -0.05 0.97 4.50 0.00 -1.89 -2.64 103.07 103.96 2vl4 h GLY 592 Ca 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.33 2vl4 h GLY 592 CO 0.00 -0.02 0.22 3.43 0.00 0.00 0.00 176.54 180.17 2vl4 h ASN 593 N -0.58 0.61 -0.73 0.19 2.35 -1.90 -1.42 115.58 114.09 2vl4 h ASN 593 Ca -0.00 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.59 2vl4 h ASN 593 Cb 0.53 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.71 2vl4 h ASN 593 CO 0.01 0.57 0.35 0.77 -1.65 0.00 0.00 177.43 177.47 2vl4 h SER 594 N 0.60 0.96 -0.61 5.81 4.64 -1.94 -2.63 113.55 120.38 2vl4 h SER 594 Ca 0.16 -0.14 0.03 0.00 -0.47 0.00 0.00 61.79 61.38 2vl4 h SER 594 Cb 0.13 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 61.93 2vl4 h SER 594 CO -0.02 0.83 0.36 0.25 -0.87 0.00 0.00 176.83 177.38 2vl4 h LEU 595 N 1.03 0.57 0.05 5.97 5.85 -1.05 -1.13 115.31 126.60 2vl4 h LEU 595 Ca 0.25 0.01 0.02 0.00 0.84 0.00 0.00 57.88 59.00 2vl4 h LEU 595 Cb 0.13 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2vl4 h LEU 595 CO -0.03 0.40 -0.13 0.40 -0.34 0.00 0.00 178.44 178.73 2vl4 h ILE 596 N 0.70 0.68 -0.44 4.05 2.04 -0.92 -0.70 117.51 122.93 2vl4 h ILE 596 Ca 0.25 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.20 2vl4 h ILE 596 Cb 0.06 0.68 -0.08 0.00 -0.74 0.00 0.00 36.82 36.74 2vl4 h ILE 596 CO -0.12 0.00 -0.10 -0.09 0.00 0.00 0.00 178.15 177.84 2vl4 h ARG 597 N -0.25 0.01 -0.25 2.37 2.43 -1.32 0.98 114.38 118.35 2vl4 h ARG 597 Ca 0.03 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.24 2vl4 h ARG 597 Cb 0.28 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.79 2vl4 h ARG 597 CO -0.10 0.00 0.02 1.15 -1.51 0.00 0.00 179.97 179.53 2vl4 h THR 598 N 0.01 0.84 -0.33 0.20 2.02 -0.89 -0.56 112.91 114.19 2vl4 h THR 598 Ca 0.21 -0.03 -0.15 0.00 0.77 0.00 0.00 66.41 67.21 2vl4 h THR 598 Cb 0.32 0.73 -0.00 0.00 -1.74 0.00 0.00 68.15 67.46 2vl4 h THR 598 CO -0.45 0.02 -0.39 1.88 0.37 0.00 0.00 175.52 176.95 2vl4 h TYR 599 N 0.10 1.02 -0.91 3.16 -1.99 -0.87 -3.15 116.97 114.33 2vl4 h TYR 599 Ca 0.12 -0.32 0.06 0.00 2.00 0.00 0.00 58.73 60.59 2vl4 h TYR 599 Cb 0.14 -0.21 -0.06 0.00 2.00 0.00 0.00 36.73 38.60 2vl4 h TYR 599 CO -0.19 1.13 0.58 1.98 -0.00 0.00 0.00 178.16 181.66 2vl4 h MET 600 N 0.63 1.02 0.00 4.88 4.05 -0.47 -1.84 114.93 123.19 2vl4 h MET 600 Ca 0.04 -0.06 -0.04 0.00 -0.28 0.00 0.00 59.70 59.37 2vl4 h MET 600 Cb 0.98 -0.23 -0.01 0.00 -0.80 0.00 0.00 31.60 31.55 2vl4 h MET 600 CO 0.09 0.67 -0.17 1.49 0.23 0.00 0.00 176.91 179.22 2vl4 h GLU 601 N 1.05 0.00 0.00 0.39 4.22 -1.07 0.67 114.58 119.84 2vl4 h GLU 601 Ca 0.40 0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.80 2vl4 h GLU 601 Cb 0.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2vl4 h GLU 601 CO -0.17 0.17 -0.17 0.00 -2.18 0.00 0.00 179.01 176.66 2vl4 h ARG 602 N 0.00 0.00 0.00 1.92 3.08 -1.33 -3.37 114.38 114.69 2vl4 h ARG 602 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2vl4 h ARG 602 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2vl4 h ARG 602 CO 0.02 0.17 -0.18 -0.25 -1.07 0.00 0.00 179.97 178.67 2vl4 n ASP 603 N -4.24 0.89 -4.15 7.04 8.00 -0.92 -4.97 116.55 118.19 2vl4 n ASP 603 Ca -0.02 -0.18 -0.11 0.00 0.71 0.00 0.00 54.79 55.19 2vl4 n ASP 603 Cb 0.24 0.53 -0.10 0.00 -0.02 0.00 0.00 41.12 41.77 2vl4 n ASP 603 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2vl4 s TYR 604 N -0.71 0.86 -0.06 1.24 2.02 0.18 -0.61 117.35 120.27 2vl4 s TYR 604 Ca 0.00 -0.85 -0.30 0.00 -0.37 0.00 0.00 57.07 55.55 2vl4 s TYR 604 Cb 0.00 -0.50 -0.02 0.00 -0.40 0.00 0.00 41.96 41.04 2vl4 s TYR 604 CO 0.00 -0.14 1.07 0.42 -1.57 0.00 0.00 175.55 175.33 2vl4 s ILE 605 N -3.29 4.58 -0.25 2.71 1.01 -1.26 -4.29 121.20 120.41 2vl4 s ILE 605 Ca 0.09 1.87 -0.29 0.00 0.00 0.00 0.00 60.65 62.31 2vl4 s ILE 605 Cb 0.03 -4.20 -0.02 0.00 0.01 0.00 0.00 42.46 38.28 2vl4 s ILE 605 CO -0.04 0.04 1.53 -0.63 0.00 0.00 0.00 174.94 175.84 2vl4 s ILE 606 N 1.79 3.82 0.60 2.92 1.09 -1.26 -4.99 121.20 125.16 2vl4 s ILE 606 Ca 0.52 0.92 -0.18 0.00 -1.10 0.00 0.00 60.65 60.82 2vl4 s ILE 606 Cb -0.22 -3.84 -0.03 0.00 -1.06 0.00 0.00 42.46 37.31 2vl4 s ILE 606 CO 0.22 -0.35 1.15 -2.84 -0.10 0.00 0.00 174.94 173.02 2vl4 s PRO 607 N 4.54 3.03 0.14 2.79 0.02 -1.26 -4.97 135.00 139.30 2vl4 s PRO 607 Ca 0.67 1.64 -0.02 0.00 0.02 0.00 0.00 61.00 63.32 2vl4 s PRO 607 Cb -0.22 -1.96 -0.06 0.00 0.02 0.00 0.00 34.50 32.27 2vl4 s PRO 607 CO 0.28 -1.12 1.33 0.93 -0.33 0.00 0.00 177.00 178.09 2vl4 h GLU 608 N 0.75 0.32 -6.54 5.54 5.08 -1.95 -3.43 114.58 114.36 2vl4 h GLU 608 Ca -0.49 -0.35 -0.52 0.00 -1.00 0.00 0.00 59.36 56.99 2vl4 h GLU 608 Cb 1.27 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.59 2vl4 h GLU 608 CO 0.55 1.05 0.03 -1.54 -1.00 0.00 0.00 179.01 178.10 2vl4 s SER 609 N -7.02 6.88 0.18 1.42 1.04 -1.26 -4.99 113.70 109.94 2vl4 s SER 609 Ca -0.05 1.24 -0.13 0.00 0.48 0.00 0.00 55.95 57.49 2vl4 s SER 609 Cb 0.09 -2.35 0.10 0.00 0.10 0.00 0.00 66.02 63.96 2vl4 s SER 609 CO 0.85 -0.03 1.82 0.15 0.98 0.00 0.00 173.24 177.01 2vl4 h PHE 610 N 3.03 0.61 -0.92 5.02 3.57 -1.88 -0.66 116.94 125.71 2vl4 h PHE 610 Ca -0.48 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.08 2vl4 h PHE 610 Cb 1.19 -0.20 -0.06 0.00 2.79 0.00 0.00 35.95 39.67 2vl4 h PHE 610 CO 0.63 0.36 0.60 0.93 -2.23 0.00 0.00 178.31 178.60 2vl4 h GLU 611 N 0.65 1.09 0.02 1.11 3.07 -1.94 0.39 114.58 118.96 2vl4 h GLU 611 Ca 0.21 -0.07 -0.22 0.00 -0.50 0.00 0.00 59.36 58.78 2vl4 h GLU 611 Cb -0.00 -0.25 -0.00 0.00 -0.84 0.00 0.00 28.75 27.66 2vl4 h GLU 611 CO -0.08 0.72 -0.96 -0.44 -1.40 0.00 0.00 179.01 176.85 2vl4 h ASP 612 N 1.12 0.45 -0.45 1.42 3.32 -1.84 -2.50 116.42 117.95 2vl4 h ASP 612 Ca 0.38 -0.38 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2vl4 h ASP 612 Cb 0.08 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 2vl4 h ASP 612 CO -0.12 1.19 0.25 0.15 -1.72 0.00 0.00 179.24 178.98 2vl4 h PHE 613 N 0.18 0.62 -0.23 4.55 3.57 -0.68 -0.69 116.94 124.27 2vl4 h PHE 613 Ca -0.08 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.45 2vl4 h PHE 613 Cb 1.60 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 40.11 2vl4 h PHE 613 CO 0.05 0.46 -0.01 0.28 -2.23 0.00 0.00 178.31 176.87 2vl4 h VAL 614 N 0.59 0.83 -0.06 1.41 2.07 -0.85 0.53 116.25 120.78 2vl4 h VAL 614 Ca 0.16 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.67 2vl4 h VAL 614 Cb 0.05 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 2vl4 h VAL 614 CO -0.03 0.01 -0.03 0.22 0.02 0.00 0.00 177.57 177.77 2vl4 h TYR 615 N 0.06 -0.07 -0.46 1.57 3.20 -1.18 -1.53 116.97 118.56 2vl4 h TYR 615 Ca 0.11 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.94 2vl4 h TYR 615 Cb 0.14 0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.43 2vl4 h TYR 615 CO -0.19 -0.05 0.11 0.28 -1.64 0.00 0.00 178.16 176.67 2vl4 h VAL 616 N -0.03 1.20 -0.28 1.81 2.07 -0.93 -2.06 116.25 118.03 2vl4 h VAL 616 Ca 0.03 -0.72 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 2vl4 h VAL 616 Cb 0.08 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2vl4 h VAL 616 CO -0.08 0.26 0.07 1.23 0.02 0.00 0.00 177.57 179.08 2vl4 h GLY 617 N 0.88 0.42 0.72 2.17 0.00 -0.48 0.13 103.07 106.91 2vl4 h GLY 617 Ca 0.15 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 2vl4 h GLY 617 CO -0.00 0.19 -0.02 1.41 0.00 0.00 0.00 176.54 178.12 2vl4 h LEU 618 N 0.39 0.19 -0.51 3.11 3.38 -0.77 -2.04 115.31 119.05 2vl4 h LEU 618 Ca 0.10 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.76 2vl4 h LEU 618 Cb 0.14 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 2vl4 h LEU 618 CO -0.01 0.50 0.25 0.58 0.09 0.00 0.00 178.44 179.86 2vl4 h VAL 619 N -0.13 0.93 0.35 1.22 2.07 -1.03 -1.92 116.25 117.74 2vl4 h VAL 619 Ca 0.03 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.38 2vl4 h VAL 619 Cb 0.42 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 2vl4 h VAL 619 CO 0.01 0.09 -0.31 0.25 0.02 0.00 0.00 177.57 177.63 2vl4 h LEU 620 N 0.48 -0.82 -0.70 2.57 5.85 -0.71 0.49 115.31 122.47 2vl4 h LEU 620 Ca 0.23 0.07 0.11 0.00 0.84 0.00 0.00 57.88 59.13 2vl4 h LEU 620 Cb 0.16 0.27 -0.08 0.00 0.37 0.00 0.00 40.66 41.38 2vl4 h LEU 620 CO -0.17 -0.45 0.30 -0.61 -0.34 0.00 0.00 178.44 177.17 2vl4 h GLN 621 N -0.67 0.48 -0.13 1.25 4.15 -1.24 -0.74 115.11 118.20 2vl4 h GLN 621 Ca -0.02 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.33 2vl4 h GLN 621 Cb 0.60 -0.11 -0.00 0.00 0.21 0.00 0.00 27.48 28.18 2vl4 h GLN 621 CO -0.04 0.31 -0.06 0.78 -1.93 0.00 0.00 178.83 177.90 2vl4 h GLY 622 N 0.49 0.29 0.89 2.39 0.00 -1.07 -2.26 103.07 103.79 2vl4 h GLY 622 Ca 0.36 -0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.42 2vl4 h GLY 622 CO -0.33 0.23 0.08 1.46 0.00 0.00 0.00 176.54 177.98 2vl4 h GLN 623 N -0.07 0.41 -0.21 4.80 1.08 -0.63 -1.58 115.11 118.90 2vl4 h GLN 623 Ca 0.03 -0.09 -0.01 0.00 -1.45 0.00 0.00 58.65 57.13 2vl4 h GLN 623 Cb 0.51 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.87 2vl4 h GLN 623 CO 0.02 0.48 0.10 0.78 -0.95 0.00 0.00 178.83 179.26 2vl4 h GLY 624 N 0.25 0.32 0.99 3.46 0.00 -1.19 -2.59 103.07 104.32 2vl4 h GLY 624 Ca 0.08 -0.16 -0.08 0.00 0.00 0.00 0.00 47.33 47.18 2vl4 h GLY 624 CO -0.00 0.15 -0.01 -0.33 0.00 0.00 0.00 176.54 176.35 2vl4 h MET 625 N 0.21 0.82 -0.09 4.80 2.86 -1.41 -2.69 114.93 119.42 2vl4 h MET 625 Ca 0.07 -0.27 -0.05 0.00 -2.06 0.00 0.00 59.70 57.40 2vl4 h MET 625 Cb 0.11 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 2vl4 h MET 625 CO -0.01 0.88 -0.17 -0.09 1.06 0.00 0.00 176.91 178.58 2vl4 h ARG 626 N 0.67 0.15 -0.95 1.72 1.12 -1.27 -1.22 114.38 114.59 2vl4 h ARG 626 Ca 0.13 -0.03 0.05 0.00 -1.11 0.00 0.00 59.98 59.01 2vl4 h ARG 626 Cb 0.52 -0.02 -0.06 0.00 -0.01 0.00 0.00 29.97 30.39 2vl4 h ARG 626 CO 0.03 0.32 0.61 1.25 -3.11 0.00 0.00 179.97 179.07 2vl4 h HIS 627 N 0.14 1.14 -0.10 2.20 2.76 -1.13 -0.77 115.15 119.40 2vl4 h HIS 627 Ca 0.03 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.20 2vl4 h HIS 627 Cb 0.38 -0.38 -0.00 0.00 1.55 0.00 0.00 27.41 28.96 2vl4 h HIS 627 CO 0.00 0.62 -0.04 0.78 -1.30 0.00 0.00 177.93 178.00 2vl4 h GLY 628 N 1.15 0.21 0.35 5.26 0.00 -1.16 -2.08 103.07 106.80 2vl4 h GLY 628 Ca 0.39 -0.19 0.13 0.00 0.00 0.00 0.00 47.33 47.66 2vl4 h GLY 628 CO -0.15 0.17 0.47 1.41 0.00 0.00 0.00 176.54 178.44 2vl4 h LEU 629 N -0.16 0.62 -0.38 3.11 3.38 -0.97 -0.90 115.31 120.01 2vl4 h LEU 629 Ca 0.02 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2vl4 h LEU 629 Cb 0.48 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2vl4 h LEU 629 CO 0.01 0.30 0.12 -0.33 0.09 0.00 0.00 178.44 178.64 2vl4 h GLU 630 N 0.71 0.59 -0.74 1.13 5.08 -1.15 -2.21 114.58 117.99 2vl4 h GLU 630 Ca 0.44 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.67 2vl4 h GLU 630 Cb 0.54 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.67 2vl4 h GLU 630 CO -0.31 0.60 0.44 0.00 -1.00 0.00 0.00 179.01 178.74 2vl4 h ALA 631 N 0.97 1.38 -0.09 3.43 0.00 -0.55 0.56 119.26 124.96 2vl4 h ALA 631 Ca 0.12 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2vl4 h ALA 631 Cb 0.25 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2vl4 h ALA 631 CO -0.00 0.53 -0.04 0.45 0.00 0.00 0.00 179.25 180.19 2vl4 h HIS 632 N 1.03 0.20 -0.22 0.00 3.86 -0.81 -1.82 115.15 117.39 2vl4 h HIS 632 Ca 0.27 -0.05 -0.09 0.00 -1.16 0.00 0.00 60.37 59.34 2vl4 h HIS 632 Cb -0.04 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 2vl4 h HIS 632 CO 0.00 0.53 -0.24 0.00 0.86 0.00 0.00 177.93 179.09 2vl4 h ARG 633 N -0.18 0.40 -0.11 2.45 3.08 -1.27 -2.77 114.38 115.99 2vl4 h ARG 633 Ca 0.02 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 59.87 2vl4 h ARG 633 Cb 0.48 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 2vl4 h ARG 633 CO 0.01 0.62 -0.21 -0.09 -1.07 0.00 0.00 179.97 179.23 2vl4 h ARG 634 N 0.36 0.18 -0.65 0.04 2.43 -0.72 -2.89 114.38 113.12 2vl4 h ARG 634 Ca 0.06 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2vl4 h ARG 634 Cb 0.62 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 2vl4 h ARG 634 CO 0.04 0.39 0.00 0.09 -1.51 0.00 0.00 179.97 178.98 2vl4 n ASN 635 N -4.22 4.89 -4.76 -3.80 3.02 -0.70 -4.79 115.26 104.89 2vl4 n ASN 635 Ca -0.01 -2.74 -0.41 0.00 -0.03 0.00 0.00 54.58 51.39 2vl4 n ASN 635 Cb 0.31 -0.65 -0.02 0.00 -0.61 0.00 0.00 39.78 38.82 2vl4 n ASN 635 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2vl4 s ARG 636 N -2.41 4.30 0.00 3.52 3.52 -1.09 -1.27 118.95 125.52 2vl4 s ARG 636 Ca 0.45 2.28 0.26 0.00 -0.13 0.00 0.00 55.73 58.60 2vl4 s ARG 636 Cb 0.34 -3.07 0.69 0.00 -1.56 0.00 0.00 34.95 31.36 2vl4 s ARG 636 CO 0.14 -0.28 1.54 -0.35 -0.81 0.00 0.00 175.30 175.53 2vl4 n PRO 637 N 1.12 1.71 -0.18 5.12 -0.04 -1.26 -4.60 135.00 136.86 2vl4 n PRO 637 Ca 0.02 -1.17 -0.01 0.00 -0.04 0.00 0.00 63.50 62.30 2vl4 n PRO 637 Cb 0.41 -1.48 0.09 0.00 -0.04 0.00 0.00 33.50 32.49 2vl4 n PRO 637 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 2vl4 h TYR 638 N 2.86 0.16 -3.26 0.54 3.20 -1.74 -3.38 116.97 115.36 2vl4 h TYR 638 Ca 0.00 0.03 -0.64 0.00 3.14 0.00 0.00 58.73 61.27 2vl4 h TYR 638 Cb 0.66 0.01 -0.17 0.00 1.54 0.00 0.00 36.73 38.78 2vl4 h TYR 638 CO 0.00 -0.03 -0.60 0.00 -1.64 0.00 0.00 178.16 175.89 2vl4 n MET 640 N 3.12 2.08 0.00 0.00 2.81 -0.18 -3.63 117.12 121.31 2vl4 n MET 640 Ca -0.17 -1.80 0.00 0.00 -1.81 0.00 0.00 57.70 53.92 2vl4 n MET 640 Cb 0.53 -1.12 0.00 0.00 -0.71 0.00 0.00 33.22 31.91 2vl4 n MET 640 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2vl4 n GLY 641 N -0.78 1.23 2.83 3.03 0.00 -1.26 -2.06 105.19 108.18 2vl4 n GLY 641 Ca 0.06 -0.49 -0.16 0.00 0.00 0.00 0.00 46.02 45.42 2vl4 n GLY 641 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2vl4 s THR 642 N -2.00 -0.17 -0.29 2.61 -1.32 -0.45 -0.57 115.64 113.46 2vl4 s THR 642 Ca 0.00 0.31 0.03 0.00 -1.21 0.00 0.00 61.69 60.82 2vl4 s THR 642 Cb 0.00 -0.24 0.08 0.00 -1.51 0.00 0.00 72.50 70.83 2vl4 s THR 642 CO 0.00 0.13 -0.02 -0.76 -2.21 0.00 0.00 174.62 171.76 2vl4 s LEU 643 N 1.88 3.68 0.63 9.08 1.43 0.85 -1.67 118.68 134.57 2vl4 s LEU 643 Ca -0.01 -1.67 -0.15 0.00 -1.03 0.00 0.00 54.13 51.28 2vl4 s LEU 643 Cb -0.12 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.63 2vl4 s LEU 643 CO -0.05 -0.29 1.08 -0.72 0.23 0.00 0.00 176.35 176.60 2vl4 s TYR 644 N 1.12 2.85 -0.38 0.29 1.13 -0.89 -3.40 117.35 118.07 2vl4 s TYR 644 Ca 0.01 1.52 -0.14 0.00 -1.41 0.00 0.00 57.07 57.05 2vl4 s TYR 644 Cb -0.19 -3.06 0.00 0.00 -1.10 0.00 0.00 41.96 37.61 2vl4 s TYR 644 CO -0.08 -1.36 0.28 -0.46 -2.51 0.00 0.00 175.55 171.42 2vl4 s TRP 645 N -2.47 3.23 0.08 -3.49 -0.11 0.90 -0.85 118.94 116.24 2vl4 s TRP 645 Ca 0.64 -0.43 -0.08 0.00 1.22 0.00 0.00 56.10 57.45 2vl4 s TRP 645 Cb -0.18 -2.55 -0.00 0.00 -1.50 0.00 0.00 33.47 29.24 2vl4 s TRP 645 CO 0.41 -0.50 0.17 1.14 -4.62 0.00 0.00 176.95 173.55 2vl4 s GLN 646 N 1.71 0.80 0.01 5.86 -2.07 -1.01 -4.14 119.66 120.82 2vl4 s GLN 646 Ca 0.06 -0.93 -0.25 0.00 -1.82 0.00 0.00 55.36 52.42 2vl4 s GLN 646 Cb -0.18 0.32 -0.18 0.00 -1.09 0.00 0.00 33.01 31.88 2vl4 s GLN 646 CO 0.10 -0.24 1.36 1.25 -1.32 0.00 0.00 175.29 176.43 2vl4 h LEU 647 N 2.89 0.06 -8.54 2.60 5.85 -1.22 -1.95 115.31 115.00 2vl4 h LEU 647 Ca -0.34 -0.41 -0.23 0.00 0.84 0.00 0.00 57.88 57.74 2vl4 h LEU 647 Cb 1.19 -0.02 -0.13 0.00 0.37 0.00 0.00 40.66 42.08 2vl4 h LEU 647 CO 0.56 0.46 -0.43 0.54 -0.34 0.00 0.00 178.44 179.22 2vl4 s ASN 648 N -5.68 0.38 0.14 1.25 4.22 -1.26 -1.80 114.94 112.20 2vl4 s ASN 648 Ca -0.15 -1.34 0.08 0.00 -2.14 0.00 0.00 52.86 49.31 2vl4 s ASN 648 Cb 0.03 0.49 -0.04 0.00 1.28 0.00 0.00 41.25 43.01 2vl4 s ASN 648 CO 0.68 -1.00 -0.18 -1.81 -2.04 0.00 0.00 177.10 172.75 2vl4 s ASP 649 N -3.16 2.57 0.00 3.54 1.01 -1.22 -4.72 116.67 114.69 2vl4 s ASP 649 Ca 0.34 -0.81 0.24 0.00 0.71 0.00 0.00 52.55 53.03 2vl4 s ASP 649 Cb 0.04 -0.14 0.35 0.00 1.01 0.00 0.00 42.92 44.18 2vl4 s ASP 649 CO 0.14 -0.02 1.31 -1.54 0.21 0.00 0.00 175.17 175.27 2vl4 n SER 650 N 0.52 0.70 -3.68 0.27 3.41 -1.24 -4.56 113.62 109.04 2vl4 n SER 650 Ca -0.15 -0.51 -0.01 0.00 -0.26 0.00 0.00 58.87 57.94 2vl4 n SER 650 Cb 0.56 0.41 -0.01 0.00 -0.26 0.00 0.00 64.21 64.91 2vl4 n SER 650 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 2vl4 s TRP 651 N -2.94 -0.08 -0.09 7.33 1.48 -1.26 -2.05 118.94 121.33 2vl4 s TRP 651 Ca 0.12 -0.14 -0.29 0.00 -1.06 0.00 0.00 56.10 54.72 2vl4 s TRP 651 Cb 0.17 0.60 -0.05 0.00 -1.16 0.00 0.00 33.47 33.04 2vl4 s TRP 651 CO 0.72 -0.60 1.63 -2.14 -4.06 0.00 0.00 176.95 172.50 2vl4 s PRO 652 N -2.86 4.10 0.12 3.25 0.02 -1.26 -4.46 135.00 133.92 2vl4 s PRO 652 Ca 0.14 2.06 -0.25 0.00 0.02 0.00 0.00 61.00 62.97 2vl4 s PRO 652 Cb 0.01 -3.98 0.07 0.00 0.02 0.00 0.00 34.50 30.62 2vl4 s PRO 652 CO -0.00 -0.93 0.79 0.54 -0.33 0.00 0.00 177.00 177.07 2vl4 s VAL 653 N 4.27 0.00 -0.19 3.83 0.11 -1.26 -4.92 120.40 122.23 2vl4 s VAL 653 Ca 0.72 -0.31 -0.22 0.00 -2.93 0.00 0.00 61.98 59.25 2vl4 s VAL 653 Cb -0.31 -1.38 -0.02 0.00 -1.53 0.00 0.00 36.38 33.14 2vl4 s VAL 653 CO 0.28 0.00 0.67 -0.69 -3.33 0.00 0.00 175.10 172.04 2vl4 s VAL 654 N -3.46 4.99 0.38 2.04 1.01 -0.28 -4.35 120.40 120.73 2vl4 s VAL 654 Ca 0.06 1.28 -0.13 0.00 0.00 0.00 0.00 61.98 63.20 2vl4 s VAL 654 Cb -0.02 -3.99 0.05 0.00 0.00 0.00 0.00 36.38 32.42 2vl4 s VAL 654 CO -0.05 0.10 0.73 -0.94 0.00 0.00 0.00 175.10 174.94 2vl4 s SER 655 N 1.17 0.23 0.00 3.32 1.04 -1.14 -4.56 113.70 113.76 2vl4 s SER 655 Ca 0.31 -1.24 0.16 0.00 0.48 0.00 0.00 55.95 55.65 2vl4 s SER 655 Cb -0.16 0.82 0.95 0.00 0.10 0.00 0.00 66.02 67.72 2vl4 s SER 655 CO 0.11 -1.62 1.43 0.79 0.98 0.00 0.00 173.24 174.92 2vl4 n TRP 656 N -0.54 0.00 -1.38 5.02 8.01 -1.26 -1.00 117.44 126.28 2vl4 n TRP 656 Ca -0.07 0.00 -0.32 0.00 -1.31 0.00 0.00 57.50 55.81 2vl4 n TRP 656 Cb 0.60 0.00 0.08 0.00 -2.01 0.00 0.00 31.31 29.98 2vl4 n TRP 656 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.69 175.14 2vl4 s SER 657 N -1.77 4.62 0.03 -0.99 1.04 -1.25 -2.39 113.70 112.98 2vl4 s SER 657 Ca 0.24 1.89 0.22 0.00 0.48 0.00 0.00 55.95 58.78 2vl4 s SER 657 Cb 0.11 -2.53 -0.14 0.00 0.10 0.00 0.00 66.02 63.56 2vl4 s SER 657 CO 0.18 -1.96 0.81 -1.54 0.98 0.00 0.00 173.24 171.71 2vl4 n SER 658 N -3.24 0.48 -3.86 7.02 3.41 -0.73 -4.81 113.62 111.89 2vl4 n SER 658 Ca 0.10 -0.19 -0.24 0.00 -0.26 0.00 0.00 58.87 58.27 2vl4 n SER 658 Cb 0.53 1.22 -0.17 0.00 -0.26 0.00 0.00 64.21 65.52 2vl4 n SER 658 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2vl4 s ILE 659 N -3.30 0.70 1.03 -1.33 1.01 -0.74 -0.97 121.20 117.61 2vl4 s ILE 659 Ca -0.00 -0.11 -0.16 0.00 0.00 0.00 0.00 60.65 60.38 2vl4 s ILE 659 Cb 0.14 -0.77 0.21 0.00 0.01 0.00 0.00 42.46 42.05 2vl4 s ILE 659 CO 0.85 0.31 1.18 1.51 0.00 0.00 0.00 174.94 178.79 2vl4 s ASP 660 N 1.66 2.43 0.44 3.58 1.47 -0.82 -3.37 116.67 122.05 2vl4 s ASP 660 Ca 0.02 0.64 0.13 0.00 1.18 0.00 0.00 52.55 54.52 2vl4 s ASP 660 Cb -0.13 -0.94 1.03 0.00 -0.34 0.00 0.00 42.92 42.54 2vl4 s ASP 660 CO -0.05 -3.19 2.00 0.22 0.68 0.00 0.00 175.17 174.83 2vl4 h TYR 661 N -1.94 0.40 -0.08 2.11 5.03 -1.81 -0.29 116.97 120.40 2vl4 h TYR 661 Ca -0.47 0.01 0.00 0.00 2.58 0.00 0.00 58.73 60.85 2vl4 h TYR 661 Cb 1.29 -0.13 0.00 0.00 1.55 0.00 0.00 36.73 39.44 2vl4 h TYR 661 CO -1.01 0.20 0.00 0.66 -1.32 0.00 0.00 178.16 176.70 2vl4 n TYR 662 N -4.47 0.10 -0.71 -3.82 4.01 -1.26 -4.90 117.16 106.11 2vl4 n TYR 662 Ca 0.08 -0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 2vl4 n TYR 662 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.35 2vl4 n TYR 662 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2vl4 n GLY 663 N 0.89 0.74 3.69 2.72 0.00 -0.12 -3.95 105.19 109.16 2vl4 n GLY 663 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 2vl4 n GLY 663 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2vl4 s ASN 664 N -2.46 6.99 0.03 1.61 0.01 -1.26 -4.83 114.94 115.03 2vl4 s ASN 664 Ca 0.00 1.93 -0.30 0.00 -0.71 0.00 0.00 52.86 53.77 2vl4 s ASN 664 Cb 0.00 -2.56 -0.07 0.00 0.41 0.00 0.00 41.25 39.03 2vl4 s ASN 664 CO 0.00 -0.62 1.48 0.26 -1.51 0.00 0.00 177.10 176.71 2vl4 s TRP 665 N 2.20 2.75 0.91 2.20 0.52 -1.26 -1.95 118.94 124.31 2vl4 s TRP 665 Ca 0.59 0.67 -0.12 0.00 0.02 0.00 0.00 56.10 57.26 2vl4 s TRP 665 Cb -0.27 -3.76 0.14 0.00 -1.15 0.00 0.00 33.47 28.42 2vl4 s TRP 665 CO 0.24 -2.90 1.11 0.15 0.02 0.00 0.00 176.95 175.57 2vl4 s LYS 666 N 2.36 1.13 0.38 4.98 1.02 -0.14 -4.93 119.74 124.53 2vl4 s LYS 666 Ca 0.67 0.49 0.12 0.00 0.02 0.00 0.00 55.97 57.27 2vl4 s LYS 666 Cb -0.35 -1.82 0.92 0.00 -0.52 0.00 0.00 37.83 36.06 2vl4 s LYS 666 CO 0.29 -2.25 1.86 0.00 -0.92 0.00 0.00 175.35 174.33 2vl4 h ALA 667 N -1.54 1.96 -0.44 5.17 0.00 -1.85 -1.74 119.26 120.83 2vl4 h ALA 667 Ca -0.51 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.45 2vl4 h ALA 667 Cb 1.31 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 2vl4 h ALA 667 CO 0.59 -0.23 0.29 1.25 0.00 0.00 0.00 179.25 181.16 2vl4 h LEU 668 N 0.58 0.42 -0.46 0.00 5.85 -1.83 -0.41 115.31 119.46 2vl4 h LEU 668 Ca 0.46 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 59.03 2vl4 h LEU 668 Cb 0.89 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 2vl4 h LEU 668 CO -0.20 0.29 -0.28 -0.74 -0.34 0.00 0.00 178.44 177.17 2vl4 h HIS 669 N 0.49 1.13 -0.58 1.25 2.76 -1.41 0.24 115.15 119.03 2vl4 h HIS 669 Ca 0.18 -0.30 -0.10 0.00 -2.20 0.00 0.00 60.37 57.95 2vl4 h HIS 669 Cb 0.09 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 28.78 2vl4 h HIS 669 CO -0.00 1.13 -0.02 1.88 -1.30 0.00 0.00 177.93 179.62 2vl4 h TYR 670 N 0.82 1.13 -0.38 5.26 0.05 -1.45 -1.69 116.97 120.71 2vl4 h TYR 670 Ca 0.09 -0.20 -0.13 0.00 0.05 0.00 0.00 58.73 58.55 2vl4 h TYR 670 Cb 0.87 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 38.30 2vl4 h TYR 670 CO 0.06 1.01 -0.27 1.96 -1.05 0.00 0.00 178.16 179.86 2vl4 h GLN 671 N 0.94 0.80 -0.36 4.88 1.08 -0.83 -1.97 115.11 119.65 2vl4 h GLN 671 Ca 0.16 -0.35 -0.04 0.00 -1.45 0.00 0.00 58.65 56.97 2vl4 h GLN 671 Cb 0.57 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.97 2vl4 h GLN 671 CO 0.03 0.98 0.07 0.00 -0.95 0.00 0.00 178.83 178.96 2vl4 h ALA 672 N 1.00 0.48 -0.42 3.87 0.00 -0.41 -0.62 119.26 123.16 2vl4 h ALA 672 Ca 0.08 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 54.88 2vl4 h ALA 672 Cb 0.81 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 18.37 2vl4 h ALA 672 CO 0.07 0.17 -0.16 -0.22 0.00 0.00 0.00 179.25 179.11 2vl4 h LYS 673 N 0.44 -0.07 -0.34 0.00 3.64 -1.11 -0.56 116.57 118.57 2vl4 h LYS 673 Ca 0.11 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 2vl4 h LYS 673 Cb 0.34 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 2vl4 h LYS 673 CO 0.00 -0.05 0.22 0.00 -2.27 0.00 0.00 179.45 177.36 2vl4 h ARG 674 N -0.07 0.43 0.00 1.90 3.08 -1.18 -2.21 114.38 116.34 2vl4 h ARG 674 Ca 0.20 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.23 2vl4 h ARG 674 Cb 0.38 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 2vl4 h ARG 674 CO -0.47 0.29 -0.00 0.00 -1.07 0.00 0.00 179.97 178.71 2vl4 h ALA 675 N 1.14 1.00 -0.03 0.04 0.00 -0.82 -2.67 119.26 117.91 2vl4 h ALA 675 Ca 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2vl4 h ALA 675 Cb -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2vl4 h ALA 675 CO -0.04 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.40 2vl4 n PHE 676 N -3.09 0.01 -1.58 0.00 3.72 -0.24 -4.80 117.46 111.47 2vl4 n PHE 676 Ca -0.00 -0.01 -0.49 0.00 -0.05 0.00 0.00 57.45 56.90 2vl4 n PHE 676 Cb 0.26 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.76 2vl4 n PHE 676 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2vl4 n ALA 677 N 1.06 -0.80 -0.31 4.37 0.00 -0.85 -4.84 120.51 119.15 2vl4 n ALA 677 Ca 0.11 0.47 0.14 0.00 0.00 0.00 0.00 53.44 54.16 2vl4 n ALA 677 Cb 0.47 -2.03 0.32 0.00 0.00 0.00 0.00 19.45 18.21 2vl4 n ALA 677 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2vl4 h PRO 678 N 3.45 0.32 -5.29 0.00 0.11 -1.92 -3.35 132.00 125.32 2vl4 h PRO 678 Ca -0.43 -0.02 -0.66 0.00 0.11 0.00 0.00 66.00 65.00 2vl4 h PRO 678 Cb 1.34 -0.07 -0.27 0.00 0.11 0.00 0.00 31.00 32.11 2vl4 h PRO 678 CO 0.71 0.21 -0.77 0.08 -0.21 0.00 0.00 178.00 178.02 2vl4 s VAL 679 N -5.88 3.00 -0.04 3.15 1.01 -1.26 0.28 120.40 120.66 2vl4 s VAL 679 Ca -0.12 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.20 2vl4 s VAL 679 Cb 0.26 -2.26 0.02 0.00 0.00 0.00 0.00 36.38 34.40 2vl4 s VAL 679 CO 0.78 0.52 -0.05 -0.22 0.00 0.00 0.00 175.10 176.13 2vl4 s LEU 680 N 0.46 1.44 -0.24 3.92 2.96 0.30 -4.91 118.68 122.62 2vl4 s LEU 680 Ca -0.10 -0.13 -0.19 0.00 -0.22 0.00 0.00 54.13 53.50 2vl4 s LEU 680 Cb -0.16 -0.43 -0.03 0.00 0.50 0.00 0.00 46.19 46.07 2vl4 s LEU 680 CO 0.05 -0.03 0.56 -0.63 -1.32 0.00 0.00 176.35 174.98 2vl4 s ILE 681 N 0.73 5.04 -0.47 6.68 1.01 -1.26 -1.43 121.20 131.51 2vl4 s ILE 681 Ca -0.10 1.00 0.00 0.00 0.00 0.00 0.00 60.65 61.56 2vl4 s ILE 681 Cb -0.13 -3.88 0.12 0.00 0.01 0.00 0.00 42.46 38.59 2vl4 s ILE 681 CO 0.00 0.08 0.24 0.21 0.00 0.00 0.00 174.94 175.48 2vl4 s ASN 682 N 1.42 4.93 0.05 3.58 3.04 0.09 -4.75 114.94 123.29 2vl4 s ASN 682 Ca 0.24 -2.48 -0.30 0.00 0.04 0.00 0.00 52.86 50.36 2vl4 s ASN 682 Cb -0.16 -1.75 -0.05 0.00 -1.54 0.00 0.00 41.25 37.75 2vl4 s ASN 682 CO 0.09 -0.39 1.21 -2.16 -3.04 0.00 0.00 177.10 172.81 2vl4 s PRO 683 N 0.47 4.41 -0.09 0.43 0.04 -1.26 -0.71 135.00 138.29 2vl4 s PRO 683 Ca 0.13 1.78 0.00 0.00 0.04 0.00 0.00 61.00 62.95 2vl4 s PRO 683 Cb -0.22 -3.38 0.02 0.00 0.04 0.00 0.00 34.50 30.96 2vl4 s PRO 683 CO -0.04 -0.30 -0.08 -1.50 0.04 0.00 0.00 177.00 175.12 2vl4 s ILE 684 N 1.27 0.96 -0.21 0.56 1.10 0.22 -4.99 121.20 120.12 2vl4 s ILE 684 Ca 0.59 -0.28 -0.02 0.00 -0.51 0.00 0.00 60.65 60.42 2vl4 s ILE 684 Cb -0.29 -0.97 -0.00 0.00 0.15 0.00 0.00 42.46 41.35 2vl4 s ILE 684 CO 0.28 0.35 -0.09 -1.58 -2.11 0.00 0.00 174.94 171.79 2vl4 s GLN 685 N 1.45 3.27 -0.00 3.50 0.74 -1.26 -0.67 119.66 126.69 2vl4 s GLN 685 Ca -0.00 -0.68 -0.05 0.00 0.05 0.00 0.00 55.36 54.67 2vl4 s GLN 685 Cb -0.13 -2.88 -0.00 0.00 1.10 0.00 0.00 33.01 31.10 2vl4 s GLN 685 CO -0.05 -0.19 0.10 -0.65 -0.55 0.00 0.00 175.29 173.95 2vl4 s GLN 686 N 1.40 0.38 -1.46 1.67 -0.21 -0.31 -4.92 119.66 116.22 2vl4 s GLN 686 Ca 0.05 -0.32 -0.09 0.00 0.02 0.00 0.00 55.36 55.02 2vl4 s GLN 686 Cb -0.14 0.16 0.03 0.00 1.00 0.00 0.00 33.01 34.06 2vl4 s GLN 686 CO -0.06 -0.08 0.89 0.09 -2.12 0.00 0.00 175.29 174.01 2vl4 n ASN 687 N 1.79 -5.68 -2.23 5.90 3.02 -1.26 -1.81 115.26 114.99 2vl4 n ASN 687 Ca -0.21 -0.50 -0.18 0.00 -0.03 0.00 0.00 54.58 53.65 2vl4 n ASN 687 Cb 0.56 -4.54 0.00 0.00 -0.61 0.00 0.00 39.78 35.20 2vl4 n ASN 687 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2vl4 n ASP 688 N -2.75 -5.31 -3.92 6.41 2.03 -1.26 -4.97 116.55 106.77 2vl4 n ASP 688 Ca -0.02 -0.09 -0.10 0.00 0.52 0.00 0.00 54.79 55.09 2vl4 n ASP 688 Cb 0.57 -4.31 -0.11 0.00 -0.72 0.00 0.00 41.12 36.55 2vl4 n ASP 688 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2vl4 s SER 689 N -2.38 0.11 -0.15 1.67 0.15 -0.75 -0.64 113.70 111.71 2vl4 s SER 689 Ca 0.09 -0.29 -0.02 0.00 0.70 0.00 0.00 55.95 56.43 2vl4 s SER 689 Cb -0.04 0.15 -0.02 0.00 -1.71 0.00 0.00 66.02 64.40 2vl4 s SER 689 CO 0.11 -0.29 -0.08 -0.22 1.20 0.00 0.00 173.24 173.96 2vl4 s LEU 690 N -1.20 2.94 0.16 3.45 2.96 -0.02 -1.16 118.68 125.80 2vl4 s LEU 690 Ca -0.13 -0.26 0.09 0.00 -0.22 0.00 0.00 54.13 53.61 2vl4 s LEU 690 Cb -0.08 -1.69 -0.04 0.00 0.50 0.00 0.00 46.19 44.88 2vl4 s LEU 690 CO 0.00 0.14 -0.12 -0.44 -1.32 0.00 0.00 176.35 174.61 2vl4 s SER 691 N 0.49 4.15 -0.15 3.68 0.01 0.16 -1.03 113.70 121.00 2vl4 s SER 691 Ca -0.06 -0.56 0.01 0.00 1.31 0.00 0.00 55.95 56.64 2vl4 s SER 691 Cb -0.15 -0.67 0.02 0.00 0.21 0.00 0.00 66.02 65.43 2vl4 s SER 691 CO 0.04 0.13 -0.16 -0.69 0.41 0.00 0.00 173.24 172.97 2vl4 s VAL 692 N -1.50 1.68 0.02 3.43 1.01 0.80 -0.61 120.40 125.22 2vl4 s VAL 692 Ca 0.23 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2vl4 s VAL 692 Cb -0.09 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 2vl4 s VAL 692 CO 0.13 0.48 0.11 -0.31 0.00 0.00 0.00 175.10 175.51 2vl4 s TYR 693 N 1.42 3.32 -0.20 5.22 2.02 0.12 -1.40 117.35 127.85 2vl4 s TYR 693 Ca 0.04 0.20 -0.06 0.00 -0.37 0.00 0.00 57.07 56.89 2vl4 s TYR 693 Cb -0.13 -1.73 -0.03 0.00 -0.40 0.00 0.00 41.96 39.67 2vl4 s TYR 693 CO -0.11 0.56 0.02 -0.51 -1.57 0.00 0.00 175.55 173.95 2vl4 s LEU 694 N -1.96 3.42 -0.13 -1.29 1.43 0.02 -0.74 118.68 119.43 2vl4 s LEU 694 Ca 0.26 -0.13 0.03 0.00 -1.03 0.00 0.00 54.13 53.25 2vl4 s LEU 694 Cb -0.12 -1.87 0.01 0.00 0.03 0.00 0.00 46.19 44.24 2vl4 s LEU 694 CO 0.17 0.08 -0.21 -0.63 0.23 0.00 0.00 176.35 176.00 2vl4 s ILE 695 N 0.92 1.93 -0.06 -0.59 1.01 -0.51 -1.70 121.20 122.20 2vl4 s ILE 695 Ca 0.02 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.77 2vl4 s ILE 695 Cb -0.14 -1.71 0.02 0.00 0.01 0.00 0.00 42.46 40.64 2vl4 s ILE 695 CO 0.02 0.53 -0.06 -0.55 0.00 0.00 0.00 174.94 174.88 2vl4 s SER 696 N 0.79 1.28 -0.13 3.58 0.15 0.56 -0.54 113.70 119.40 2vl4 s SER 696 Ca -0.08 -0.17 0.17 0.00 0.70 0.00 0.00 55.95 56.57 2vl4 s SER 696 Cb -0.16 -0.55 0.69 0.00 -1.71 0.00 0.00 66.02 64.29 2vl4 s SER 696 CO -0.01 -0.06 1.60 0.47 1.20 0.00 0.00 173.24 176.45 2vl4 n ASP 697 N 4.20 4.70 -4.77 5.45 8.00 0.14 -1.65 116.55 132.62 2vl4 n ASP 697 Ca -0.21 -2.54 -0.32 0.00 0.71 0.00 0.00 54.79 52.43 2vl4 n ASP 697 Cb 0.51 -0.57 0.08 0.00 -0.02 0.00 0.00 41.12 41.12 2vl4 n ASP 697 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2vl4 s ARG 698 N -2.01 2.45 0.28 -1.24 0.52 -1.26 -4.70 118.95 112.99 2vl4 s ARG 698 Ca 0.49 1.23 0.23 0.00 -0.52 0.00 0.00 55.73 57.17 2vl4 s ARG 698 Cb 0.33 -1.92 0.28 0.00 0.52 0.00 0.00 34.95 34.16 2vl4 s ARG 698 CO 0.21 -1.50 1.38 -0.07 0.02 0.00 0.00 175.30 175.35 2vl4 h LEU 699 N -0.74 0.00 -9.59 2.53 3.38 -1.95 -2.63 115.31 106.32 2vl4 h LEU 699 Ca -0.45 -0.04 -0.65 0.00 0.09 0.00 0.00 57.88 56.84 2vl4 h LEU 699 Cb 1.23 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.89 2vl4 h LEU 699 CO 0.52 0.02 -0.57 1.51 0.09 0.00 0.00 178.44 180.01 2vl4 s ASP 700 N -5.38 5.70 0.23 -0.43 -4.77 -1.26 -4.79 116.67 105.97 2vl4 s ASP 700 Ca 0.05 0.14 -0.29 0.00 -3.30 0.00 0.00 52.55 49.14 2vl4 s ASP 700 Cb 0.09 -1.63 -0.09 0.00 -1.09 0.00 0.00 42.92 40.20 2vl4 s ASP 700 CO 0.71 0.26 0.92 -0.89 0.70 0.00 0.00 175.17 176.87 2vl4 s THR 701 N -1.23 4.11 -0.17 2.11 2.01 -1.26 -4.09 115.64 117.12 2vl4 s THR 701 Ca 0.24 2.04 -0.08 0.00 0.31 0.00 0.00 61.69 64.20 2vl4 s THR 701 Cb -0.12 -4.31 -0.04 0.00 0.01 0.00 0.00 72.50 68.04 2vl4 s THR 701 CO 0.15 0.50 0.10 -0.04 -0.69 0.00 0.00 174.62 174.64 2vl4 s MET 702 N -1.16 3.93 0.19 4.92 1.00 -0.46 -4.94 119.30 122.77 2vl4 s MET 702 Ca 0.40 -0.27 0.11 0.00 0.00 0.00 0.00 55.69 55.93 2vl4 s MET 702 Cb -0.26 -3.27 -0.04 0.00 0.00 0.00 0.00 34.83 31.26 2vl4 s MET 702 CO 0.31 0.38 -0.22 -1.21 0.00 0.00 0.00 175.02 174.28 2vl4 s GLU 703 N 0.09 1.47 -1.30 2.03 2.02 -1.26 -0.34 118.70 121.41 2vl4 s GLU 703 Ca 0.07 -1.51 -0.05 0.00 0.02 0.00 0.00 54.97 53.50 2vl4 s GLU 703 Cb -0.12 -1.73 0.01 0.00 0.10 0.00 0.00 34.13 32.40 2vl4 s GLU 703 CO -0.00 0.37 1.06 1.04 0.02 0.00 0.00 175.26 177.74 2vl4 n GLN 704 N 0.22 -7.02 -3.58 1.61 6.02 -0.99 -4.55 117.38 109.10 2vl4 n GLN 704 Ca -0.12 0.81 -0.31 0.00 -0.01 0.00 0.00 57.00 57.37 2vl4 n GLN 704 Cb 0.56 -5.80 -0.04 0.00 1.02 0.00 0.00 30.24 25.98 2vl4 n GLN 704 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 2vl4 s MET 705 N -5.90 3.64 -0.16 -1.09 -1.94 -0.19 -2.66 119.30 111.00 2vl4 s MET 705 Ca 0.29 -0.04 0.01 0.00 -1.71 0.00 0.00 55.69 54.25 2vl4 s MET 705 Cb -0.13 -2.78 0.02 0.00 2.01 0.00 0.00 34.83 33.95 2vl4 s MET 705 CO 0.74 0.39 -0.19 0.99 -0.01 0.00 0.00 175.02 176.94 2vl4 s THR 706 N -1.78 1.94 -0.17 2.05 2.01 0.16 -0.33 115.64 119.52 2vl4 s THR 706 Ca 0.42 -0.87 -0.24 0.00 0.31 0.00 0.00 61.69 61.31 2vl4 s THR 706 Cb -0.12 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 2vl4 s THR 706 CO 0.25 0.52 0.77 -0.22 -0.69 0.00 0.00 174.62 175.25 2vl4 s LEU 707 N 1.22 4.18 -0.12 4.42 2.96 -0.09 -1.13 118.68 130.13 2vl4 s LEU 707 Ca 0.02 1.09 0.02 0.00 -0.22 0.00 0.00 54.13 55.04 2vl4 s LEU 707 Cb -0.14 -3.14 -0.01 0.00 0.50 0.00 0.00 46.19 43.41 2vl4 s LEU 707 CO -0.10 -0.34 -0.17 -0.70 -1.32 0.00 0.00 176.35 173.72 2vl4 s GLU 708 N 1.96 3.25 0.09 1.98 2.12 0.68 -1.01 118.70 127.78 2vl4 s GLU 708 Ca 0.36 -0.76 0.08 0.00 0.36 0.00 0.00 54.97 55.00 2vl4 s GLU 708 Cb -0.16 -2.50 -0.03 0.00 0.26 0.00 0.00 34.13 31.69 2vl4 s GLU 708 CO 0.12 0.20 -0.20 -1.64 -0.54 0.00 0.00 175.26 173.21 2vl4 s MET 709 N 0.34 1.10 -0.08 4.30 -1.94 0.23 -0.90 119.30 122.35 2vl4 s MET 709 Ca -0.14 -1.11 -0.17 0.00 -1.71 0.00 0.00 55.69 52.56 2vl4 s MET 709 Cb -0.17 -1.32 0.04 0.00 2.01 0.00 0.00 34.83 35.39 2vl4 s MET 709 CO 0.07 0.31 0.41 -1.59 -0.01 0.00 0.00 175.02 174.20 2vl4 s LYS 710 N -1.81 0.64 -0.22 2.03 -2.85 -0.51 -0.39 119.74 116.62 2vl4 s LYS 710 Ca 0.05 0.20 -0.21 0.00 -1.00 0.00 0.00 55.97 55.02 2vl4 s LYS 710 Cb -0.10 0.30 -0.02 0.00 -2.06 0.00 0.00 37.83 35.95 2vl4 s LYS 710 CO 0.04 -0.15 0.64 0.08 0.10 0.00 0.00 175.35 176.06 2vl4 s VAL 711 N -0.64 5.00 -0.04 1.79 1.01 -1.26 -0.97 120.40 125.29 2vl4 s VAL 711 Ca -0.07 1.18 0.07 0.00 0.00 0.00 0.00 61.98 63.15 2vl4 s VAL 711 Cb -0.04 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 2vl4 s VAL 711 CO 0.03 0.07 -0.25 -0.69 0.00 0.00 0.00 175.10 174.27 2vl4 s VAL 712 N 2.18 2.11 0.82 2.92 1.01 -0.28 -0.12 120.40 129.04 2vl4 s VAL 712 Ca 0.28 -1.07 -0.12 0.00 0.00 0.00 0.00 61.98 61.07 2vl4 s VAL 712 Cb -0.16 -1.75 0.08 0.00 0.00 0.00 0.00 36.38 34.56 2vl4 s VAL 712 CO 0.09 0.58 1.18 1.51 0.00 0.00 0.00 175.10 178.47 2vl4 s ASP 713 N -0.43 4.44 0.04 3.32 1.47 0.32 -1.12 116.67 124.71 2vl4 s ASP 713 Ca 0.05 0.76 0.13 0.00 1.18 0.00 0.00 52.55 54.67 2vl4 s ASP 713 Cb -0.12 -1.24 0.55 0.00 -0.34 0.00 0.00 42.92 41.77 2vl4 s ASP 713 CO 0.01 -1.95 1.40 0.49 0.68 0.00 0.00 175.17 175.80 2vl4 n PHE 714 N -3.34 0.12 1.09 2.11 3.72 -1.04 -0.45 117.46 119.67 2vl4 n PHE 714 Ca 0.08 0.05 0.12 0.00 -0.05 0.00 0.00 57.45 57.65 2vl4 n PHE 714 Cb 0.61 -0.58 0.14 0.00 -0.94 0.00 0.00 39.48 38.70 2vl4 n PHE 714 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2vl4 n ASP 715 N -1.61 1.50 0.00 4.37 8.00 -1.26 -1.00 116.55 126.55 2vl4 n ASP 715 Ca 0.02 -1.18 0.00 0.00 0.71 0.00 0.00 54.79 54.34 2vl4 n ASP 715 Cb 0.13 0.39 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 2vl4 n ASP 715 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2vl4 n GLY 716 N 1.40 0.93 3.70 0.44 0.00 0.40 -4.84 105.19 107.22 2vl4 n GLY 716 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 2vl4 n GLY 716 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2vl4 s LYS 717 N -0.92 4.25 0.20 1.61 2.20 -1.25 -4.79 119.74 121.04 2vl4 s LYS 717 Ca 0.00 0.23 -0.30 0.00 -0.36 0.00 0.00 55.97 55.53 2vl4 s LYS 717 Cb 0.00 -3.47 -0.09 0.00 -1.51 0.00 0.00 37.83 32.75 2vl4 s LYS 717 CO 0.00 0.10 1.40 0.99 -0.36 0.00 0.00 175.35 177.48 2vl4 s THR 718 N 0.85 2.93 -0.20 3.43 2.01 -1.26 -0.52 115.64 122.88 2vl4 s THR 718 Ca 0.20 0.75 -0.08 0.00 0.31 0.00 0.00 61.69 62.86 2vl4 s THR 718 Cb -0.14 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 2vl4 s THR 718 CO 0.07 0.10 0.09 -0.76 -0.69 0.00 0.00 174.62 173.44 2vl4 s LEU 719 N 0.07 3.88 0.00 4.42 1.43 0.83 -4.91 118.68 124.40 2vl4 s LEU 719 Ca 0.60 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.77 2vl4 s LEU 719 Cb -0.39 -2.01 0.00 0.00 0.03 0.00 0.00 46.19 43.82 2vl4 s LEU 719 CO 0.38 0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.70 2vl4 n GLY 720 N 3.86 0.63 3.54 -3.19 0.00 -1.26 -4.26 105.19 104.52 2vl4 n GLY 720 Ca -0.16 -0.80 -0.26 0.00 0.00 0.00 0.00 46.02 44.80 2vl4 n GLY 720 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2vl4 s LYS 721 N 0.00 1.81 0.51 1.61 2.20 -1.26 -5.03 119.74 119.57 2vl4 s LYS 721 Ca 0.00 -1.96 -0.22 0.00 -0.36 0.00 0.00 55.97 53.43 2vl4 s LYS 721 Cb 0.00 -1.54 -0.08 0.00 -1.51 0.00 0.00 37.83 34.70 2vl4 s LYS 721 CO 0.00 0.04 0.98 1.63 -0.36 0.00 0.00 175.35 177.65 2vl4 n LYS 722 N -0.81 1.16 -4.36 4.03 5.02 -1.26 -4.77 118.16 117.17 2vl4 n LYS 722 Ca -0.05 0.43 -0.34 0.00 -2.02 0.00 0.00 58.31 56.33 2vl4 n LYS 722 Cb 0.65 -2.11 -0.12 0.00 -0.02 0.00 0.00 35.03 33.43 2vl4 n LYS 722 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2vl4 s ILE 723 N -1.40 4.00 -0.07 -0.18 1.01 0.48 -4.99 121.20 120.05 2vl4 s ILE 723 Ca 0.68 -0.32 0.05 0.00 0.00 0.00 0.00 60.65 61.07 2vl4 s ILE 723 Cb -0.48 -2.76 -0.01 0.00 0.01 0.00 0.00 42.46 39.22 2vl4 s ILE 723 CO 0.53 0.49 -0.24 -1.10 0.00 0.00 0.00 174.94 174.62 2vl4 s GLN 724 N 0.32 2.72 -0.25 2.79 -0.21 -1.26 -0.60 119.66 123.17 2vl4 s GLN 724 Ca -0.03 -0.88 0.01 0.00 0.02 0.00 0.00 55.36 54.48 2vl4 s GLN 724 Cb -0.14 -2.19 0.07 0.00 1.00 0.00 0.00 33.01 31.74 2vl4 s GLN 724 CO 0.03 0.29 -0.05 0.08 -2.12 0.00 0.00 175.29 173.52 2vl4 s VAL 725 N 0.05 1.71 0.59 1.09 1.01 -0.18 -5.03 120.40 119.65 2vl4 s VAL 725 Ca -0.10 -1.43 0.07 0.00 0.00 0.00 0.00 61.98 60.53 2vl4 s VAL 725 Cb -0.15 -1.98 0.09 0.00 0.00 0.00 0.00 36.38 34.33 2vl4 s VAL 725 CO 0.06 -0.16 0.81 -1.00 0.00 0.00 0.00 175.10 174.81 2vl4 s HIS 726 N 1.29 1.60 -1.57 5.22 3.76 -1.26 -0.91 115.29 123.42 2vl4 s HIS 726 Ca -0.04 -0.59 -0.03 0.00 -0.15 0.00 0.00 55.06 54.24 2vl4 s HIS 726 Cb -0.19 -2.39 0.00 0.00 1.11 0.00 0.00 32.58 31.11 2vl4 s HIS 726 CO -0.07 -1.19 0.41 0.43 -0.85 0.00 0.00 174.74 173.47 2vl4 n SER 727 N -2.33 -5.92 -4.82 1.40 7.64 -1.09 -4.92 113.62 103.59 2vl4 n SER 727 Ca 0.15 -0.20 -0.38 0.00 1.01 0.00 0.00 58.87 59.45 2vl4 n SER 727 Cb 0.61 -4.80 -0.06 0.00 -1.01 0.00 0.00 64.21 58.95 2vl4 n SER 727 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2vl4 s LEU 728 N -6.24 4.50 0.08 -3.43 1.43 0.55 -4.78 118.68 110.78 2vl4 s LEU 728 Ca 0.20 1.22 0.04 0.00 -1.03 0.00 0.00 54.13 54.56 2vl4 s LEU 728 Cb -0.09 -2.90 -0.04 0.00 0.03 0.00 0.00 46.19 43.19 2vl4 s LEU 728 CO 0.25 0.26 0.00 -0.70 0.23 0.00 0.00 176.35 176.40 2vl4 s GLU 729 N -1.20 2.59 -0.43 1.70 2.12 -1.26 -1.02 118.70 121.20 2vl4 s GLU 729 Ca 0.29 -0.80 0.02 0.00 0.36 0.00 0.00 54.97 54.84 2vl4 s GLU 729 Cb -0.19 -2.56 0.15 0.00 0.26 0.00 0.00 34.13 31.78 2vl4 s GLU 729 CO 0.18 0.55 0.27 0.08 -0.54 0.00 0.00 175.26 175.81 2vl4 s VAL 730 N -1.29 1.01 0.67 3.70 1.01 0.54 -5.01 120.40 121.04 2vl4 s VAL 730 Ca 0.25 -2.49 -0.17 0.00 0.00 0.00 0.00 61.98 59.57 2vl4 s VAL 730 Cb -0.12 -1.71 0.01 0.00 0.00 0.00 0.00 36.38 34.56 2vl4 s VAL 730 CO 0.17 -0.99 1.23 -2.84 0.00 0.00 0.00 175.10 172.68 2vl4 s PRO 731 N 0.35 2.48 0.22 2.72 0.02 -1.26 -1.36 135.00 138.16 2vl4 s PRO 731 Ca 0.21 1.85 -0.31 0.00 0.02 0.00 0.00 61.00 62.76 2vl4 s PRO 731 Cb -0.18 -1.86 -0.15 0.00 0.02 0.00 0.00 34.50 32.33 2vl4 s PRO 731 CO -0.04 -1.60 1.22 0.00 -0.33 0.00 0.00 177.00 176.25 2vl4 n ALA 732 N -2.21 -0.02 -3.61 -1.55 0.00 -1.26 -3.38 120.51 108.47 2vl4 n ALA 732 Ca 0.14 0.43 -0.20 0.00 0.00 0.00 0.00 53.44 53.81 2vl4 n ALA 732 Cb 0.50 -2.11 0.05 0.00 0.00 0.00 0.00 19.45 17.89 2vl4 n ALA 732 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2vl4 n ASN 733 N 1.90 -1.61 -4.03 0.00 3.02 -0.85 -4.98 115.26 108.71 2vl4 n ASN 733 Ca 0.13 -0.75 -0.08 0.00 -0.03 0.00 0.00 54.58 53.85 2vl4 n ASN 733 Cb 0.28 -4.42 -0.09 0.00 -0.61 0.00 0.00 39.78 34.94 2vl4 n ASN 733 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2vl4 s THR 734 N -3.55 0.18 -0.11 3.41 -4.23 -0.66 -4.99 115.64 105.68 2vl4 s THR 734 Ca 0.03 -1.63 0.00 0.00 -1.18 0.00 0.00 61.69 58.91 2vl4 s THR 734 Cb -0.01 -1.54 0.02 0.00 1.34 0.00 0.00 72.50 72.31 2vl4 s THR 734 CO 0.78 -0.82 -0.10 -0.55 -0.54 0.00 0.00 174.62 173.39 2vl4 s SER 735 N -2.92 2.25 0.01 3.99 0.15 -1.26 -0.32 113.70 115.60 2vl4 s SER 735 Ca 0.09 -0.35 0.01 0.00 0.70 0.00 0.00 55.95 56.40 2vl4 s SER 735 Cb 0.07 -0.92 -0.01 0.00 -1.71 0.00 0.00 66.02 63.45 2vl4 s SER 735 CO -0.09 -0.08 -0.04 -0.54 1.20 0.00 0.00 173.24 173.69 2vl4 s LYS 736 N 1.49 0.33 0.10 5.44 1.02 -0.69 -4.99 119.74 122.44 2vl4 s LYS 736 Ca 0.02 -0.27 -0.29 0.00 0.02 0.00 0.00 55.97 55.45 2vl4 s LYS 736 Cb -0.13 -0.25 -0.06 0.00 -0.52 0.00 0.00 37.83 36.87 2vl4 s LYS 736 CO -0.07 0.06 0.93 0.00 -0.92 0.00 0.00 175.35 175.36 2vl4 n VAL 738 N 2.81 0.00 -3.64 0.00 0.24 -0.49 -4.95 118.33 112.30 2vl4 n VAL 738 Ca 0.02 -0.32 -0.06 0.00 -2.04 0.00 0.00 64.34 61.93 2vl4 n VAL 738 Cb 0.49 1.29 -0.07 0.00 -1.47 0.00 0.00 33.84 34.09 2vl4 n VAL 738 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 2vl4 s TYR 739 N -0.11 -0.69 -0.08 6.34 5.04 -1.22 -4.99 117.35 121.65 2vl4 s TYR 739 Ca 0.00 1.46 -0.05 0.00 -2.44 0.00 0.00 57.07 56.04 2vl4 s TYR 739 Cb 0.00 0.41 0.03 0.00 0.35 0.00 0.00 41.96 42.75 2vl4 s TYR 739 CO 0.00 -0.34 0.19 0.50 -1.34 0.00 0.00 175.55 174.56 2vl4 s ARG 740 N 1.06 0.19 -0.19 4.97 3.52 -1.26 -0.14 118.95 127.09 2vl4 s ARG 740 Ca -0.06 0.34 -0.16 0.00 -0.13 0.00 0.00 55.73 55.73 2vl4 s ARG 740 Cb -0.04 -0.00 0.05 0.00 -1.56 0.00 0.00 34.95 33.40 2vl4 s ARG 740 CO -0.13 -0.08 0.50 0.00 -0.81 0.00 0.00 175.30 174.78 2vl4 s ALA 741 N 0.57 -1.27 0.49 6.12 0.00 -0.20 -5.01 121.76 122.46 2vl4 s ALA 741 Ca -0.04 1.55 -0.23 0.00 0.00 0.00 0.00 51.96 53.25 2vl4 s ALA 741 Cb -0.05 -0.91 -0.07 0.00 0.00 0.00 0.00 23.12 22.09 2vl4 s ALA 741 CO -0.03 -0.26 1.26 0.15 0.00 0.00 0.00 175.76 176.88 2vl4 s LYS 742 N 0.66 3.55 0.24 0.00 3.01 -1.26 -0.84 119.74 125.10 2vl4 s LYS 742 Ca -0.03 2.00 0.11 0.00 -1.01 0.00 0.00 55.97 57.04 2vl4 s LYS 742 Cb -0.05 -2.39 0.20 0.00 -1.01 0.00 0.00 37.83 34.58 2vl4 s LYS 742 CO -0.04 -0.79 1.51 -0.07 0.51 0.00 0.00 175.35 176.47 2vl4 h LEU 743 N 1.90 0.00 -9.36 3.17 3.38 -1.24 -3.41 115.31 109.75 2vl4 h LEU 743 Ca -0.50 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 56.93 2vl4 h LEU 743 Cb 1.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 2vl4 h LEU 743 CO 0.59 0.69 0.79 -0.62 0.09 0.00 0.00 178.44 179.99 2vl4 s ASP 744 N -6.70 6.90 0.00 -0.43 2.15 -1.26 -0.99 116.67 116.34 2vl4 s ASP 744 Ca 0.00 2.04 0.00 0.00 0.43 0.00 0.00 52.55 55.02 2vl4 s ASP 744 Cb 0.11 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.17 2vl4 s ASP 744 CO 0.77 -0.68 0.00 0.61 -0.17 0.00 0.00 175.17 175.70 2vl4 n GLY 745 N 3.57 2.46 0.24 2.66 0.00 -1.26 -4.84 105.19 108.01 2vl4 n GLY 745 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 2vl4 n GLY 745 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2vl4 n TRP 746 N -2.00 0.00 -4.32 1.61 -0.00 -0.60 -5.01 117.44 107.12 2vl4 n TRP 746 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.50 57.31 2vl4 n TRP 746 Cb 0.00 -0.84 -0.15 0.00 -0.00 0.00 0.00 31.31 30.32 2vl4 n TRP 746 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 2vl4 s LEU 747 N -7.37 1.77 0.63 5.87 1.43 -0.17 -5.11 118.68 115.74 2vl4 s LEU 747 Ca -0.33 -0.16 -0.09 0.00 -1.03 0.00 0.00 54.13 52.51 2vl4 s LEU 747 Cb 0.12 -0.48 -0.00 0.00 0.03 0.00 0.00 46.19 45.86 2vl4 s LEU 747 CO 0.43 0.05 1.00 0.42 0.23 0.00 0.00 176.35 178.48 2vl4 s THR 748 N 0.22 3.95 0.53 5.49 -4.23 -1.26 -4.55 115.64 115.79 2vl4 s THR 748 Ca -0.03 0.42 0.26 0.00 -1.18 0.00 0.00 61.69 61.15 2vl4 s THR 748 Cb -0.08 -3.60 0.40 0.00 1.34 0.00 0.00 72.50 70.56 2vl4 s THR 748 CO 0.00 -0.72 1.99 -0.65 -0.54 0.00 0.00 174.62 174.70 2vl4 h PRO 749 N -0.37 0.00 -0.20 3.99 0.11 -2.00 -0.15 132.00 133.40 2vl4 h PRO 749 Ca -0.45 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.60 2vl4 h PRO 749 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 2vl4 h PRO 749 CO 0.62 0.00 -0.12 0.93 -0.21 0.00 0.00 178.00 179.23 2vl4 h GLU 750 N 0.00 0.43 -0.91 1.05 3.07 -2.00 -2.97 114.58 113.25 2vl4 h GLU 750 Ca 0.26 -0.20 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 2vl4 h GLU 750 Cb 1.04 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.90 2vl4 h GLU 750 CO -0.00 0.73 0.58 -0.44 -1.40 0.00 0.00 179.01 178.48 2vl4 h ASP 751 N 0.11 1.06 0.02 1.42 3.32 -1.41 -2.77 116.42 118.17 2vl4 h ASP 751 Ca 0.04 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2vl4 h ASP 751 Cb 0.62 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 2vl4 h ASP 751 CO 0.03 0.79 -0.01 0.00 -1.72 0.00 0.00 179.24 178.33 2vl4 n ARG 753 N -4.26 0.09 0.00 0.00 1.74 -1.05 -3.87 116.66 109.31 2vl4 n ARG 753 Ca -0.03 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 2vl4 n ARG 753 Cb 0.10 -1.58 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 2vl4 n ARG 753 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2vl4 n ARG 754 N -1.72 0.41 -4.17 5.56 1.74 -0.71 -1.18 116.66 116.59 2vl4 n ARG 754 Ca 0.06 -0.55 -0.11 0.00 -0.77 0.00 0.00 57.85 56.48 2vl4 n ARG 754 Cb 0.37 -0.69 -0.09 0.00 -1.02 0.00 0.00 32.46 31.03 2vl4 n ARG 754 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2vl4 s SER 755 N -0.20 0.15 0.15 0.55 1.04 -0.66 -2.49 113.70 112.24 2vl4 s SER 755 Ca 0.00 -1.30 0.00 0.00 0.48 0.00 0.00 55.95 55.13 2vl4 s SER 755 Cb 0.00 0.39 -0.04 0.00 0.10 0.00 0.00 66.02 66.47 2vl4 s SER 755 CO 0.00 -0.85 0.04 0.72 0.98 0.00 0.00 173.24 174.13 2vl4 s PHE 756 N -4.12 1.02 -0.19 5.02 -0.71 -0.28 -4.52 117.98 114.20 2vl4 s PHE 756 Ca 0.35 -1.16 -0.05 0.00 -1.04 0.00 0.00 56.93 55.03 2vl4 s PHE 756 Cb 0.06 -0.58 -0.02 0.00 -1.21 0.00 0.00 43.02 41.27 2vl4 s PHE 756 CO 0.10 -0.40 -0.00 -1.17 -1.34 0.00 0.00 175.22 172.40 2vl4 s LEU 757 N -3.11 3.26 -0.08 -1.99 2.96 0.72 -1.13 118.68 119.31 2vl4 s LEU 757 Ca 0.25 -0.19 -0.15 0.00 -0.22 0.00 0.00 54.13 53.81 2vl4 s LEU 757 Cb 0.07 -1.82 -0.05 0.00 0.50 0.00 0.00 46.19 44.89 2vl4 s LEU 757 CO 0.03 0.08 0.40 -0.75 -1.32 0.00 0.00 176.35 174.79 2vl4 s LYS 758 N 0.92 4.13 -0.03 1.98 2.20 -0.15 -0.76 119.74 128.04 2vl4 s LYS 758 Ca 0.01 0.34 0.03 0.00 -0.36 0.00 0.00 55.97 55.99 2vl4 s LYS 758 Cb -0.14 -3.34 -0.00 0.00 -1.51 0.00 0.00 37.83 32.84 2vl4 s LYS 758 CO 0.02 0.41 -0.12 -0.51 -0.36 0.00 0.00 175.35 174.79 2vl4 s LEU 759 N -0.16 1.88 -0.02 5.43 1.02 -0.23 -1.43 118.68 125.18 2vl4 s LEU 759 Ca 0.23 -0.24 -0.01 0.00 0.02 0.00 0.00 54.13 54.13 2vl4 s LEU 759 Cb -0.15 -0.67 0.01 0.00 0.02 0.00 0.00 46.19 45.39 2vl4 s LEU 759 CO 0.10 0.11 0.04 -0.63 0.02 0.00 0.00 176.35 175.99 2vl4 s ILE 760 N 0.02 -0.00 -0.06 -0.59 1.01 -0.08 -0.45 121.20 121.05 2vl4 s ILE 760 Ca -0.01 0.01 0.06 0.00 0.00 0.00 0.00 60.65 60.71 2vl4 s ILE 760 Cb -0.08 -0.06 -0.01 0.00 0.01 0.00 0.00 42.46 42.31 2vl4 s ILE 760 CO 0.01 0.00 -0.23 -0.22 0.00 0.00 0.00 174.94 174.50 2vl4 s LEU 761 N 0.08 2.18 0.03 2.97 2.96 -0.37 -0.23 118.68 126.30 2vl4 s LEU 761 Ca -0.00 -0.46 0.00 0.00 -0.22 0.00 0.00 54.13 53.45 2vl4 s LEU 761 Cb -0.01 -1.40 -0.02 0.00 0.50 0.00 0.00 46.19 45.25 2vl4 s LEU 761 CO -0.00 0.26 -0.04 -1.59 -1.32 0.00 0.00 176.35 173.65 2vl4 s LYS 762 N -0.23 0.41 1.01 1.98 -2.85 -0.28 -0.46 119.74 119.31 2vl4 s LYS 762 Ca -0.01 -0.74 -0.17 0.00 -1.00 0.00 0.00 55.97 54.05 2vl4 s LYS 762 Cb -0.13 0.02 0.24 0.00 -2.06 0.00 0.00 37.83 35.90 2vl4 s LYS 762 CO 0.03 -0.03 1.06 -0.40 0.10 0.00 0.00 175.35 176.10 2vl4 n ASP 763 N 1.33 -1.15 -0.21 0.03 5.68 -0.69 -0.66 116.55 120.88 2vl4 n ASP 763 Ca -0.22 -1.23 -0.05 0.00 -0.50 0.00 0.00 54.79 52.79 2vl4 n ASP 763 Cb 0.56 -0.90 0.05 0.00 -1.14 0.00 0.00 41.12 39.69 2vl4 n ASP 763 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 2vl4 h LYS 764 N 0.00 0.70 0.00 0.11 1.63 -1.75 -0.78 116.57 116.48 2vl4 h LYS 764 Ca -0.37 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.38 2vl4 h LYS 764 Cb 1.09 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.56 2vl4 h LYS 764 CO 0.25 0.47 0.00 -1.13 -3.45 0.00 0.00 179.45 175.59 2vl4 n SER 765 N -4.74 0.00 0.00 4.20 3.41 -1.26 -4.88 113.62 110.35 2vl4 n SER 765 Ca 0.05 -0.66 0.00 0.00 -0.26 0.00 0.00 58.87 58.01 2vl4 n SER 765 Cb 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 2vl4 n SER 765 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vl4 n GLY 766 N 0.05 0.44 3.69 5.00 0.00 -0.30 -5.04 105.19 109.04 2vl4 n GLY 766 Ca 0.10 -0.62 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 2vl4 n GLY 766 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2vl4 s HIS 767 N -2.00 3.32 -0.10 1.61 5.65 -1.26 -4.82 115.29 117.69 2vl4 s HIS 767 Ca 0.00 1.35 -0.30 0.00 0.25 0.00 0.00 55.06 56.36 2vl4 s HIS 767 Cb 0.00 -3.34 -0.03 0.00 -1.18 0.00 0.00 32.58 28.03 2vl4 s HIS 767 CO 0.00 -0.95 1.34 -1.14 -0.65 0.00 0.00 174.74 173.34 2vl4 s GLN 768 N 2.01 4.26 -0.01 2.88 0.74 -1.26 -1.70 119.66 126.58 2vl4 s GLN 768 Ca 0.54 1.80 0.14 0.00 0.05 0.00 0.00 55.36 57.89 2vl4 s GLN 768 Cb -0.23 -3.73 -0.18 0.00 1.10 0.00 0.00 33.01 29.97 2vl4 s GLN 768 CO 0.22 -0.66 0.46 1.33 -0.55 0.00 0.00 175.29 176.09 2vl4 n VAL 769 N 5.12 0.00 -3.47 1.34 0.24 0.39 -4.98 118.33 116.97 2vl4 n VAL 769 Ca 0.14 -0.25 -0.14 0.00 -2.04 0.00 0.00 64.34 62.05 2vl4 n VAL 769 Cb 0.45 0.62 -0.04 0.00 -1.47 0.00 0.00 33.84 33.40 2vl4 n VAL 769 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2vl4 s ALA 770 N -2.62 -1.69 -0.07 2.33 0.00 -1.16 -4.94 121.76 113.62 2vl4 s ALA 770 Ca 0.00 0.86 -0.17 0.00 0.00 0.00 0.00 51.96 52.66 2vl4 s ALA 770 Cb 0.10 0.48 0.04 0.00 0.00 0.00 0.00 23.12 23.73 2vl4 s ALA 770 CO 0.57 -0.60 0.40 -1.83 0.00 0.00 0.00 175.76 174.30 2vl4 s GLU 771 N -2.68 0.66 0.11 0.00 -1.05 -1.26 -1.23 118.70 113.24 2vl4 s GLU 771 Ca -0.03 0.13 0.00 0.00 -0.15 0.00 0.00 54.97 54.92 2vl4 s GLU 771 Cb -0.01 0.31 -0.04 0.00 -0.44 0.00 0.00 34.13 33.95 2vl4 s GLU 771 CO -0.04 -0.16 -0.00 0.45 0.95 0.00 0.00 175.26 176.46 2vl4 s SER 772 N -0.79 0.69 0.02 0.83 0.15 0.40 -4.82 113.70 110.18 2vl4 s SER 772 Ca -0.09 -1.10 0.08 0.00 0.70 0.00 0.00 55.95 55.54 2vl4 s SER 772 Cb -0.04 0.20 -0.02 0.00 -1.71 0.00 0.00 66.02 64.45 2vl4 s SER 772 CO 0.04 -0.61 -0.23 -0.69 1.20 0.00 0.00 173.24 172.95 2vl4 s VAL 773 N -3.86 1.82 -0.05 4.45 1.01 -1.26 -1.06 120.40 121.46 2vl4 s VAL 773 Ca 0.17 -1.13 0.03 0.00 0.00 0.00 0.00 61.98 61.04 2vl4 s VAL 773 Cb 0.07 -1.55 0.01 0.00 0.00 0.00 0.00 36.38 34.91 2vl4 s VAL 773 CO -0.03 0.38 -0.11 -2.28 0.00 0.00 0.00 175.10 173.06 2vl4 s HIS 774 N -0.67 1.27 0.00 5.22 2.46 0.06 -4.98 115.29 118.65 2vl4 s HIS 774 Ca 0.09 -0.40 0.02 0.00 0.47 0.00 0.00 55.06 55.24 2vl4 s HIS 774 Cb -0.09 -0.92 -0.04 0.00 -0.13 0.00 0.00 32.58 31.41 2vl4 s HIS 774 CO 0.01 -0.19 -0.01 -0.06 -2.47 0.00 0.00 174.74 172.01 2vl4 s PHE 775 N 0.43 3.04 -0.70 3.88 0.08 -1.26 -0.20 117.98 123.24 2vl4 s PHE 775 Ca -0.09 0.05 0.23 0.00 0.12 0.00 0.00 56.93 57.24 2vl4 s PHE 775 Cb -0.13 -1.65 0.04 0.00 -0.57 0.00 0.00 43.02 40.71 2vl4 s PHE 775 CO 0.02 0.45 1.03 1.19 -0.10 0.00 0.00 175.22 177.80 2vl4 n PHE 776 N 1.38 0.18 -4.26 0.36 3.72 -1.26 -4.93 117.46 112.65 2vl4 n PHE 776 Ca -0.14 0.05 -0.14 0.00 -0.05 0.00 0.00 57.45 57.16 2vl4 n PHE 776 Cb 0.53 -0.34 -0.10 0.00 -0.94 0.00 0.00 39.48 38.62 2vl4 n PHE 776 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2vl4 s ARG 777 N -3.15 1.13 0.54 -1.08 1.81 -1.25 -4.98 118.95 111.96 2vl4 s ARG 777 Ca 0.05 -1.53 -0.22 0.00 -1.72 0.00 0.00 55.73 52.30 2vl4 s ARG 777 Cb 0.15 -0.44 -0.05 0.00 -0.45 0.00 0.00 34.95 34.16 2vl4 s ARG 777 CO 0.81 -0.06 1.36 0.15 -0.68 0.00 0.00 175.30 176.88 2vl4 s LYS 778 N -3.85 3.17 0.26 3.54 1.02 -1.26 -4.84 119.74 117.78 2vl4 s LYS 778 Ca 0.22 2.25 -0.01 0.00 0.02 0.00 0.00 55.97 58.45 2vl4 s LYS 778 Cb 0.05 -2.28 0.53 0.00 -0.52 0.00 0.00 37.83 35.61 2vl4 s LYS 778 CO 0.04 -1.17 1.77 1.15 -0.92 0.00 0.00 175.35 176.22 2vl4 h THR 779 N 1.49 0.76 0.00 2.17 2.02 -1.93 0.73 112.91 118.16 2vl4 h THR 779 Ca -0.51 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 66.44 2vl4 h THR 779 Cb 1.30 0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 67.73 2vl4 h THR 779 CO 0.57 0.12 -0.00 0.07 0.37 0.00 0.00 175.52 176.65 2vl4 h LYS 780 N 0.68 0.00 -0.01 6.66 2.10 -1.19 -1.87 116.57 122.94 2vl4 h LYS 780 Ca 0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.11 2vl4 h LYS 780 Cb 0.62 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.95 2vl4 h LYS 780 CO -0.34 0.00 -0.59 -0.25 -2.00 0.00 0.00 179.45 176.27 2vl4 n ASP 781 N -3.14 1.28 -4.78 7.07 8.00 0.23 -4.87 116.55 120.34 2vl4 n ASP 781 Ca -0.03 -1.04 -0.37 0.00 0.71 0.00 0.00 54.79 54.07 2vl4 n ASP 781 Cb 0.10 0.53 -0.04 0.00 -0.02 0.00 0.00 41.12 41.69 2vl4 n ASP 781 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2vl4 s LEU 782 N -2.72 4.22 -1.16 0.64 1.43 -0.71 -4.81 118.68 115.57 2vl4 s LEU 782 Ca 0.15 2.04 -0.06 0.00 -1.03 0.00 0.00 54.13 55.23 2vl4 s LEU 782 Cb 0.18 -4.09 0.25 0.00 0.03 0.00 0.00 46.19 42.56 2vl4 s LEU 782 CO 0.67 -0.39 1.62 0.00 0.23 0.00 0.00 176.35 178.48 2vl4 n GLN 783 N 0.17 4.12 -2.30 1.70 6.02 -0.32 -5.01 117.38 121.76 2vl4 n GLN 783 Ca 0.04 -4.17 -0.42 0.00 -0.01 0.00 0.00 57.00 52.44 2vl4 n GLN 783 Cb 0.49 -2.67 -0.03 0.00 1.02 0.00 0.00 30.24 29.05 2vl4 n GLN 783 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2vl4 s LEU 784 N -1.70 4.37 0.33 1.08 1.43 -1.26 -4.90 118.68 118.03 2vl4 s LEU 784 Ca 0.34 2.17 -0.27 0.00 -1.03 0.00 0.00 54.13 55.34 2vl4 s LEU 784 Cb 0.06 -3.58 -0.09 0.00 0.03 0.00 0.00 46.19 42.60 2vl4 s LEU 784 CO 0.06 -0.55 1.05 -2.16 0.23 0.00 0.00 176.35 174.98 2vl4 s PRO 785 N 1.00 4.47 0.13 1.29 0.04 -1.26 -4.99 135.00 135.68 2vl4 s PRO 785 Ca 0.61 1.61 -0.35 0.00 0.04 0.00 0.00 61.00 62.91 2vl4 s PRO 785 Cb -0.33 -2.91 -0.16 0.00 0.04 0.00 0.00 34.50 31.14 2vl4 s PRO 785 CO 0.30 0.11 1.32 -2.30 0.04 0.00 0.00 177.00 176.47 2vl4 n PRO 786 N 0.67 1.31 -3.60 0.56 -0.02 -1.26 -4.95 135.00 127.71 2vl4 n PRO 786 Ca 0.01 0.47 -0.14 0.00 -2.02 0.00 0.00 63.50 61.82 2vl4 n PRO 786 Cb 0.47 -2.08 -0.06 0.00 -0.02 0.00 0.00 33.50 31.81 2vl4 n PRO 786 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2vl4 s THR 787 N 0.29 0.03 -0.17 3.45 -1.32 -1.26 -5.01 115.64 111.65 2vl4 s THR 787 Ca 0.80 -0.26 -0.06 0.00 -1.21 0.00 0.00 61.69 60.96 2vl4 s THR 787 Cb -0.88 -0.94 -0.03 0.00 -1.51 0.00 0.00 72.50 69.14 2vl4 s THR 787 CO 0.48 -0.14 0.02 -0.44 -2.21 0.00 0.00 174.62 172.32 2vl4 s SER 788 N -1.82 5.22 -0.32 8.08 0.01 -1.26 -5.00 113.70 118.61 2vl4 s SER 788 Ca -0.07 -0.03 -0.19 0.00 1.31 0.00 0.00 55.95 56.97 2vl4 s SER 788 Cb -0.01 -1.88 -0.01 0.00 0.21 0.00 0.00 66.02 64.33 2vl4 s SER 788 CO 0.00 0.16 0.59 -0.69 0.41 0.00 0.00 173.24 173.71 2vl4 s VAL 789 N 0.44 4.96 0.12 3.43 1.01 -1.26 -4.57 120.40 124.53 2vl4 s VAL 789 Ca -0.00 0.69 0.02 0.00 0.00 0.00 0.00 61.98 62.69 2vl4 s VAL 789 Cb -0.13 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 2vl4 s VAL 789 CO 0.02 -0.16 0.25 -0.94 0.00 0.00 0.00 175.10 174.26 2vl4 s SER 790 N 1.69 6.27 0.02 3.32 1.04 -0.31 -4.95 113.70 120.79 2vl4 s SER 790 Ca 0.23 0.18 -0.03 0.00 0.48 0.00 0.00 55.95 56.81 2vl4 s SER 790 Cb -0.15 -1.88 -0.02 0.00 0.10 0.00 0.00 66.02 64.07 2vl4 s SER 790 CO 0.12 0.09 0.03 -0.72 0.98 0.00 0.00 173.24 173.75 2vl4 s TYR 791 N -1.66 0.23 -0.08 5.02 -0.85 -1.26 -0.40 117.35 118.36 2vl4 s TYR 791 Ca 0.34 -0.51 0.00 0.00 -0.52 0.00 0.00 57.07 56.39 2vl4 s TYR 791 Cb -0.12 -0.18 -0.03 0.00 0.38 0.00 0.00 41.96 42.02 2vl4 s TYR 791 CO 0.28 -0.27 -0.07 -0.65 -1.52 0.00 0.00 175.55 173.32 2vl4 s GLN 792 N -1.98 2.86 -0.22 -3.49 -0.21 -0.28 -4.94 119.66 111.40 2vl4 s GLN 792 Ca -0.11 -0.56 0.02 0.00 0.02 0.00 0.00 55.36 54.73 2vl4 s GLN 792 Cb -0.06 -2.61 0.05 0.00 1.00 0.00 0.00 33.01 31.39 2vl4 s GLN 792 CO -0.02 0.59 -0.11 1.41 -2.12 0.00 0.00 175.29 175.04 2vl4 s MET 793 N -0.62 2.18 -0.56 2.91 -2.45 -1.26 -0.03 119.30 119.47 2vl4 s MET 793 Ca 0.09 -1.05 -0.12 0.00 -1.25 0.00 0.00 55.69 53.36 2vl4 s MET 793 Cb -0.12 -2.64 0.14 0.00 1.25 0.00 0.00 34.83 33.47 2vl4 s MET 793 CO 0.02 -0.48 0.47 0.21 1.05 0.00 0.00 175.02 176.29 2vl4 s LYS 794 N 1.27 2.82 -0.30 4.11 2.20 0.15 -4.95 119.74 125.04 2vl4 s LYS 794 Ca -0.04 -1.91 -0.14 0.00 -0.36 0.00 0.00 55.97 53.52 2vl4 s LYS 794 Cb -0.18 -4.11 -0.03 0.00 -1.51 0.00 0.00 37.83 32.00 2vl4 s LYS 794 CO -0.07 -1.25 0.35 -1.14 -0.36 0.00 0.00 175.35 172.87 2vl4 s GLN 795 N 1.16 3.85 0.00 4.03 0.74 -1.26 -1.45 119.66 126.73 2vl4 s GLN 795 Ca 0.07 -0.16 0.00 0.00 0.05 0.00 0.00 55.36 55.32 2vl4 s GLN 795 Cb -0.25 -3.71 0.00 0.00 1.10 0.00 0.00 33.01 30.16 2vl4 s GLN 795 CO -0.01 -0.35 0.00 0.25 -0.55 0.00 0.00 175.29 174.63 2vl4 n THR 796 N 5.16 0.00 -2.41 -0.34 -2.24 -0.73 -4.54 114.28 109.17 2vl4 n THR 796 Ca -0.09 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 2vl4 n THR 796 Cb 0.50 -0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 68.22 2vl4 n THR 796 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2vl4 s ASP 797 N -0.57 7.04 -0.63 3.42 1.01 -1.26 -3.14 116.67 122.53 2vl4 s ASP 797 Ca 0.00 1.94 0.00 0.00 0.71 0.00 0.00 52.55 55.20 2vl4 s ASP 797 Cb 0.00 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.36 2vl4 s ASP 797 CO 0.00 -0.55 0.00 0.61 0.21 0.00 0.00 175.17 175.44 2vl4 n GLY 798 N 3.34 0.65 3.13 0.21 0.00 0.97 -4.95 105.19 108.53 2vl4 n GLY 798 Ca 0.10 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 2vl4 n GLY 798 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2vl4 s LYS 799 N -2.26 0.33 -0.14 1.61 2.20 -1.19 -2.52 119.74 117.78 2vl4 s LYS 799 Ca 0.00 0.22 -0.03 0.00 -0.36 0.00 0.00 55.97 55.80 2vl4 s LYS 799 Cb 0.00 0.15 0.05 0.00 -1.51 0.00 0.00 37.83 36.52 2vl4 s LYS 799 CO 0.00 -0.05 0.04 0.00 -0.36 0.00 0.00 175.35 174.98 2vl4 s GLU 801 N 1.98 3.54 -0.05 0.00 2.02 -0.53 -0.13 118.70 125.53 2vl4 s GLU 801 Ca 0.02 -0.59 -0.02 0.00 0.02 0.00 0.00 54.97 54.40 2vl4 s GLU 801 Cb -0.15 -3.64 -0.04 0.00 0.10 0.00 0.00 34.13 30.40 2vl4 s GLU 801 CO -0.07 -0.36 0.04 -0.51 0.02 0.00 0.00 175.26 174.39 2vl4 s LEU 802 N 1.68 3.76 -0.17 1.80 1.43 0.22 0.30 118.68 127.71 2vl4 s LEU 802 Ca 0.06 0.17 0.01 0.00 -1.03 0.00 0.00 54.13 53.34 2vl4 s LEU 802 Cb -0.17 -2.01 0.02 0.00 0.03 0.00 0.00 46.19 44.06 2vl4 s LEU 802 CO 0.08 0.34 -0.20 -0.89 0.23 0.00 0.00 176.35 175.91 2vl4 s THR 803 N -1.02 2.04 -0.03 5.49 2.01 0.95 -1.21 115.64 123.87 2vl4 s THR 803 Ca 0.17 -0.94 0.02 0.00 0.31 0.00 0.00 61.69 61.25 2vl4 s THR 803 Cb -0.12 -1.83 -0.03 0.00 0.01 0.00 0.00 72.50 70.53 2vl4 s THR 803 CO 0.07 0.54 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.72 2vl4 s LEU 804 N 1.13 3.19 -0.03 4.42 1.02 -0.01 -1.13 118.68 127.28 2vl4 s LEU 804 Ca 0.01 -0.07 -0.02 0.00 0.02 0.00 0.00 54.13 54.07 2vl4 s LEU 804 Cb -0.14 -1.76 0.01 0.00 0.02 0.00 0.00 46.19 44.32 2vl4 s LEU 804 CO -0.09 0.33 0.07 0.12 0.02 0.00 0.00 176.35 176.79 2vl4 s PHE 805 N -0.90 -0.07 -0.09 0.29 5.36 0.47 -1.83 117.98 121.22 2vl4 s PHE 805 Ca 0.15 0.20 -0.05 0.00 -0.96 0.00 0.00 56.93 56.27 2vl4 s PHE 805 Cb -0.11 -0.03 0.04 0.00 -0.34 0.00 0.00 43.02 42.58 2vl4 s PHE 805 CO 0.04 -0.06 0.20 0.45 -1.46 0.00 0.00 175.22 174.40 2vl4 s SER 806 N 0.35 -0.20 0.44 6.13 0.15 -1.26 -1.16 113.70 118.15 2vl4 s SER 806 Ca -0.03 0.42 0.23 0.00 0.70 0.00 0.00 55.95 57.28 2vl4 s SER 806 Cb -0.04 0.33 0.96 0.00 -1.71 0.00 0.00 66.02 65.56 2vl4 s SER 806 CO -0.01 -0.14 1.85 0.77 1.20 0.00 0.00 173.24 176.91 2vl4 h SER 807 N 6.94 0.00 -2.35 5.45 4.64 -1.91 0.66 113.55 126.98 2vl4 h SER 807 Ca -0.38 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.33 2vl4 h SER 807 Cb 1.16 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.11 2vl4 h SER 807 CO 0.39 0.24 -0.76 -0.04 -0.87 0.00 0.00 176.83 175.79 2vl4 s MET 808 N -3.75 1.64 0.12 4.77 -1.94 -1.26 -3.20 119.30 115.68 2vl4 s MET 808 Ca -0.00 -1.74 -0.35 0.00 -1.71 0.00 0.00 55.69 51.89 2vl4 s MET 808 Cb 0.11 -1.73 -0.14 0.00 2.01 0.00 0.00 34.83 35.08 2vl4 s MET 808 CO 0.64 0.32 1.55 -0.11 -0.01 0.00 0.00 175.02 177.41 2vl4 n LEU 809 N -0.54 2.81 -4.18 -0.03 7.94 -0.17 -4.30 117.00 118.52 2vl4 n LEU 809 Ca -0.06 1.08 -0.33 0.00 -1.11 0.00 0.00 56.01 55.59 2vl4 n LEU 809 Cb 0.60 -1.37 -0.16 0.00 0.53 0.00 0.00 43.42 43.02 2vl4 n LEU 809 CO 0.37 -0.43 -0.50 0.00 -1.11 0.00 0.00 177.39 175.72 2vl4 s ALA 810 N 1.06 2.44 -0.07 1.96 0.00 -0.42 -4.69 121.76 122.04 2vl4 s ALA 810 Ca 0.81 -1.18 -0.18 0.00 0.00 0.00 0.00 51.96 51.41 2vl4 s ALA 810 Cb -0.74 -1.27 -0.05 0.00 0.00 0.00 0.00 23.12 21.06 2vl4 s ALA 810 CO 0.41 -0.30 0.50 0.21 0.00 0.00 0.00 175.76 176.58 2vl4 s LYS 811 N 1.24 4.27 -1.27 0.00 2.47 -1.26 -0.51 119.74 124.67 2vl4 s LYS 811 Ca 0.03 0.53 -0.16 0.00 -1.56 0.00 0.00 55.97 54.81 2vl4 s LYS 811 Cb -0.14 -3.38 0.01 0.00 -1.46 0.00 0.00 37.83 32.86 2vl4 s LYS 811 CO -0.09 0.30 0.58 -0.25 0.16 0.00 0.00 175.35 176.05 2vl4 n ASP 812 N 3.12 -2.96 -4.77 1.43 8.00 -1.23 -2.23 116.55 117.91 2vl4 n ASP 812 Ca -0.08 -1.11 -0.39 0.00 0.71 0.00 0.00 54.79 53.92 2vl4 n ASP 812 Cb 0.52 -2.71 -0.02 0.00 -0.02 0.00 0.00 41.12 38.88 2vl4 n ASP 812 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2vl4 s ILE 813 N -3.71 2.99 -0.27 0.53 -4.36 0.70 -4.60 121.20 112.48 2vl4 s ILE 813 Ca 0.30 0.88 0.01 0.00 -0.26 0.00 0.00 60.65 61.58 2vl4 s ILE 813 Cb -0.13 -3.52 0.05 0.00 1.25 0.00 0.00 42.46 40.11 2vl4 s ILE 813 CO 0.91 0.13 -0.08 0.12 0.24 0.00 0.00 174.94 176.26 2vl4 s PHE 814 N -1.31 3.22 -0.49 1.37 5.36 0.11 -0.99 117.98 125.26 2vl4 s PHE 814 Ca 0.54 -2.08 -0.24 0.00 -0.96 0.00 0.00 56.93 54.19 2vl4 s PHE 814 Cb -0.34 -2.00 0.03 0.00 -0.34 0.00 0.00 43.02 40.38 2vl4 s PHE 814 CO 0.44 -0.84 0.88 0.42 -1.46 0.00 0.00 175.22 174.66 2vl4 s ILE 815 N 1.18 4.51 -0.14 3.12 1.01 -1.26 -0.85 121.20 128.77 2vl4 s ILE 815 Ca -0.06 0.45 -0.03 0.00 0.00 0.00 0.00 60.65 61.01 2vl4 s ILE 815 Cb -0.19 -4.43 -0.03 0.00 0.01 0.00 0.00 42.46 37.82 2vl4 s ILE 815 CO -0.04 -0.90 -0.06 -0.70 0.00 0.00 0.00 174.94 173.25 2vl4 s GLU 816 N 3.65 3.53 0.07 2.79 2.12 0.18 -4.96 118.70 126.09 2vl4 s GLU 816 Ca 0.32 -0.55 0.05 0.00 0.36 0.00 0.00 54.97 55.15 2vl4 s GLU 816 Cb -0.12 -2.83 -0.03 0.00 0.26 0.00 0.00 34.13 31.41 2vl4 s GLU 816 CO 0.22 0.28 -0.15 0.95 -0.54 0.00 0.00 175.26 176.02 2vl4 s THR 817 N 0.24 1.19 -1.70 -1.70 -4.23 -1.26 -0.21 115.64 107.96 2vl4 s THR 817 Ca -0.04 -1.31 0.31 0.00 -1.18 0.00 0.00 61.69 59.47 2vl4 s THR 817 Cb -0.14 -1.13 0.65 0.00 1.34 0.00 0.00 72.50 73.22 2vl4 s THR 817 CO 0.03 -0.18 2.07 -0.81 -0.54 0.00 0.00 174.62 175.19 2vl4 n PRO 818 N 1.31 0.72 -2.45 3.99 -0.05 -1.26 -4.79 135.00 132.46 2vl4 n PRO 818 Ca -0.21 -0.07 -0.43 0.00 -0.05 0.00 0.00 63.50 62.74 2vl4 n PRO 818 Cb 0.54 -1.50 -0.02 0.00 -0.05 0.00 0.00 33.50 32.47 2vl4 n PRO 818 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 175.50 174.28 2vl4 s LEU 819 N -2.33 3.64 0.31 1.53 2.96 -1.26 -4.97 118.68 118.55 2vl4 s LEU 819 Ca 0.36 0.74 -0.30 0.00 -0.22 0.00 0.00 54.13 54.71 2vl4 s LEU 819 Cb 0.21 -3.54 -0.12 0.00 0.50 0.00 0.00 46.19 43.24 2vl4 s LEU 819 CO 0.43 -1.33 1.53 0.00 -1.32 0.00 0.00 176.35 175.65 2vl4 n GLN 820 N 7.91 2.58 -0.88 1.98 1.13 -1.26 -2.57 117.38 126.26 2vl4 n GLN 820 Ca 0.15 0.91 0.00 0.00 -1.94 0.00 0.00 57.00 56.12 2vl4 n GLN 820 Cb 0.48 -2.66 0.00 0.00 0.11 0.00 0.00 30.24 28.18 2vl4 n GLN 820 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2vl4 n GLY 821 N 1.66 0.25 3.65 1.08 0.00 -1.25 -5.00 105.19 105.58 2vl4 n GLY 821 Ca 0.07 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.64 2vl4 n GLY 821 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vl4 n ALA 822 N 1.00 0.71 -2.87 4.61 0.00 -1.06 -4.87 120.51 118.04 2vl4 n ALA 822 Ca 0.00 0.40 -0.34 0.00 0.00 0.00 0.00 53.44 53.49 2vl4 n ALA 822 Cb 0.20 -2.19 -0.06 0.00 0.00 0.00 0.00 19.45 17.40 2vl4 n ALA 822 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2vl4 s ARG 823 N -1.10 3.35 0.00 0.00 0.52 0.12 -4.82 118.95 117.02 2vl4 s ARG 823 Ca 0.63 -0.30 0.08 0.00 -0.52 0.00 0.00 55.73 55.62 2vl4 s ARG 823 Cb -0.65 -3.07 -0.02 0.00 0.52 0.00 0.00 34.95 31.72 2vl4 s ARG 823 CO 0.56 0.70 -0.24 0.71 0.02 0.00 0.00 175.30 177.05 2vl4 s TYR 824 N -1.19 2.16 0.32 -0.53 2.02 -1.26 -0.42 117.35 118.44 2vl4 s TYR 824 Ca 0.22 -0.40 0.10 0.00 -0.37 0.00 0.00 57.07 56.62 2vl4 s TYR 824 Cb -0.12 -1.35 0.54 0.00 -0.40 0.00 0.00 41.96 40.62 2vl4 s TYR 824 CO 0.13 0.02 1.73 0.66 -1.57 0.00 0.00 175.55 176.51 2vl4 h SER 825 N 5.28 0.08 -5.01 2.29 4.64 -1.48 -3.45 113.55 115.91 2vl4 h SER 825 Ca -0.43 -0.04 -0.02 0.00 -0.47 0.00 0.00 61.79 60.83 2vl4 h SER 825 Cb 1.13 -0.02 -0.12 0.00 -0.31 0.00 0.00 62.40 63.08 2vl4 h SER 825 CO 0.46 0.52 0.17 -0.62 -0.87 0.00 0.00 176.83 176.50 2vl4 s ASP 826 N -6.90 -0.52 -0.00 4.97 -1.08 -1.26 -4.99 116.67 106.88 2vl4 s ASP 826 Ca -0.03 -0.04 -0.29 0.00 -0.52 0.00 0.00 52.55 51.67 2vl4 s ASP 826 Cb 0.14 0.58 0.10 0.00 -1.46 0.00 0.00 42.92 42.28 2vl4 s ASP 826 CO 0.75 -0.95 0.95 0.21 0.52 0.00 0.00 175.17 176.65 2vl4 s ASN 827 N -2.75 -0.30 -1.20 -0.34 3.84 -1.26 -4.91 114.94 108.02 2vl4 s ASN 827 Ca 0.01 -0.07 -0.03 0.00 0.21 0.00 0.00 52.86 52.99 2vl4 s ASN 827 Cb -0.01 0.37 -0.02 0.00 -0.55 0.00 0.00 41.25 41.05 2vl4 s ASN 827 CO -0.13 -0.61 0.87 0.49 -2.79 0.00 0.00 177.10 174.93 2vl4 n PHE 828 N -0.27 -2.14 -4.27 0.43 3.72 -0.16 -4.92 117.46 109.85 2vl4 n PHE 828 Ca -0.07 0.86 -0.15 0.00 -0.05 0.00 0.00 57.45 58.03 2vl4 n PHE 828 Cb 0.61 -4.55 -0.10 0.00 -0.94 0.00 0.00 39.48 34.50 2vl4 n PHE 828 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 176.76 176.12 2vl4 s PHE 829 N -3.47 1.34 -0.11 1.38 -0.12 -1.18 -4.81 117.98 111.00 2vl4 s PHE 829 Ca 0.13 -0.82 -0.27 0.00 -0.05 0.00 0.00 56.93 55.92 2vl4 s PHE 829 Cb -0.02 -0.72 -0.02 0.00 -0.63 0.00 0.00 43.02 41.63 2vl4 s PHE 829 CO 0.77 0.03 0.89 -0.51 -0.05 0.00 0.00 175.22 176.34 2vl4 s ASP 830 N -3.20 7.10 -0.27 1.98 1.01 -1.26 -0.21 116.67 121.82 2vl4 s ASP 830 Ca 0.20 1.35 -0.21 0.00 0.71 0.00 0.00 52.55 54.61 2vl4 s ASP 830 Cb 0.04 -2.50 -0.01 0.00 1.01 0.00 0.00 42.92 41.46 2vl4 s ASP 830 CO 0.03 -0.36 0.65 -0.22 0.21 0.00 0.00 175.17 175.48 2vl4 s LEU 831 N 1.78 4.09 0.22 1.23 2.96 0.33 -4.94 118.68 124.35 2vl4 s LEU 831 Ca 0.43 0.65 -0.20 0.00 -0.22 0.00 0.00 54.13 54.79 2vl4 s LEU 831 Cb -0.18 -2.88 -0.08 0.00 0.50 0.00 0.00 46.19 43.55 2vl4 s LEU 831 CO 0.17 -0.43 0.73 -0.76 -1.32 0.00 0.00 176.35 174.74 2vl4 s LEU 832 N 2.59 4.37 -0.04 -0.68 1.43 -1.26 -1.30 118.68 123.78 2vl4 s LEU 832 Ca 0.27 1.45 -0.36 0.00 -1.03 0.00 0.00 54.13 54.45 2vl4 s LEU 832 Cb -0.15 -3.56 -0.14 0.00 0.03 0.00 0.00 46.19 42.37 2vl4 s LEU 832 CO 0.10 0.05 1.65 -0.81 0.23 0.00 0.00 176.35 177.56 2vl4 n PRO 833 N 0.82 1.66 -1.79 1.29 -0.04 -1.26 -1.25 135.00 134.42 2vl4 n PRO 833 Ca -0.03 0.61 -0.21 0.00 -0.04 0.00 0.00 63.50 63.83 2vl4 n PRO 833 Cb 0.51 -2.34 -0.07 0.00 -0.04 0.00 0.00 33.50 31.55 2vl4 n PRO 833 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2vl4 n GLY 834 N 3.68 1.41 3.12 0.55 0.00 0.23 -4.78 105.19 109.40 2vl4 n GLY 834 Ca 0.21 -0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 2vl4 n GLY 834 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vl4 s GLU 835 N -4.07 2.22 0.67 1.61 2.02 -0.38 -5.02 118.70 115.74 2vl4 s GLU 835 Ca 0.00 -1.42 -0.17 0.00 0.02 0.00 0.00 54.97 53.40 2vl4 s GLU 835 Cb 0.00 -3.13 -0.01 0.00 0.10 0.00 0.00 34.13 31.09 2vl4 s GLU 835 CO 0.00 -0.68 1.10 0.54 0.02 0.00 0.00 175.26 176.24 2vl4 n ARG 836 N 4.52 0.82 -3.72 1.61 3.00 -1.26 -4.48 116.66 117.14 2vl4 n ARG 836 Ca -0.10 0.33 -0.14 0.00 -0.01 0.00 0.00 57.85 57.93 2vl4 n ARG 836 Cb 0.43 -2.34 -0.14 0.00 0.00 0.00 0.00 32.46 30.41 2vl4 n ARG 836 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 2vl4 s LYS 837 N -3.23 0.12 -0.15 5.56 2.47 -0.76 -4.97 119.74 118.78 2vl4 s LYS 837 Ca 0.78 0.47 -0.11 0.00 -1.56 0.00 0.00 55.97 55.54 2vl4 s LYS 837 Cb -0.37 -0.17 -0.05 0.00 -1.46 0.00 0.00 37.83 35.78 2vl4 s LYS 837 CO 0.45 -0.20 0.23 0.21 0.16 0.00 0.00 175.35 176.21 2vl4 s LYS 838 N 1.45 4.05 -0.07 4.03 2.20 -1.26 -0.83 119.74 129.31 2vl4 s LYS 838 Ca -0.07 -0.01 0.00 0.00 -0.36 0.00 0.00 55.97 55.54 2vl4 s LYS 838 Cb -0.11 -3.36 0.02 0.00 -1.51 0.00 0.00 37.83 32.87 2vl4 s LYS 838 CO -0.07 0.41 -0.05 0.08 -0.36 0.00 0.00 175.35 175.35 2vl4 s VAL 839 N -0.01 0.71 -0.24 4.02 1.01 -0.35 -4.90 120.40 120.65 2vl4 s VAL 839 Ca 0.14 -0.16 -0.09 0.00 0.00 0.00 0.00 61.98 61.88 2vl4 s VAL 839 Cb -0.13 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 2vl4 s VAL 839 CO 0.03 0.29 0.12 -0.63 0.00 0.00 0.00 175.10 174.91 2vl4 s ILE 840 N 1.32 4.90 -0.19 2.22 1.01 -1.26 -0.61 121.20 128.58 2vl4 s ILE 840 Ca -0.04 0.02 -0.10 0.00 0.00 0.00 0.00 60.65 60.54 2vl4 s ILE 840 Cb -0.14 -3.28 -0.05 0.00 0.01 0.00 0.00 42.46 39.00 2vl4 s ILE 840 CO -0.03 0.34 0.13 -0.63 0.00 0.00 0.00 174.94 174.76 2vl4 s ILE 841 N 1.28 5.42 0.06 2.92 1.01 0.81 -1.10 121.20 131.60 2vl4 s ILE 841 Ca 0.06 0.19 0.07 0.00 0.00 0.00 0.00 60.65 60.97 2vl4 s ILE 841 Cb -0.14 -3.47 -0.03 0.00 0.01 0.00 0.00 42.46 38.83 2vl4 s ILE 841 CO 0.05 0.45 -0.19 0.42 0.00 0.00 0.00 174.94 175.67 2vl4 s THR 842 N 0.25 1.54 -0.28 2.92 -4.23 0.44 -0.14 115.64 116.14 2vl4 s THR 842 Ca 0.09 -1.25 -0.25 0.00 -1.18 0.00 0.00 61.69 59.09 2vl4 s THR 842 Cb -0.11 -1.37 0.12 0.00 1.34 0.00 0.00 72.50 72.48 2vl4 s THR 842 CO -0.01 0.08 1.02 -0.55 -0.54 0.00 0.00 174.62 174.62 2vl4 s SER 843 N -1.38 -0.46 0.32 3.99 0.15 -1.05 -0.71 113.70 114.57 2vl4 s SER 843 Ca 0.06 0.88 0.17 0.00 0.70 0.00 0.00 55.95 57.75 2vl4 s SER 843 Cb -0.09 0.90 0.91 0.00 -1.71 0.00 0.00 66.02 66.03 2vl4 s SER 843 CO 0.02 -0.15 1.45 -0.81 1.20 0.00 0.00 173.24 174.95 2vl4 n PRO 844 N 2.25 0.11 -0.24 5.44 -0.04 -1.26 -1.97 135.00 139.29 2vl4 n PRO 844 Ca -0.13 0.60 0.12 0.00 -0.04 0.00 0.00 63.50 64.05 2vl4 n PRO 844 Cb 0.56 -2.04 0.26 0.00 -0.04 0.00 0.00 33.50 32.24 2vl4 n PRO 844 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2vl4 n ARG 845 N -2.14 2.51 -3.04 0.54 5.12 -1.26 -4.76 116.66 113.63 2vl4 n ARG 845 Ca -0.01 -2.31 -0.42 0.00 -1.93 0.00 0.00 57.85 53.19 2vl4 n ARG 845 Cb 0.20 -1.52 -0.06 0.00 -1.16 0.00 0.00 32.46 29.92 2vl4 n ARG 845 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2vl4 s ILE 846 N -1.36 4.86 -0.11 0.55 1.01 -0.83 -4.97 121.20 120.34 2vl4 s ILE 846 Ca 0.41 0.92 -0.05 0.00 0.00 0.00 0.00 60.65 61.94 2vl4 s ILE 846 Cb 0.23 -4.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 2vl4 s ILE 846 CO 0.32 -0.24 0.07 -0.54 0.00 0.00 0.00 174.94 174.54 2vl4 s LYS 847 N 2.80 3.31 0.00 2.79 1.02 -1.26 0.32 119.74 128.72 2vl4 s LYS 847 Ca 0.28 -0.28 -0.02 0.00 0.02 0.00 0.00 55.97 55.97 2vl4 s LYS 847 Cb -0.14 -3.01 -0.02 0.00 -0.52 0.00 0.00 37.83 34.13 2vl4 s LYS 847 CO 0.13 0.68 0.35 1.17 -0.92 0.00 0.00 175.35 176.76 2vl4 n LYS 848 N 2.26 0.00 0.00 1.68 3.00 -1.24 -4.79 118.16 119.07 2vl4 n LYS 848 Ca -0.19 -0.08 0.00 0.00 -0.00 0.00 0.00 58.31 58.04 2vl4 n LYS 848 Cb 0.54 -1.13 0.00 0.00 0.00 0.00 0.00 35.03 34.44 2vl4 n LYS 848 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2vl4 n GLU 850 N 3.35 0.00 0.00 1.64 -0.58 -1.26 -4.96 120.64 118.83 2vl4 n GLU 850 Ca 0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 2vl4 n GLU 850 Cb 0.13 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.00 2vl4 n GLU 850 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2vl4 n GLU 851 N -0.41 0.00 -2.35 3.49 4.07 -1.26 -4.46 120.64 119.72 2vl4 n GLU 851 Ca 0.00 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.68 2vl4 n GLU 851 Cb 0.00 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.35 2vl4 n GLU 851 CO 0.00 0.00 0.00 -1.17 -0.06 0.00 0.00 177.13 175.90 2vl4 s LEU 852 N 0.00 4.31 0.06 4.31 2.96 -1.26 -4.97 118.68 124.08 2vl4 s LEU 852 Ca 0.00 1.97 -0.31 0.00 -0.22 0.00 0.00 54.13 55.57 2vl4 s LEU 852 Cb 0.00 -3.56 -0.08 0.00 0.50 0.00 0.00 46.19 43.05 2vl4 s LEU 852 CO 0.00 -0.63 1.67 -2.84 -1.32 0.00 0.00 176.35 173.23 2vl4 s PRO 853 N 2.14 4.19 -0.06 0.98 0.02 -1.26 -5.01 135.00 136.00 2vl4 s PRO 853 Ca 0.60 2.34 0.01 0.00 0.02 0.00 0.00 61.00 63.97 2vl4 s PRO 853 Cb -0.28 -3.65 0.02 0.00 0.02 0.00 0.00 34.50 30.61 2vl4 s PRO 853 CO 0.25 -0.76 -0.08 0.08 -0.33 0.00 0.00 177.00 176.16 2vl4 s VAL 854 N 2.82 0.85 -0.20 3.83 1.01 -1.26 -4.26 120.40 123.20 2vl4 s VAL 854 Ca 0.75 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 62.45 2vl4 s VAL 854 Cb -0.40 -0.83 0.03 0.00 0.00 0.00 0.00 36.38 35.19 2vl4 s VAL 854 CO 0.33 0.30 -0.17 0.21 0.00 0.00 0.00 175.10 175.77 2vl4 s ASN 855 N 0.93 3.40 -0.28 3.32 2.47 0.71 -4.97 114.94 120.52 2vl4 s ASN 855 Ca -0.10 -0.82 -0.10 0.00 0.42 0.00 0.00 52.86 52.26 2vl4 s ASN 855 Cb -0.15 -1.45 -0.03 0.00 -1.45 0.00 0.00 41.25 38.18 2vl4 s ASN 855 CO 0.01 -0.06 0.14 -0.63 -3.72 0.00 0.00 177.10 172.84 2vl4 s ILE 856 N 1.28 4.79 0.09 -5.21 1.01 -1.26 -0.64 121.20 121.25 2vl4 s ILE 856 Ca 0.01 -0.12 0.05 0.00 0.00 0.00 0.00 60.65 60.59 2vl4 s ILE 856 Cb -0.15 -3.32 -0.04 0.00 0.01 0.00 0.00 42.46 38.96 2vl4 s ILE 856 CO -0.11 0.21 -0.00 -0.54 0.00 0.00 0.00 174.94 174.50 2vl4 s LYS 857 N 1.67 2.55 0.20 2.79 1.02 -0.03 -4.95 119.74 122.99 2vl4 s LYS 857 Ca 0.06 -0.83 -0.10 0.00 0.02 0.00 0.00 55.97 55.12 2vl4 s LYS 857 Cb -0.16 -2.54 -0.01 0.00 -0.52 0.00 0.00 37.83 34.60 2vl4 s LYS 857 CO 0.07 0.54 0.34 -3.38 -0.92 0.00 0.00 175.35 172.01 2vl4 s HIS 858 N -1.29 0.43 0.15 3.18 -3.43 -1.26 -0.72 115.29 112.35 2vl4 s HIS 858 Ca 0.25 -0.78 -0.16 0.00 -0.80 0.00 0.00 55.06 53.58 2vl4 s HIS 858 Cb -0.12 -0.00 0.02 0.00 -1.43 0.00 0.00 32.58 31.05 2vl4 s HIS 858 CO 0.18 -0.81 1.77 0.82 -2.00 0.00 0.00 174.74 174.70 2vl4 h ILE 859 N 2.44 1.15 -0.56 -5.38 1.08 -1.70 -2.57 117.51 111.97 2vl4 h ILE 859 Ca -0.30 -0.36 0.11 0.00 -0.39 0.00 0.00 64.86 63.91 2vl4 h ILE 859 Cb 1.24 0.60 -0.03 0.00 -3.07 0.00 0.00 36.82 35.56 2vl4 h ILE 859 CO 0.44 0.15 0.38 -0.09 -0.69 0.00 0.00 178.15 178.34 2vl4 h ARG 860 N 0.57 0.30 0.00 2.37 1.12 -1.92 -0.89 114.38 115.93 2vl4 h ARG 860 Ca 0.15 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 59.01 2vl4 h ARG 860 Cb 0.03 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 29.92 2vl4 h ARG 860 CO -0.03 0.20 0.00 0.93 -3.11 0.00 0.00 179.97 177.96 2vl4 h GLU 861 N 0.31 0.00 -0.00 0.20 5.08 -1.85 -3.16 114.58 115.17 2vl4 h GLU 861 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 2vl4 h GLU 861 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2vl4 h GLU 861 CO -0.06 0.00 -0.02 0.25 -1.00 0.00 0.00 179.01 178.18 2vl4 n THR 862 N -2.55 0.00 -3.92 1.13 -2.24 -0.34 -4.88 114.28 101.48 2vl4 n THR 862 Ca 0.01 -0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 2vl4 n THR 862 Cb 0.22 -0.46 -0.05 0.00 -2.10 0.00 0.00 70.33 67.94 2vl4 n THR 862 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2vl4 s TYR 863 N -2.72 0.22 -2.46 4.78 1.13 -1.19 -4.33 117.35 112.78 2vl4 s TYR 863 Ca 0.23 -0.59 0.20 0.00 -1.41 0.00 0.00 57.07 55.50 2vl4 s TYR 863 Cb 0.20 0.22 0.16 0.00 -1.10 0.00 0.00 41.96 41.43 2vl4 s TYR 863 CO 0.49 -0.93 1.12 1.63 -2.51 0.00 0.00 175.55 175.35