#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vl4 s ASN 28 N 0.00 6.30 0.09 1.61 3.84 -1.26 -4.87 114.94 120.65 2vl4 s ASN 28 Ca 0.00 -1.23 0.00 0.00 0.21 0.00 0.00 52.86 51.84 2vl4 s ASN 28 Cb 0.00 -2.57 -0.00 0.00 -0.55 0.00 0.00 41.25 38.13 2vl4 s ASN 28 CO 0.00 -1.69 0.11 -0.90 -2.79 0.00 0.00 177.10 171.83 2vl4 n ASP 29 N 9.53 -0.30 -0.27 -4.21 5.68 -1.26 -4.68 116.55 121.04 2vl4 n ASP 29 Ca 0.30 -1.52 0.13 0.00 -0.50 0.00 0.00 54.79 53.21 2vl4 n ASP 29 Cb 0.50 0.60 0.63 0.00 -1.14 0.00 0.00 41.12 41.71 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 -0.16 0.04 -1.35 2.12 -2.24 -0.16 -4.88 114.28 107.65 2vl4 n THR 30 Ca 0.01 -0.15 -0.31 0.00 -2.27 0.00 0.00 64.05 61.33 2vl4 n THR 30 Cb 0.15 0.04 0.08 0.00 -2.10 0.00 0.00 70.33 68.50 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 -1.85 4.72 0.02 3.42 1.04 -1.26 -4.88 113.70 114.91 2vl4 s SER 31 Ca 0.38 1.79 0.08 0.00 0.48 0.00 0.00 55.95 58.68 2vl4 s SER 31 Cb 0.19 -2.52 -0.02 0.00 0.10 0.00 0.00 66.02 63.77 2vl4 s SER 31 CO 0.31 -1.89 -0.23 -0.70 0.98 0.00 0.00 173.24 171.71 2vl4 s GLU 32 N -4.89 1.73 -0.03 4.02 2.12 -0.14 -4.99 118.70 116.52 2vl4 s GLU 32 Ca 0.61 -0.94 0.05 0.00 0.36 0.00 0.00 54.97 55.05 2vl4 s GLU 32 Cb -0.17 -1.78 -0.03 0.00 0.26 0.00 0.00 34.13 32.42 2vl4 s GLU 32 CO 0.55 0.47 -0.17 0.08 -0.54 0.00 0.00 175.26 175.65 2vl4 s VAL 33 N -0.68 2.82 -0.11 3.70 1.01 -1.26 -0.94 120.40 124.94 2vl4 s VAL 33 Ca 0.09 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.26 2vl4 s VAL 33 Cb -0.09 -2.09 0.01 0.00 0.00 0.00 0.00 36.38 34.21 2vl4 s VAL 33 CO 0.01 0.57 -0.21 -0.32 0.00 0.00 0.00 175.10 175.14 2vl4 s MET 34 N -0.77 2.75 -0.17 2.72 0.00 0.92 -4.97 119.30 119.78 2vl4 s MET 34 Ca 0.11 -0.77 -0.20 0.00 0.00 0.00 0.00 55.69 54.83 2vl4 s MET 34 Cb -0.10 -2.16 -0.03 0.00 0.00 0.00 0.00 34.83 32.54 2vl4 s MET 34 CO 0.01 0.08 0.59 -0.51 0.00 0.00 0.00 175.02 175.19 2vl4 s LEU 35 N 0.58 4.18 -1.16 4.11 1.43 -1.26 0.07 118.68 126.63 2vl4 s LEU 35 Ca -0.14 0.84 -0.09 0.00 -1.03 0.00 0.00 54.13 53.71 2vl4 s LEU 35 Cb -0.17 -2.85 0.24 0.00 0.03 0.00 0.00 46.19 43.45 2vl4 s LEU 35 CO 0.04 -0.19 1.44 0.18 0.23 0.00 0.00 176.35 178.05 2vl4 n LEU 36 N 4.64 5.96 -0.04 1.79 4.77 -0.17 -4.66 117.00 129.28 2vl4 n LEU 36 Ca -0.03 -4.89 0.02 0.00 -0.03 0.00 0.00 56.01 51.08 2vl4 n LEU 36 Cb 0.50 -1.45 0.03 0.00 -2.33 0.00 0.00 43.42 40.18 2vl4 n LEU 36 CO 0.44 1.33 0.48 -0.90 -1.33 0.00 0.00 177.39 177.40 2vl4 n ASP 37 N 3.13 1.76 -4.13 -1.43 5.75 -1.26 -4.61 116.55 115.76 2vl4 n ASP 37 Ca 0.30 -2.15 -0.09 0.00 -0.01 0.00 0.00 54.79 52.84 2vl4 n ASP 37 Cb 0.37 -0.11 -0.10 0.00 -1.03 0.00 0.00 41.12 40.25 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 -1.30 0.24 -0.58 2.12 -4.23 -1.26 -4.60 115.64 106.03 2vl4 s THR 38 Ca 0.08 -1.87 0.00 0.00 -1.18 0.00 0.00 61.69 58.71 2vl4 s THR 38 Cb 0.07 -1.79 0.00 0.00 1.34 0.00 0.00 72.50 72.12 2vl4 s THR 38 CO 0.01 -0.73 0.00 0.61 -0.54 0.00 0.00 174.62 173.96 2vl4 n GLY 39 N -0.01 0.78 3.83 3.99 0.00 -1.26 -4.88 105.19 107.64 2vl4 n GLY 39 Ca -0.10 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.07 3.42 0.10 1.61 0.52 -1.26 -4.46 118.94 116.80 2vl4 s TRP 40 Ca 0.00 1.42 0.03 0.00 0.02 0.00 0.00 56.10 57.58 2vl4 s TRP 40 Cb 0.00 -2.69 -0.04 0.00 -1.15 0.00 0.00 33.47 29.60 2vl4 s TRP 40 CO 0.00 0.07 -0.10 -1.21 0.02 0.00 0.00 176.95 175.74 2vl4 s GLU 41 N -2.82 0.87 0.11 4.98 2.02 0.35 -1.05 118.70 123.16 2vl4 s GLU 41 Ca 0.55 -1.22 0.04 0.00 0.02 0.00 0.00 54.97 54.35 2vl4 s GLU 41 Cb -0.11 -0.49 -0.04 0.00 0.10 0.00 0.00 34.13 33.58 2vl4 s GLU 41 CO 0.17 0.06 -0.09 -0.59 0.02 0.00 0.00 175.26 174.83 2vl4 s PHE 42 N -2.74 1.09 -0.09 1.61 -0.12 -0.15 -1.11 117.98 116.47 2vl4 s PHE 42 Ca 0.08 -0.74 -0.07 0.00 -0.05 0.00 0.00 56.93 56.15 2vl4 s PHE 42 Cb -0.01 -0.59 0.03 0.00 -0.63 0.00 0.00 43.02 41.83 2vl4 s PHE 42 CO -0.01 -0.00 0.23 0.45 -0.05 0.00 0.00 175.22 175.84 2vl4 s SER 43 N -2.81 -0.24 -0.06 1.98 0.15 0.43 -1.89 113.70 111.26 2vl4 s SER 43 Ca 0.10 0.47 -0.30 0.00 0.70 0.00 0.00 55.95 56.93 2vl4 s SER 43 Cb 0.01 0.43 -0.05 0.00 -1.71 0.00 0.00 66.02 64.70 2vl4 s SER 43 CO -0.01 -0.11 1.56 -1.58 1.20 0.00 0.00 173.24 174.30 2vl4 s GLN 44 N 0.52 4.20 0.23 5.44 0.74 -1.26 -0.98 119.66 128.56 2vl4 s GLN 44 Ca -0.03 2.08 -0.31 0.00 0.05 0.00 0.00 55.36 57.15 2vl4 s GLN 44 Cb -0.05 -3.87 -0.14 0.00 1.10 0.00 0.00 33.01 30.06 2vl4 s GLN 44 CO -0.03 -0.78 1.38 0.43 -0.55 0.00 0.00 175.29 175.74 2vl4 n SER 45 N 6.70 2.58 0.00 6.67 7.64 -0.10 -2.18 113.62 134.92 2vl4 n SER 45 Ca 0.16 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.18 2vl4 n SER 45 Cb 0.43 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.23 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 2.17 0.45 0.05 0.23 0.00 -1.26 -4.83 105.19 102.00 2vl4 n GLY 46 Ca 0.12 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.20 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 0.50 -1.61 2.61 -2.24 -0.93 -4.98 114.28 105.63 2vl4 n THR 47 Ca 0.00 -0.60 -0.18 0.00 -2.27 0.00 0.00 64.05 61.00 2vl4 n THR 47 Cb 0.00 -0.22 -0.07 0.00 -2.10 0.00 0.00 70.33 67.94 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 -2.49 -1.44 -4.56 -0.78 1.02 -1.26 -4.97 120.64 106.17 2vl4 n GLU 48 Ca -0.10 1.03 -0.33 0.00 -0.02 0.00 0.00 57.16 57.73 2vl4 n GLU 48 Cb 0.72 -5.39 -0.13 0.00 -0.02 0.00 0.00 31.44 26.62 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 -3.67 3.48 0.06 3.49 2.20 -1.26 -5.11 119.74 118.93 2vl4 s LYS 49 Ca 0.00 -0.58 0.09 0.00 -0.36 0.00 0.00 55.97 55.12 2vl4 s LYS 49 Cb 0.00 -2.78 -0.03 0.00 -1.51 0.00 0.00 37.83 33.50 2vl4 s LYS 49 CO 0.00 0.28 -0.23 -1.58 -0.36 0.00 0.00 175.35 173.45 2vl4 s TRP 50 N 0.24 2.41 0.05 4.03 0.52 -1.26 -4.32 118.94 120.60 2vl4 s TRP 50 Ca -0.05 -0.35 -0.07 0.00 0.02 0.00 0.00 56.10 55.65 2vl4 s TRP 50 Cb -0.14 -1.40 -0.01 0.00 -1.15 0.00 0.00 33.47 30.77 2vl4 s TRP 50 CO 0.04 0.20 0.13 -1.64 0.02 0.00 0.00 176.95 175.70 2vl4 s MET 51 N -1.44 0.67 0.49 4.98 -1.94 -0.79 -4.97 119.30 116.30 2vl4 s MET 51 Ca 0.13 -0.80 -0.22 0.00 -1.71 0.00 0.00 55.69 53.09 2vl4 s MET 51 Cb -0.10 0.27 -0.08 0.00 2.01 0.00 0.00 34.83 36.93 2vl4 s MET 51 CO 0.04 -0.18 1.13 -2.30 -0.01 0.00 0.00 175.02 173.69 2vl4 n PRO 52 N 0.54 1.44 -4.37 2.03 -0.02 -1.26 -0.98 135.00 132.37 2vl4 n PRO 52 Ca -0.18 0.52 -0.19 0.00 -2.02 0.00 0.00 63.50 61.63 2vl4 n PRO 52 Cb 0.60 -2.26 -0.10 0.00 -0.02 0.00 0.00 33.50 31.71 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 -1.33 2.09 -0.14 3.55 0.00 -0.22 -4.64 121.76 121.07 2vl4 s ALA 53 Ca 0.68 -1.76 -0.01 0.00 0.00 0.00 0.00 51.96 50.87 2vl4 s ALA 53 Cb -0.48 0.10 -0.01 0.00 0.00 0.00 0.00 23.12 22.73 2vl4 s ALA 53 CO 0.53 -0.04 -0.12 0.99 0.00 0.00 0.00 175.76 177.13 2vl4 s THR 54 N -3.07 3.13 -0.05 0.00 2.01 -1.26 -4.41 115.64 112.00 2vl4 s THR 54 Ca 0.26 -0.63 0.02 0.00 0.31 0.00 0.00 61.69 61.65 2vl4 s THR 54 Cb 0.02 -2.33 0.01 0.00 0.01 0.00 0.00 72.50 70.21 2vl4 s THR 54 CO 0.09 0.51 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.75 2vl4 s VAL 55 N 0.48 0.88 0.56 3.82 1.01 -1.26 -3.05 120.40 122.83 2vl4 s VAL 55 Ca -0.08 -0.34 -0.21 0.00 0.00 0.00 0.00 61.98 61.34 2vl4 s VAL 55 Cb -0.16 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 2vl4 s VAL 55 CO 0.04 0.29 1.30 -2.84 0.00 0.00 0.00 175.10 173.90 2vl4 s PRO 56 N 0.66 3.10 0.00 2.72 0.02 -1.26 -4.58 135.00 135.66 2vl4 s PRO 56 Ca -0.12 2.09 0.00 0.00 0.02 0.00 0.00 61.00 63.00 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 0.02 -1.17 0.00 0.41 -0.33 0.00 0.00 177.00 175.93 2vl4 n GLY 57 N 0.69 1.20 3.09 0.52 0.00 -0.36 -4.95 105.19 105.38 2vl4 n GLY 57 Ca 0.11 -0.72 -0.12 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.30 0.57 0.18 2.61 -4.23 -1.26 -3.58 115.64 107.63 2vl4 s THR 58 Ca 0.00 -1.34 -0.14 0.00 -1.18 0.00 0.00 61.69 59.03 2vl4 s THR 58 Cb 0.00 -0.93 0.11 0.00 1.34 0.00 0.00 72.50 73.01 2vl4 s THR 58 CO 0.00 -0.54 1.70 0.58 -0.54 0.00 0.00 174.62 175.82 2vl4 h VAL 59 N 4.03 0.67 -0.64 2.29 2.07 -1.58 -0.44 116.25 122.63 2vl4 h VAL 59 Ca -0.36 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.14 2vl4 h VAL 59 Cb 1.19 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 31.43 2vl4 h VAL 59 CO 0.48 0.03 0.40 0.45 0.02 0.00 0.00 177.57 178.95 2vl4 h HIS 60 N 0.14 0.76 -0.35 1.57 3.86 -1.97 0.43 115.15 119.59 2vl4 h HIS 60 Ca 0.23 0.02 -0.17 0.00 -1.16 0.00 0.00 60.37 59.30 2vl4 h HIS 60 Cb 0.34 -0.25 -0.00 0.00 1.06 0.00 0.00 27.41 28.56 2vl4 h HIS 60 CO -0.28 0.44 -0.44 0.37 0.86 0.00 0.00 177.93 178.88 2vl4 h GLN 61 N 0.80 0.91 -1.01 2.45 5.75 -1.91 0.49 115.11 122.60 2vl4 h GLN 61 Ca 0.26 -0.51 0.05 0.00 -0.15 0.00 0.00 58.65 58.29 2vl4 h GLN 61 Cb 0.00 0.03 -0.06 0.00 1.07 0.00 0.00 27.48 28.52 2vl4 h GLN 61 CO -0.10 1.16 0.66 -0.44 -2.65 0.00 0.00 178.83 177.46 2vl4 h ASP 62 N 0.73 1.08 -0.34 -0.69 3.32 -0.55 0.42 116.42 120.39 2vl4 h ASP 62 Ca 0.04 -0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 2vl4 h ASP 62 Cb 1.04 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 2vl4 h ASP 62 CO 0.10 0.72 -0.21 -0.07 -1.72 0.00 0.00 179.24 178.06 2vl4 h LEU 63 N 1.24 0.78 -0.84 1.55 3.38 -0.74 -3.02 115.31 117.66 2vl4 h LEU 63 Ca 0.41 -0.43 0.04 0.00 0.09 0.00 0.00 57.88 57.99 2vl4 h LEU 63 Cb 0.07 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.55 2vl4 h LEU 63 CO -0.14 1.04 0.54 0.40 0.09 0.00 0.00 178.44 180.36 2vl4 h ILE 64 N 0.52 1.12 0.00 1.22 2.04 -0.31 0.12 117.51 122.22 2vl4 h ILE 64 Ca 0.07 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.57 2vl4 h ILE 64 Cb 0.77 -0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 2vl4 h ILE 64 CO 0.06 0.19 -0.02 0.28 0.00 0.00 0.00 178.15 178.66 2vl4 h SER 65 N 1.03 0.00 -0.40 1.72 0.02 -0.04 -1.10 113.55 114.79 2vl4 h SER 65 Ca 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 2vl4 h SER 65 Cb 0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.57 2vl4 h SER 65 CO -0.12 0.02 0.00 1.41 -1.14 0.00 0.00 176.83 177.00 2vl4 n HIS 66 N -3.59 1.08 -3.30 3.45 8.25 -0.93 -4.96 115.22 115.22 2vl4 n HIS 66 Ca -0.03 -0.72 -0.24 0.00 -0.26 0.00 0.00 57.72 56.48 2vl4 n HIS 66 Cb 0.11 -0.26 0.01 0.00 1.12 0.00 0.00 29.99 30.97 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 0.19 -4.15 0.00 -0.41 1.02 -0.41 -4.87 120.64 112.01 2vl4 n GLU 67 Ca 0.21 0.64 0.13 0.00 -0.02 0.00 0.00 57.16 58.11 2vl4 n GLU 67 Cb 0.82 -5.42 0.28 0.00 -0.02 0.00 0.00 31.44 27.11 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 -3.93 1.82 -4.02 -4.62 4.77 0.37 -4.83 117.00 106.56 2vl4 n LEU 68 Ca -0.04 -0.60 -0.14 0.00 -0.03 0.00 0.00 56.01 55.19 2vl4 n LEU 68 Cb 0.57 -0.03 -0.13 0.00 -2.33 0.00 0.00 43.42 41.50 2vl4 n LEU 68 CO 0.52 0.32 -0.40 -0.76 -1.33 0.00 0.00 177.39 175.74 2vl4 s LEU 69 N -2.23 2.15 0.90 2.23 1.43 -1.22 -4.90 118.68 117.04 2vl4 s LEU 69 Ca 0.28 -0.36 -0.12 0.00 -1.03 0.00 0.00 54.13 52.90 2vl4 s LEU 69 Cb 0.20 -0.22 0.13 0.00 0.03 0.00 0.00 46.19 46.32 2vl4 s LEU 69 CO 0.43 -0.08 1.11 -2.16 0.23 0.00 0.00 176.35 175.88 2vl4 s PRO 70 N -0.96 1.22 -0.33 1.29 0.04 -1.26 -4.64 135.00 130.36 2vl4 s PRO 70 Ca -0.05 0.46 -0.35 0.00 0.04 0.00 0.00 61.00 61.11 2vl4 s PRO 70 Cb -0.07 -1.83 -0.11 0.00 0.04 0.00 0.00 34.50 32.53 2vl4 s PRO 70 CO 0.00 -2.18 2.17 -1.71 0.04 0.00 0.00 177.00 175.32 2vl4 n ASN 71 N -3.79 2.23 0.27 6.66 2.85 -1.26 -4.83 115.26 117.39 2vl4 n ASN 71 Ca 0.06 0.44 0.14 0.00 -0.11 0.00 0.00 54.58 55.12 2vl4 n ASN 71 Cb 0.58 -1.28 0.77 0.00 1.24 0.00 0.00 39.78 41.09 2vl4 n ASN 71 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2vl4 h PRO 72 N 12.26 0.00 0.00 1.20 0.13 -1.91 -2.66 132.00 141.03 2vl4 h PRO 72 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2vl4 h PRO 72 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2vl4 h PRO 72 CO 1.01 0.09 -0.36 1.19 -0.23 0.00 0.00 178.00 179.70 2vl4 n PHE 73 N -3.48 0.07 -2.91 1.56 3.72 -1.26 -3.96 117.46 111.20 2vl4 n PHE 73 Ca -0.01 0.02 -0.41 0.00 -0.05 0.00 0.00 57.45 57.00 2vl4 n PHE 73 Cb 0.24 -0.37 -0.04 0.00 -0.94 0.00 0.00 39.48 38.36 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 -3.02 3.66 0.00 1.38 5.04 -1.00 -4.74 117.35 118.67 2vl4 s TYR 74 Ca 0.11 1.48 0.00 0.00 -2.44 0.00 0.00 57.07 56.23 2vl4 s TYR 74 Cb 0.17 -2.92 0.00 0.00 0.35 0.00 0.00 41.96 39.56 2vl4 s TYR 74 CO 0.65 0.12 0.00 0.41 -1.34 0.00 0.00 175.55 175.39 2vl4 n GLY 75 N 2.80 2.05 1.40 8.97 0.00 0.46 -0.98 105.19 119.89 2vl4 n GLY 75 Ca 0.01 0.46 0.09 0.00 0.00 0.00 0.00 46.02 46.59 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 5.56 3.43 0.21 1.61 2.81 -1.26 -4.66 117.12 124.83 2vl4 n MET 76 Ca 0.00 -2.76 0.15 0.00 -1.81 0.00 0.00 57.70 53.27 2vl4 n MET 76 Cb 0.00 -1.77 0.76 0.00 -0.71 0.00 0.00 33.22 31.50 2vl4 n MET 76 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2vl4 h ASN 77 N 3.74 0.00 -0.53 7.83 2.35 -1.32 -3.25 115.58 124.41 2vl4 h ASN 77 Ca 0.00 0.00 0.08 0.00 -0.55 0.00 0.00 56.30 55.83 2vl4 h ASN 77 Cb 1.30 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 39.60 2vl4 h ASN 77 CO 0.17 0.00 0.15 -0.08 -1.65 0.00 0.00 177.43 176.02 2vl4 h GLU 78 N 0.00 0.29 -0.62 0.81 4.81 -1.81 -0.73 114.58 117.34 2vl4 h GLU 78 Ca 0.00 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.29 2vl4 h GLU 78 Cb 0.07 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.35 2vl4 h GLU 78 CO 0.00 0.19 0.41 0.87 -0.73 0.00 0.00 179.01 179.76 2vl4 h LYS 79 N 0.30 0.52 0.00 1.92 1.57 -1.95 -2.90 116.57 116.04 2vl4 h LYS 79 Ca 0.26 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 2vl4 h LYS 79 Cb 0.33 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.52 2vl4 h LYS 79 CO -0.30 0.34 0.00 1.63 -0.57 0.00 0.00 179.45 180.55 2vl4 n LYS 80 N -4.48 0.03 0.00 3.15 5.02 -0.29 -3.38 118.16 118.21 2vl4 n LYS 80 Ca 0.09 0.10 0.03 0.00 -2.02 0.00 0.00 58.31 56.51 2vl4 n LYS 80 Cb 0.30 -1.54 0.02 0.00 -0.02 0.00 0.00 35.03 33.79 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 -1.58 0.00 0.27 -0.18 -5.35 -1.09 -4.63 119.36 106.79 2vl4 n ILE 81 Ca 0.06 -0.48 0.13 0.00 -0.27 0.00 0.00 62.75 62.18 2vl4 n ILE 81 Cb 0.30 1.13 0.75 0.00 -1.74 0.00 0.00 39.64 40.08 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 1.20 0.00 -0.64 6.28 1.08 -1.63 -3.10 115.11 118.30 2vl4 h GLN 82 Ca 0.00 0.00 0.12 0.00 -1.45 0.00 0.00 58.65 57.32 2vl4 h GLN 82 Cb 0.27 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.66 2vl4 h GLN 82 CO 0.00 0.10 0.43 0.11 -0.95 0.00 0.00 178.83 178.53 2vl4 h TRP 83 N 0.00 0.39 -0.90 2.96 5.08 -1.83 -2.76 115.95 118.89 2vl4 h TRP 83 Ca -0.00 0.01 0.10 0.00 1.08 0.00 0.00 58.89 60.08 2vl4 h TRP 83 Cb 0.29 -0.12 -0.07 0.00 -3.00 0.00 0.00 29.16 26.26 2vl4 h TRP 83 CO 0.00 0.17 0.58 0.28 -1.28 0.00 0.00 178.44 178.19 2vl4 h VAL 84 N 0.35 0.97 0.00 0.12 2.07 -1.92 -1.66 116.25 116.18 2vl4 h VAL 84 Ca 0.31 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2vl4 h VAL 84 Cb 0.72 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2vl4 h VAL 84 CO -0.08 0.16 0.00 1.05 0.02 0.00 0.00 177.57 178.72 2vl4 h GLU 85 N 0.90 0.00 0.00 1.57 4.11 -1.71 -1.91 114.58 117.54 2vl4 h GLU 85 Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.85 2vl4 h GLU 85 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2vl4 h GLU 85 CO -0.18 0.00 -0.59 0.09 0.07 0.00 0.00 179.01 178.39 2vl4 n ASN 86 N -2.46 0.59 -4.92 3.06 3.02 -0.62 -4.30 115.26 109.63 2vl4 n ASN 86 Ca 0.01 -0.05 -0.27 0.00 -0.03 0.00 0.00 54.58 54.25 2vl4 n ASN 86 Cb 0.23 0.24 -0.02 0.00 -0.61 0.00 0.00 39.78 39.61 2vl4 n ASN 86 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2vl4 s GLU 87 N -3.10 3.57 0.28 3.52 0.41 -0.72 -4.91 118.70 117.75 2vl4 s GLU 87 Ca 0.08 -0.11 -0.05 0.00 -0.41 0.00 0.00 54.97 54.48 2vl4 s GLU 87 Cb 0.15 -2.63 -0.05 0.00 -1.78 0.00 0.00 34.13 29.82 2vl4 s GLU 87 CO 0.71 0.16 0.55 -0.51 -0.49 0.00 0.00 175.26 175.68 2vl4 s ASP 88 N -3.56 6.46 -0.03 -0.19 1.01 -1.26 -3.93 116.67 115.17 2vl4 s ASP 88 Ca 0.43 0.72 0.01 0.00 0.71 0.00 0.00 52.55 54.42 2vl4 s ASP 88 Cb -0.10 -2.15 0.01 0.00 1.01 0.00 0.00 42.92 41.69 2vl4 s ASP 88 CO 0.33 -0.18 -0.05 0.26 0.21 0.00 0.00 175.17 175.74 2vl4 s TRP 89 N -2.06 0.69 -0.04 4.23 0.52 -0.91 -0.93 118.94 120.44 2vl4 s TRP 89 Ca 0.44 -0.17 0.05 0.00 0.02 0.00 0.00 56.10 56.44 2vl4 s TRP 89 Cb -0.11 -0.57 -0.02 0.00 -1.15 0.00 0.00 33.47 31.62 2vl4 s TRP 89 CO 0.29 -0.13 -0.19 -1.21 0.02 0.00 0.00 176.95 175.74 2vl4 s GLU 90 N 0.55 2.39 0.02 4.98 2.02 -0.15 -0.06 118.70 128.44 2vl4 s GLU 90 Ca -0.07 -0.79 0.07 0.00 0.02 0.00 0.00 54.97 54.20 2vl4 s GLU 90 Cb -0.11 -2.25 -0.02 0.00 0.10 0.00 0.00 34.13 31.85 2vl4 s GLU 90 CO 0.00 0.58 -0.21 0.71 0.02 0.00 0.00 175.26 176.36 2vl4 s TYR 91 N -0.63 1.85 -0.01 1.61 2.02 -0.09 -0.43 117.35 121.68 2vl4 s TYR 91 Ca 0.10 -0.37 -0.07 0.00 -0.37 0.00 0.00 57.07 56.36 2vl4 s TYR 91 Cb -0.11 -1.14 0.00 0.00 -0.40 0.00 0.00 41.96 40.31 2vl4 s TYR 91 CO 0.00 0.04 0.14 -0.98 -1.57 0.00 0.00 175.55 173.18 2vl4 s ARG 92 N -0.88 0.45 0.11 -0.62 1.70 -0.27 -0.06 118.95 119.38 2vl4 s ARG 92 Ca 0.08 -0.32 -0.11 0.00 -0.47 0.00 0.00 55.73 54.91 2vl4 s ARG 92 Cb -0.08 0.19 0.01 0.00 -0.57 0.00 0.00 34.95 34.49 2vl4 s ARG 92 CO 0.01 -0.10 0.28 -0.08 -1.08 0.00 0.00 175.30 174.32 2vl4 s THR 93 N -1.19 0.11 0.21 4.99 -1.32 -0.61 -0.50 115.64 117.33 2vl4 s THR 93 Ca -0.13 -0.99 0.09 0.00 -1.21 0.00 0.00 61.69 59.46 2vl4 s THR 93 Cb -0.07 -1.33 -0.05 0.00 -1.51 0.00 0.00 72.50 69.54 2vl4 s THR 93 CO 0.01 -0.49 -0.18 -0.94 -2.21 0.00 0.00 174.62 170.81 2vl4 s SER 94 N -2.85 2.92 0.05 8.08 1.04 -1.26 -0.55 113.70 121.13 2vl4 s SER 94 Ca 0.05 -0.96 -0.20 0.00 0.48 0.00 0.00 55.95 55.32 2vl4 s SER 94 Cb 0.04 -0.19 0.05 0.00 0.10 0.00 0.00 66.02 66.01 2vl4 s SER 94 CO -0.10 -0.05 0.47 0.72 0.98 0.00 0.00 173.24 175.26 2vl4 s PHE 95 N -2.47 -0.35 -0.15 5.02 -0.12 -0.91 -4.97 117.98 114.02 2vl4 s PHE 95 Ca 0.22 0.35 -0.09 0.00 -0.05 0.00 0.00 56.93 57.37 2vl4 s PHE 95 Cb -0.04 0.29 -0.04 0.00 -0.63 0.00 0.00 43.02 42.60 2vl4 s PHE 95 CO 0.09 -0.62 0.14 0.42 -0.05 0.00 0.00 175.22 175.21 2vl4 s ILE 96 N -2.51 5.45 -0.05 -4.49 -1.09 -1.26 -0.87 121.20 116.38 2vl4 s ILE 96 Ca -0.05 0.22 0.06 0.00 -2.23 0.00 0.00 60.65 58.65 2vl4 s ILE 96 Cb -0.01 -3.44 -0.01 0.00 -1.58 0.00 0.00 42.46 37.42 2vl4 s ILE 96 CO -0.02 0.54 -0.24 -0.69 -1.23 0.00 0.00 174.94 173.29 2vl4 s VAL 97 N -0.41 2.17 0.51 2.92 1.01 -0.53 -4.97 120.40 121.11 2vl4 s VAL 97 Ca 0.12 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.08 2vl4 s VAL 97 Cb -0.12 -1.79 0.02 0.00 0.00 0.00 0.00 36.38 34.50 2vl4 s VAL 97 CO 0.02 0.57 0.73 -0.94 0.00 0.00 0.00 175.10 175.48 2vl4 s SER 98 N -0.27 5.46 0.21 3.32 1.04 -1.26 -0.79 113.70 121.41 2vl4 s SER 98 Ca -0.00 0.07 -0.09 0.00 0.48 0.00 0.00 55.95 56.41 2vl4 s SER 98 Cb -0.13 -1.08 0.16 0.00 0.10 0.00 0.00 66.02 65.07 2vl4 s SER 98 CO 0.03 -0.99 1.83 -0.08 0.98 0.00 0.00 173.24 175.01 2vl4 h GLU 99 N 0.19 1.07 -0.11 4.02 4.81 -1.98 -0.78 114.58 121.81 2vl4 h GLU 99 Ca -0.43 -0.12 -0.17 0.00 -0.13 0.00 0.00 59.36 58.51 2vl4 h GLU 99 Cb 1.28 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 2vl4 h GLU 99 CO 0.54 0.79 -0.64 1.05 -0.73 0.00 0.00 179.01 180.01 2vl4 h GLU 100 N 1.07 0.41 -0.77 1.92 9.09 -1.99 -2.21 114.58 122.10 2vl4 h GLU 100 Ca 0.27 -0.30 0.01 0.00 0.05 0.00 0.00 59.36 59.39 2vl4 h GLU 100 Cb 0.02 0.05 -0.04 0.00 -1.65 0.00 0.00 28.75 27.14 2vl4 h GLU 100 CO -0.04 0.92 0.51 1.96 0.05 0.00 0.00 179.01 182.41 2vl4 h GLN 101 N 0.30 1.01 0.00 1.06 4.20 -1.90 -2.37 115.11 117.41 2vl4 h GLN 101 Ca -0.01 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.64 2vl4 h GLN 101 Cb 1.19 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 28.75 2vl4 h GLN 101 CO 0.11 0.67 0.00 -0.07 -0.67 0.00 0.00 178.83 178.87 2vl4 h LEU 102 N 1.04 0.00 -0.19 1.46 3.38 -0.86 -2.63 115.31 117.51 2vl4 h LEU 102 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2vl4 h LEU 102 Cb -0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2vl4 h LEU 102 CO -0.06 0.00 -0.22 0.59 0.09 0.00 0.00 178.44 178.84 2vl4 n ASN 103 N -2.65 0.52 -4.72 -0.43 3.02 -0.86 -4.91 115.26 105.24 2vl4 n ASN 103 Ca 0.01 -0.40 -0.34 0.00 -0.03 0.00 0.00 54.58 53.82 2vl4 n ASN 103 Cb 0.24 -0.02 0.10 0.00 -0.61 0.00 0.00 39.78 39.50 2vl4 n ASN 103 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2vl4 s ARG 104 N -2.68 2.02 0.39 3.52 1.81 -0.99 -4.90 118.95 118.11 2vl4 s ARG 104 Ca 0.21 1.71 0.08 0.00 -1.72 0.00 0.00 55.73 56.02 2vl4 s ARG 104 Cb 0.19 -1.82 0.79 0.00 -0.45 0.00 0.00 34.95 33.65 2vl4 s ARG 104 CO 0.55 -1.92 1.96 -0.44 -0.68 0.00 0.00 175.30 174.77 2vl4 h ASP 105 N -0.50 0.35 -4.86 0.23 3.32 -1.72 -3.45 116.42 109.78 2vl4 h ASP 105 Ca -0.47 -0.05 -0.10 0.00 0.02 0.00 0.00 57.03 56.43 2vl4 h ASP 105 Cb 1.29 -0.09 -0.20 0.00 0.22 0.00 0.00 39.33 40.55 2vl4 h ASP 105 CO 0.49 0.40 -0.15 -0.83 -1.72 0.00 0.00 179.24 177.43 2vl4 s GLY 106 N -3.89 -0.28 -0.03 2.75 0.00 -0.63 -4.87 107.32 100.36 2vl4 s GLY 106 Ca -0.07 0.69 -0.00 0.00 0.00 0.00 0.00 44.72 45.34 2vl4 s GLY 106 CO 0.74 0.45 0.02 -0.42 0.00 0.00 0.00 173.10 173.88 2vl4 s ILE 107 N -1.11 0.07 0.03 0.90 1.01 -1.26 -1.45 121.20 119.39 2vl4 s ILE 107 Ca -0.11 0.18 0.07 0.00 0.00 0.00 0.00 60.65 60.78 2vl4 s ILE 107 Cb -0.04 -0.20 -0.03 0.00 0.01 0.00 0.00 42.46 42.20 2vl4 s ILE 107 CO 0.05 0.14 -0.18 -1.10 0.00 0.00 0.00 174.94 173.85 2vl4 s GLN 108 N 1.25 2.13 -0.23 2.79 -0.21 0.21 -0.64 119.66 124.96 2vl4 s GLN 108 Ca -0.07 -0.94 -0.06 0.00 0.02 0.00 0.00 55.36 54.31 2vl4 s GLN 108 Cb -0.13 -2.21 -0.02 0.00 1.00 0.00 0.00 33.01 31.65 2vl4 s GLN 108 CO -0.03 0.55 0.02 -1.17 -2.12 0.00 0.00 175.29 172.55 2vl4 s LEU 109 N -1.33 3.24 -0.18 2.90 2.96 0.93 -1.09 118.68 126.11 2vl4 s LEU 109 Ca 0.14 -0.26 -0.01 0.00 -0.22 0.00 0.00 54.13 53.78 2vl4 s LEU 109 Cb -0.10 -1.85 -0.00 0.00 0.50 0.00 0.00 46.19 44.73 2vl4 s LEU 109 CO 0.05 -0.01 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.32 2vl4 s ILE 110 N 1.45 2.88 -0.32 6.68 1.01 0.46 -0.19 121.20 133.17 2vl4 s ILE 110 Ca 0.05 -0.68 -0.07 0.00 0.00 0.00 0.00 60.65 59.96 2vl4 s ILE 110 Cb -0.15 -2.26 0.03 0.00 0.01 0.00 0.00 42.46 40.10 2vl4 s ILE 110 CO 0.01 0.49 0.10 -0.36 0.00 0.00 0.00 174.94 175.17 2vl4 s PHE 111 N 1.07 3.21 -0.42 3.97 0.08 0.05 -1.25 117.98 124.70 2vl4 s PHE 111 Ca -0.00 -1.27 0.26 0.00 0.12 0.00 0.00 56.93 56.04 2vl4 s PHE 111 Cb -0.15 -2.27 0.97 0.00 -0.57 0.00 0.00 43.02 41.00 2vl4 s PHE 111 CO -0.03 -0.68 1.77 0.93 -0.10 0.00 0.00 175.22 177.12 2vl4 h GLU 112 N 8.23 0.00 -1.07 0.44 5.08 -1.51 0.36 114.58 126.11 2vl4 h GLU 112 Ca -0.26 0.00 0.18 0.00 -1.00 0.00 0.00 59.36 58.28 2vl4 h GLU 112 Cb 1.10 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 30.06 2vl4 h GLU 112 CO 0.60 0.00 0.51 0.20 -1.00 0.00 0.00 179.01 179.32 2vl4 s GLY 113 N -3.74 0.24 -0.10 -3.84 0.00 -1.26 -4.19 107.32 94.43 2vl4 s GLY 113 Ca 0.05 3.46 0.02 0.00 0.00 0.00 0.00 44.72 48.25 2vl4 s GLY 113 CO 0.50 2.88 -0.17 1.08 0.00 0.00 0.00 173.10 177.39 2vl4 s LEU 114 N 1.52 1.81 -0.45 0.66 1.43 -1.26 -2.29 118.68 120.11 2vl4 s LEU 114 Ca -0.06 -0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 52.60 2vl4 s LEU 114 Cb -0.03 -1.12 0.12 0.00 0.03 0.00 0.00 46.19 45.19 2vl4 s LEU 114 CO -0.14 0.06 0.22 -0.62 0.23 0.00 0.00 176.35 176.10 2vl4 s ASP 115 N 0.74 5.04 0.13 2.29 -1.08 -0.05 -3.74 116.67 120.00 2vl4 s ASP 115 Ca -0.12 -2.33 0.00 0.00 -0.52 0.00 0.00 52.55 49.58 2vl4 s ASP 115 Cb -0.16 -1.77 0.00 0.00 -1.46 0.00 0.00 42.92 39.53 2vl4 s ASP 115 CO 0.02 -0.44 0.00 0.41 0.52 0.00 0.00 175.17 175.69 2vl4 n THR 116 N 4.13 0.00 -2.89 1.71 -1.04 -1.26 -0.53 114.28 114.40 2vl4 n THR 116 Ca 0.02 0.00 -0.44 0.00 -2.04 0.00 0.00 64.05 61.59 2vl4 n THR 116 Cb 0.40 -0.49 -0.02 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 3.11 -0.14 -1.42 2.02 -1.26 -3.01 117.35 114.66 2vl4 s TYR 117 Ca 0.00 -1.45 0.02 0.00 -0.37 0.00 0.00 57.07 55.27 2vl4 s TYR 117 Cb 0.00 -4.33 0.01 0.00 -0.40 0.00 0.00 41.96 37.24 2vl4 s TYR 117 CO 0.00 -1.52 -0.21 0.00 -1.57 0.00 0.00 175.55 172.25 2vl4 s ALA 118 N 2.76 2.16 -0.29 3.71 0.00 -1.09 -0.46 121.76 128.55 2vl4 s ALA 118 Ca 0.36 -1.04 -0.13 0.00 0.00 0.00 0.00 51.96 51.14 2vl4 s ALA 118 Cb -0.04 -0.98 -0.04 0.00 0.00 0.00 0.00 23.12 22.07 2vl4 s ALA 118 CO -0.08 -0.06 0.30 -0.51 0.00 0.00 0.00 175.76 175.41 2vl4 s ASP 119 N 0.88 6.15 -0.31 0.00 1.01 0.12 0.07 116.67 124.60 2vl4 s ASP 119 Ca -0.06 0.06 -0.09 0.00 0.71 0.00 0.00 52.55 53.16 2vl4 s ASP 119 Cb -0.15 -2.17 -0.00 0.00 1.01 0.00 0.00 42.92 41.60 2vl4 s ASP 119 CO -0.03 -0.17 0.14 -0.69 0.21 0.00 0.00 175.17 174.64 2vl4 s VAL 120 N 1.94 4.49 -0.14 -1.27 1.01 -0.32 -1.20 120.40 124.90 2vl4 s VAL 120 Ca 0.11 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.58 2vl4 s VAL 120 Cb -0.16 -3.30 -0.02 0.00 0.00 0.00 0.00 36.38 32.89 2vl4 s VAL 120 CO 0.11 0.06 -0.08 -0.31 0.00 0.00 0.00 175.10 174.88 2vl4 s TYR 121 N 1.59 2.94 -0.12 5.22 2.02 0.96 -0.02 117.35 129.93 2vl4 s TYR 121 Ca 0.04 -0.42 -0.01 0.00 -0.37 0.00 0.00 57.07 56.31 2vl4 s TYR 121 Cb -0.17 -1.90 0.03 0.00 -0.40 0.00 0.00 41.96 39.52 2vl4 s TYR 121 CO 0.06 -0.09 -0.05 -1.17 -1.57 0.00 0.00 175.55 172.73 2vl4 s LEU 122 N 0.31 1.16 -1.48 -1.29 2.96 0.42 -0.68 118.68 120.08 2vl4 s LEU 122 Ca -0.06 -0.37 -0.11 0.00 -0.22 0.00 0.00 54.13 53.37 2vl4 s LEU 122 Cb -0.15 -0.76 0.06 0.00 0.50 0.00 0.00 46.19 45.85 2vl4 s LEU 122 CO 0.04 -0.16 0.95 0.59 -1.32 0.00 0.00 176.35 176.45 2vl4 n ASN 123 N 4.98 -4.24 0.00 3.68 3.02 -0.83 -1.47 115.26 120.41 2vl4 n ASN 123 Ca -0.11 -0.77 0.00 0.00 -0.03 0.00 0.00 54.58 53.67 2vl4 n ASN 123 Cb 0.49 -4.00 0.00 0.00 -0.61 0.00 0.00 39.78 35.66 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 -1.70 0.83 3.66 7.41 0.00 -1.26 -5.03 105.19 109.10 2vl4 n GLY 124 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.67 5.84 -0.61 1.61 0.15 -0.54 -5.06 113.70 112.43 2vl4 s SER 125 Ca 0.00 0.12 -0.28 0.00 0.70 0.00 0.00 55.95 56.49 2vl4 s SER 125 Cb 0.00 -2.02 0.02 0.00 -1.71 0.00 0.00 66.02 62.32 2vl4 s SER 125 CO 0.00 0.15 1.30 -0.22 1.20 0.00 0.00 173.24 175.67 2vl4 s LEU 126 N 0.50 3.37 0.20 3.45 2.96 -1.26 -0.44 118.68 127.46 2vl4 s LEU 126 Ca 0.05 0.06 0.05 0.00 -0.22 0.00 0.00 54.13 54.08 2vl4 s LEU 126 Cb -0.12 -3.00 0.11 0.00 0.50 0.00 0.00 46.19 43.68 2vl4 s LEU 126 CO 0.00 -1.65 1.46 -0.07 -1.32 0.00 0.00 176.35 174.78 2vl4 h LEU 127 N 12.62 0.16 -7.00 -0.68 3.38 -0.81 -3.48 115.31 119.50 2vl4 h LEU 127 Ca -0.26 -0.12 0.09 0.00 0.09 0.00 0.00 57.88 57.68 2vl4 h LEU 127 Cb 1.07 -0.05 -0.27 0.00 0.09 0.00 0.00 40.66 41.50 2vl4 h LEU 127 CO 1.20 0.87 0.48 -0.22 0.09 0.00 0.00 178.44 180.86 2vl4 s LEU 128 N -7.48 -0.42 -0.61 1.67 2.96 -1.24 -5.03 118.68 108.54 2vl4 s LEU 128 Ca -0.02 0.76 -0.07 0.00 -0.22 0.00 0.00 54.13 54.58 2vl4 s LEU 128 Cb 0.11 1.74 0.16 0.00 0.50 0.00 0.00 46.19 48.70 2vl4 s LEU 128 CO 0.80 -0.13 0.47 -0.54 -1.32 0.00 0.00 176.35 175.64 2vl4 s LYS 129 N 0.56 2.72 0.52 1.98 1.02 -1.26 -1.18 119.74 124.10 2vl4 s LYS 129 Ca -0.00 -2.27 -0.17 0.00 0.02 0.00 0.00 55.97 53.55 2vl4 s LYS 129 Cb -0.05 -3.92 -0.08 0.00 -0.52 0.00 0.00 37.83 33.27 2vl4 s LYS 129 CO -0.10 -1.20 0.99 0.00 -0.92 0.00 0.00 175.35 174.13 2vl4 s ALA 130 N 0.44 3.01 0.00 5.17 0.00 0.11 -4.91 121.76 125.58 2vl4 s ALA 130 Ca 0.14 0.25 0.01 0.00 0.00 0.00 0.00 51.96 52.36 2vl4 s ALA 130 Cb -0.20 -3.14 0.02 0.00 0.00 0.00 0.00 23.12 19.80 2vl4 s ALA 130 CO -0.04 -0.29 0.76 -0.40 0.00 0.00 0.00 175.76 175.80 2vl4 n ASP 131 N -1.52 -0.31 -3.30 0.00 5.68 -1.16 -2.67 116.55 113.27 2vl4 n ASP 131 Ca 0.07 -1.50 -0.06 0.00 -0.50 0.00 0.00 54.79 52.80 2vl4 n ASP 131 Cb 0.54 0.08 -0.06 0.00 -1.14 0.00 0.00 41.12 40.53 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 -0.56 -0.19 0.52 -1.12 3.84 -1.25 -4.48 114.94 111.69 2vl4 s ASN 132 Ca 0.02 0.40 0.22 0.00 0.21 0.00 0.00 52.86 53.71 2vl4 s ASN 132 Cb 0.02 1.40 1.33 0.00 -0.55 0.00 0.00 41.25 43.45 2vl4 s ASN 132 CO -0.01 -0.29 2.02 -0.03 -2.79 0.00 0.00 177.10 176.00 2vl4 h MET 133 N 8.13 0.05 -0.28 0.43 1.85 -1.28 -2.85 114.93 120.98 2vl4 h MET 133 Ca -0.20 -0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.88 2vl4 h MET 133 Cb 1.16 -0.01 0.00 0.00 0.43 0.00 0.00 31.60 33.18 2vl4 h MET 133 CO 0.27 0.03 0.00 1.19 -0.40 0.00 0.00 176.91 178.00 2vl4 n PHE 134 N -4.42 0.37 -4.93 1.39 3.72 -1.26 -4.40 117.46 107.92 2vl4 n PHE 134 Ca 0.07 -0.18 -0.33 0.00 -0.05 0.00 0.00 57.45 56.96 2vl4 n PHE 134 Cb 0.48 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.88 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 -1.63 2.89 0.16 -4.37 1.01 -1.08 -4.72 120.40 112.66 2vl4 s VAL 135 Ca 0.34 -0.77 -0.14 0.00 0.00 0.00 0.00 61.98 61.41 2vl4 s VAL 135 Cb 0.19 -2.14 -0.07 0.00 0.00 0.00 0.00 36.38 34.37 2vl4 s VAL 135 CO 0.28 0.57 0.56 -0.83 0.00 0.00 0.00 175.10 175.69 2vl4 s GLY 136 N -0.42 2.46 -0.06 4.51 0.00 -1.26 -4.40 107.32 108.15 2vl4 s GLY 136 Ca 0.05 -0.11 0.05 0.00 0.00 0.00 0.00 44.72 44.70 2vl4 s GLY 136 CO 0.02 0.16 -0.22 -0.19 0.00 0.00 0.00 173.10 172.87 2vl4 s TYR 137 N -1.50 2.20 -0.18 1.90 2.02 0.13 -4.99 117.35 116.93 2vl4 s TYR 137 Ca 0.39 -0.72 0.00 0.00 -0.37 0.00 0.00 57.07 56.38 2vl4 s TYR 137 Cb -0.15 -1.47 0.01 0.00 -0.40 0.00 0.00 41.96 39.96 2vl4 s TYR 137 CO 0.19 -0.25 -0.18 0.99 -1.57 0.00 0.00 175.55 174.74 2vl4 s THR 138 N 0.05 2.27 -0.13 -0.71 2.01 -1.26 -0.77 115.64 117.09 2vl4 s THR 138 Ca -0.08 -0.87 0.03 0.00 0.31 0.00 0.00 61.69 61.08 2vl4 s THR 138 Cb -0.14 -1.96 0.01 0.00 0.01 0.00 0.00 72.50 70.41 2vl4 s THR 138 CO 0.04 0.52 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.51 2vl4 s LEU 139 N 1.27 2.10 -0.05 4.42 1.43 0.73 -4.94 118.68 123.64 2vl4 s LEU 139 Ca 0.04 -0.59 -0.30 0.00 -1.03 0.00 0.00 54.13 52.25 2vl4 s LEU 139 Cb -0.13 -1.44 -0.04 0.00 0.03 0.00 0.00 46.19 44.61 2vl4 s LEU 139 CO -0.10 0.10 1.33 -2.16 0.23 0.00 0.00 176.35 175.74 2vl4 s PRO 140 N 0.71 4.29 0.00 1.29 0.04 -1.26 -0.05 135.00 140.02 2vl4 s PRO 140 Ca -0.10 1.84 0.00 0.00 0.04 0.00 0.00 61.00 62.78 2vl4 s PRO 140 Cb -0.16 -3.63 0.00 0.00 0.04 0.00 0.00 34.50 30.75 2vl4 s PRO 140 CO 0.00 -0.57 0.55 1.33 0.04 0.00 0.00 177.00 178.35 2vl4 n VAL 141 N 4.82 0.30 -0.15 -0.36 0.24 0.19 -4.87 118.33 118.50 2vl4 n VAL 141 Ca 0.13 -0.40 -0.03 0.00 -2.04 0.00 0.00 64.34 62.00 2vl4 n VAL 141 Cb 0.45 1.05 0.05 0.00 -1.47 0.00 0.00 33.84 33.92 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 0.17 -0.25 7.34 3.64 -1.89 -1.79 116.57 123.79 2vl4 h LYS 142 Ca 0.00 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.41 2vl4 h LYS 142 Cb 0.54 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 2vl4 h LYS 142 CO 0.00 0.11 0.17 0.77 -2.27 0.00 0.00 179.45 178.23 2vl4 h SER 143 N 0.17 0.13 0.56 4.20 0.02 -1.92 -2.99 113.55 113.72 2vl4 h SER 143 Ca 0.24 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 2vl4 h SER 143 Cb 0.33 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2vl4 h SER 143 CO -0.35 0.09 -1.06 1.33 -1.14 0.00 0.00 176.83 175.70 2vl4 n VAL 144 N -4.49 0.27 -2.11 2.27 0.24 -0.73 -4.91 118.33 108.87 2vl4 n VAL 144 Ca 0.02 -0.33 -0.32 0.00 -2.04 0.00 0.00 64.34 61.67 2vl4 n VAL 144 Cb 0.22 0.04 0.00 0.00 -1.47 0.00 0.00 33.84 32.63 2vl4 n VAL 144 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2vl4 s LEU 145 N -4.30 3.51 0.09 1.34 1.43 -0.88 -4.80 118.68 115.07 2vl4 s LEU 145 Ca 0.02 1.75 0.07 0.00 -1.03 0.00 0.00 54.13 54.94 2vl4 s LEU 145 Cb 0.13 -4.53 -0.03 0.00 0.03 0.00 0.00 46.19 41.80 2vl4 s LEU 145 CO 0.80 -1.04 -0.19 -0.13 0.23 0.00 0.00 176.35 176.01 2vl4 s ARG 146 N -4.13 1.09 0.23 1.70 0.52 -1.26 -5.02 118.95 112.08 2vl4 s ARG 146 Ca 0.62 -1.09 -0.31 0.00 -0.52 0.00 0.00 55.73 54.44 2vl4 s ARG 146 Cb -0.14 -1.29 -0.11 0.00 0.52 0.00 0.00 34.95 33.93 2vl4 s ARG 146 CO 0.37 0.30 1.58 0.21 0.02 0.00 0.00 175.30 177.78 2vl4 s LYS 147 N -1.77 4.18 0.95 3.54 2.20 -1.26 -4.45 119.74 123.13 2vl4 s LYS 147 Ca 0.05 2.47 0.00 0.00 -0.36 0.00 0.00 55.97 58.12 2vl4 s LYS 147 Cb -0.10 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.13 2vl4 s LYS 147 CO 0.04 -0.60 0.00 0.41 -0.36 0.00 0.00 175.35 174.83 2vl4 n GLY 148 N 2.98 0.88 3.73 5.54 0.00 0.03 -4.93 105.19 113.41 2vl4 n GLY 148 Ca 0.11 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 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 4.31 0.05 1.61 2.02 -1.26 -1.45 118.70 123.98 2vl4 s GLU 149 Ca 0.00 2.16 0.07 0.00 0.02 0.00 0.00 54.97 57.22 2vl4 s GLU 149 Cb 0.00 -3.19 -0.03 0.00 0.10 0.00 0.00 34.13 31.01 2vl4 s GLU 149 CO 0.00 -0.42 -0.19 -0.80 0.02 0.00 0.00 175.26 173.87 2vl4 s ASN 150 N 0.76 2.29 -0.15 -0.19 0.01 -0.05 -4.76 114.94 112.85 2vl4 s ASN 150 Ca 0.62 -0.54 0.00 0.00 -0.71 0.00 0.00 52.86 52.24 2vl4 s ASN 150 Cb -0.39 -0.17 0.02 0.00 0.41 0.00 0.00 41.25 41.12 2vl4 s ASN 150 CO 0.35 0.11 -0.14 -1.00 -1.51 0.00 0.00 177.10 174.91 2vl4 s HIS 151 N -0.88 2.21 -0.15 2.20 3.76 -1.26 -2.14 115.29 119.04 2vl4 s HIS 151 Ca 0.06 -1.27 -0.03 0.00 -0.15 0.00 0.00 55.06 53.67 2vl4 s HIS 151 Cb -0.09 -1.61 -0.03 0.00 1.11 0.00 0.00 32.58 31.96 2vl4 s HIS 151 CO 0.02 -0.68 -0.05 -1.17 -0.85 0.00 0.00 174.74 172.00 2vl4 s LEU 152 N 1.47 3.16 -0.02 0.89 2.96 0.29 -1.96 118.68 125.46 2vl4 s LEU 152 Ca 0.05 -0.16 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 2vl4 s LEU 152 Cb -0.13 -1.75 0.02 0.00 0.50 0.00 0.00 46.19 44.83 2vl4 s LEU 152 CO -0.11 0.18 -0.03 -0.47 -1.32 0.00 0.00 176.35 174.61 2vl4 s TYR 153 N 0.30 0.43 -0.10 5.38 6.14 0.15 -1.57 117.35 128.08 2vl4 s TYR 153 Ca -0.05 -0.07 0.01 0.00 0.64 0.00 0.00 57.07 57.60 2vl4 s TYR 153 Cb -0.14 -0.40 0.02 0.00 0.42 0.00 0.00 41.96 41.85 2vl4 s TYR 153 CO 0.03 -0.10 -0.11 0.42 0.64 0.00 0.00 175.55 176.44 2vl4 s ILE 154 N 0.58 1.18 -0.37 3.14 1.01 0.92 -0.03 121.20 127.62 2vl4 s ILE 154 Ca -0.06 -0.44 -0.12 0.00 0.00 0.00 0.00 60.65 60.03 2vl4 s ILE 154 Cb -0.10 -1.12 0.02 0.00 0.01 0.00 0.00 42.46 41.27 2vl4 s ILE 154 CO -0.01 0.38 0.23 -0.47 0.00 0.00 0.00 174.94 175.07 2vl4 s TYR 155 N 1.16 3.23 -0.47 3.97 5.04 -0.34 -0.91 117.35 129.03 2vl4 s TYR 155 Ca -0.05 -0.76 -0.22 0.00 -2.44 0.00 0.00 57.07 53.60 2vl4 s TYR 155 Cb -0.14 -2.47 0.03 0.00 0.35 0.00 0.00 41.96 39.73 2vl4 s TYR 155 CO -0.03 -0.59 0.75 -0.06 -1.34 0.00 0.00 175.55 174.29 2vl4 s PHE 156 N 1.61 2.99 0.18 4.97 0.08 0.91 -0.70 117.98 128.02 2vl4 s PHE 156 Ca 0.03 -0.02 -0.30 0.00 0.12 0.00 0.00 56.93 56.76 2vl4 s PHE 156 Cb -0.19 -3.63 -0.08 0.00 -0.57 0.00 0.00 43.02 38.56 2vl4 s PHE 156 CO 0.08 -1.02 1.26 -1.01 -0.10 0.00 0.00 175.22 174.43 2vl4 s HIS 157 N 3.18 3.34 -0.16 0.36 3.76 0.39 -2.15 115.29 124.01 2vl4 s HIS 157 Ca 0.26 1.30 -0.40 0.00 -0.15 0.00 0.00 55.06 56.08 2vl4 s HIS 157 Cb -0.14 -3.52 -0.17 0.00 1.11 0.00 0.00 32.58 29.86 2vl4 s HIS 157 CO 0.20 -1.58 1.55 0.45 -0.85 0.00 0.00 174.74 174.51 2vl4 n SER 158 N 2.68 1.89 0.25 1.40 2.88 -1.25 -4.46 113.62 117.01 2vl4 n SER 158 Ca 0.06 1.10 0.12 0.00 -1.33 0.00 0.00 58.87 58.82 2vl4 n SER 158 Cb 0.44 -1.12 0.64 0.00 -0.75 0.00 0.00 64.21 63.42 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 5.87 0.00 0.58 -1.46 0.13 -1.90 0.16 132.00 135.39 2vl4 h PRO 159 Ca -0.47 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 2vl4 h PRO 159 Cb 1.34 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.47 2vl4 h PRO 159 CO 0.88 0.16 -0.28 0.82 -0.23 0.00 0.00 178.00 179.35 2vl4 h ILE 160 N 0.00 0.08 0.00 -3.56 1.08 -1.89 -2.97 117.51 110.24 2vl4 h ILE 160 Ca -0.00 -0.42 -0.03 0.00 -0.39 0.00 0.00 64.86 64.02 2vl4 h ILE 160 Cb 0.47 0.11 -0.00 0.00 -3.07 0.00 0.00 36.82 34.32 2vl4 h ILE 160 CO 0.02 0.01 -0.13 0.03 -0.69 0.00 0.00 178.15 177.39 2vl4 h ARG 161 N -1.18 0.00 -0.24 2.37 3.08 -1.78 0.31 114.38 116.94 2vl4 h ARG 161 Ca -0.08 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.86 2vl4 h ARG 161 Cb 0.62 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 2vl4 h ARG 161 CO 0.13 0.13 -0.33 0.37 -1.07 0.00 0.00 179.97 179.21 2vl4 h GLN 162 N 0.00 0.50 -0.01 0.04 5.75 -1.03 -3.29 115.11 117.07 2vl4 h GLN 162 Ca -0.00 -0.22 0.00 0.00 -0.15 0.00 0.00 58.65 58.28 2vl4 h GLN 162 Cb 0.36 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.90 2vl4 h GLN 162 CO 0.02 0.77 -0.50 0.25 -2.65 0.00 0.00 178.83 176.72 2vl4 n THR 163 N -4.07 0.00 -0.27 2.39 -2.24 -0.58 -4.38 114.28 105.13 2vl4 n THR 163 Ca -0.01 -0.25 0.07 0.00 -2.27 0.00 0.00 64.05 61.59 2vl4 n THR 163 Cb 0.46 1.11 0.21 0.00 -2.10 0.00 0.00 70.33 70.01 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 1.06 0.23 -0.59 3.22 3.38 -1.05 0.13 115.31 121.68 2vl4 h LEU 164 Ca 0.00 0.13 -0.15 0.00 0.09 0.00 0.00 57.88 57.95 2vl4 h LEU 164 Cb 0.47 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2vl4 h LEU 164 CO 0.00 0.05 -0.66 1.55 0.09 0.00 0.00 178.44 179.46 2vl4 h PRO 165 N 0.39 0.19 -0.35 1.13 0.13 -1.77 -1.37 132.00 130.35 2vl4 h PRO 165 Ca 0.45 -0.14 0.01 0.00 -0.87 0.00 0.00 66.00 65.44 2vl4 h PRO 165 Cb 0.75 0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.88 2vl4 h PRO 165 CO -0.46 0.78 0.23 0.37 -0.23 0.00 0.00 178.00 178.69 2vl4 h GLN 166 N 0.13 0.45 -0.11 0.86 4.15 -1.53 -1.98 115.11 117.07 2vl4 h GLN 166 Ca -0.01 -0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.40 2vl4 h GLN 166 Cb 1.19 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.75 2vl4 h GLN 166 CO 0.10 0.30 -0.05 -0.92 -1.93 0.00 0.00 178.83 176.33 2vl4 h TYR 167 N 0.46 -0.11 -0.78 3.99 3.20 -0.61 -2.67 116.97 120.45 2vl4 h TYR 167 Ca 0.13 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.12 2vl4 h TYR 167 Cb -0.04 0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.24 2vl4 h TYR 167 CO -0.06 -0.08 0.51 0.00 -1.64 0.00 0.00 178.16 176.89 2vl4 h ALA 168 N 1.06 1.85 0.00 1.82 0.00 -1.03 -0.90 119.26 122.07 2vl4 h ALA 168 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2vl4 h ALA 168 Cb 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2vl4 h ALA 168 CO -0.13 -0.03 0.00 0.66 0.00 0.00 0.00 179.25 179.75 2vl4 h SER 169 N 0.64 0.00 0.74 0.00 4.64 -1.03 -3.35 113.55 115.19 2vl4 h SER 169 Ca 0.37 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.49 2vl4 h SER 169 Cb 0.56 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.63 2vl4 h SER 169 CO -0.14 0.00 -0.90 -1.13 -0.87 0.00 0.00 176.83 173.79 2vl4 h ASN 170 N 0.00 0.13 0.00 4.97 -1.24 -0.92 -3.48 115.58 115.04 2vl4 h ASN 170 Ca 0.00 -0.12 0.00 0.00 0.71 0.00 0.00 56.30 56.89 2vl4 h ASN 170 Cb 0.68 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.69 2vl4 h ASN 170 CO 0.00 0.96 0.00 0.61 -1.29 0.00 0.00 177.43 177.71 2vl4 n GLY 171 N 0.98 0.31 3.82 1.57 0.00 -1.25 -4.97 105.19 105.65 2vl4 n GLY 171 Ca -0.02 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.64 -0.19 -0.24 1.61 -0.12 -1.26 -5.15 117.98 110.99 2vl4 s PHE 172 Ca 0.00 -0.25 -0.04 0.00 -0.05 0.00 0.00 56.93 56.59 2vl4 s PHE 172 Cb 0.00 0.68 -0.00 0.00 -0.63 0.00 0.00 43.02 43.06 2vl4 s PHE 172 CO 0.00 -1.20 -0.02 1.21 -0.05 0.00 0.00 175.22 175.16 2vl4 s ASN 173 N -2.91 4.50 0.37 1.98 2.47 -1.26 -5.03 114.94 115.06 2vl4 s ASN 173 Ca 0.11 -0.52 -0.28 0.00 0.42 0.00 0.00 52.86 52.59 2vl4 s ASN 173 Cb -0.05 -1.76 -0.11 0.00 -1.45 0.00 0.00 41.25 37.87 2vl4 s ASN 173 CO 0.06 -0.07 1.44 -1.22 -3.72 0.00 0.00 177.10 173.59 2vl4 n TYR 174 N 4.80 2.82 -1.14 0.43 4.01 -1.26 -4.86 117.16 121.96 2vl4 n TYR 174 Ca -0.17 0.47 -0.25 0.00 -0.16 0.00 0.00 57.90 57.79 2vl4 n TYR 174 Cb 0.50 -2.51 -0.10 0.00 -0.31 0.00 0.00 39.34 36.92 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 0.48 2.81 -2.78 -0.72 -0.04 -1.26 -4.72 135.00 128.77 2vl4 n PRO 175 Ca 0.02 -1.58 -0.44 0.00 -0.04 0.00 0.00 63.50 61.47 2vl4 n PRO 175 Cb 0.38 -2.39 0.00 0.00 -0.04 0.00 0.00 33.50 31.46 2vl4 n PRO 175 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2vl4 n ALA 176 N 3.04 4.28 0.26 0.55 0.00 -1.26 -4.76 120.51 122.62 2vl4 n ALA 176 Ca 0.60 -4.26 0.16 0.00 0.00 0.00 0.00 53.44 49.94 2vl4 n ALA 176 Cb 0.57 -3.04 0.89 0.00 0.00 0.00 0.00 19.45 17.87 2vl4 n ALA 176 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2vl4 h ASP 177 N 6.76 0.00 1.03 0.00 3.32 -1.90 -0.55 116.42 125.07 2vl4 h ASP 177 Ca 0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.39 2vl4 h ASP 177 Cb 0.80 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.35 2vl4 h ASP 177 CO 1.35 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 179.46 2vl4 n ASN 178 N -3.78 0.49 -4.56 6.45 3.02 -1.26 -4.57 115.26 111.06 2vl4 n ASN 178 Ca -0.01 0.58 -0.43 0.00 -0.03 0.00 0.00 54.58 54.68 2vl4 n ASN 178 Cb 0.18 -0.70 -0.04 0.00 -0.61 0.00 0.00 39.78 38.61 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 -3.92 6.46 -1.32 6.41 -1.08 -0.22 -3.59 116.67 119.41 2vl4 s ASP 179 Ca 0.09 0.02 -0.10 0.00 -0.52 0.00 0.00 52.55 52.03 2vl4 s ASP 179 Cb 0.12 -2.45 0.14 0.00 -1.46 0.00 0.00 42.92 39.28 2vl4 s ASP 179 CO 0.48 -1.08 1.96 1.41 0.52 0.00 0.00 175.17 178.45 2vl4 n HIS 180 N 7.22 3.04 -3.56 -5.34 8.25 -0.32 -4.81 115.22 119.70 2vl4 n HIS 180 Ca 0.05 -2.82 -0.17 0.00 -0.26 0.00 0.00 57.72 54.52 2vl4 n HIS 180 Cb 0.48 -2.07 -0.06 0.00 1.12 0.00 0.00 29.99 29.46 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 0.95 -0.55 0.27 4.41 5.04 -1.26 -5.01 115.29 119.14 2vl4 s HIS 181 Ca 0.41 0.88 -0.00 0.00 -1.54 0.00 0.00 55.06 54.81 2vl4 s HIS 181 Cb 0.11 0.36 0.59 0.00 0.04 0.00 0.00 32.58 33.68 2vl4 s HIS 181 CO -0.02 -0.59 1.72 1.49 -2.34 0.00 0.00 174.74 175.00 2vl4 h GLU 182 N 3.06 0.44 -5.16 2.88 4.81 -2.02 -3.39 114.58 115.20 2vl4 h GLU 182 Ca -0.28 -0.03 -0.62 0.00 -0.13 0.00 0.00 59.36 58.30 2vl4 h GLU 182 Cb 1.16 -0.10 -0.17 0.00 0.63 0.00 0.00 28.75 30.27 2vl4 h GLU 182 CO 0.39 0.29 -0.56 0.15 -0.73 0.00 0.00 179.01 178.55 2vl4 s LYS 183 N -5.96 3.93 -1.19 1.92 1.02 -1.26 -5.02 119.74 113.18 2vl4 s LYS 183 Ca -0.12 -0.36 -0.14 0.00 0.02 0.00 0.00 55.97 55.38 2vl4 s LYS 183 Cb 0.23 -3.32 0.17 0.00 -0.52 0.00 0.00 37.83 34.39 2vl4 s LYS 183 CO 0.77 0.12 1.41 -1.01 -0.92 0.00 0.00 175.35 175.72 2vl4 s HIS 184 N 0.83 3.51 -0.60 3.18 3.76 -1.26 -4.77 115.29 119.93 2vl4 s HIS 184 Ca 0.05 -2.12 0.25 0.00 -0.15 0.00 0.00 55.06 53.08 2vl4 s HIS 184 Cb -0.13 -4.30 0.50 0.00 1.11 0.00 0.00 32.58 29.76 2vl4 s HIS 184 CO 0.02 -1.39 1.54 -0.07 -0.85 0.00 0.00 174.74 174.00 2vl4 h LEU 185 N 9.65 0.00 -1.04 0.89 3.38 -1.94 -3.34 115.31 122.90 2vl4 h LEU 185 Ca 0.30 -0.06 0.15 0.00 0.09 0.00 0.00 57.88 58.36 2vl4 h LEU 185 Cb 0.88 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.54 2vl4 h LEU 185 CO 1.23 0.03 0.62 0.77 0.09 0.00 0.00 178.44 181.18 2vl4 h SER 186 N 0.00 0.85 0.49 -0.43 4.64 -1.93 -0.83 113.55 116.34 2vl4 h SER 186 Ca 0.00 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2vl4 h SER 186 Cb 0.82 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 2vl4 h SER 186 CO 0.00 0.40 0.00 -0.37 -0.87 0.00 0.00 176.83 175.99 2vl4 h VAL 187 N 0.89 0.00 0.00 0.95 -1.51 -1.96 -1.78 116.25 112.84 2vl4 h VAL 187 Ca 0.52 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.76 2vl4 h VAL 187 Cb 0.66 1.20 0.00 0.00 -2.13 0.00 0.00 31.29 31.02 2vl4 h VAL 187 CO -0.30 0.00 -0.32 -0.26 -1.23 0.00 0.00 177.57 175.46 2vl4 h PHE 188 N 0.00 0.00 -4.13 5.19 0.04 -1.42 -3.42 116.94 113.20 2vl4 h PHE 188 Ca 0.00 0.00 -0.69 0.00 2.80 0.00 0.00 57.97 60.08 2vl4 h PHE 188 Cb 0.24 0.00 -0.25 0.00 2.20 0.00 0.00 35.95 38.14 2vl4 h PHE 188 CO 0.00 0.00 -0.80 -1.12 -0.60 0.00 0.00 178.31 175.79 2vl4 s SER 189 N -4.92 3.78 -1.22 2.17 0.01 -0.67 -5.03 113.70 107.82 2vl4 s SER 189 Ca 0.07 -0.27 -0.18 0.00 1.31 0.00 0.00 55.95 56.87 2vl4 s SER 189 Cb 0.11 -0.76 0.08 0.00 0.21 0.00 0.00 66.02 65.66 2vl4 s SER 189 CO 0.68 0.33 1.62 -0.13 0.41 0.00 0.00 173.24 176.15 2vl4 s ARG 190 N -0.65 3.91 -0.01 12.44 1.81 -1.26 -4.87 118.95 130.33 2vl4 s ARG 190 Ca 0.10 -1.91 -0.11 0.00 -1.72 0.00 0.00 55.73 52.09 2vl4 s ARG 190 Cb -0.11 -5.42 0.01 0.00 -0.45 0.00 0.00 34.95 28.99 2vl4 s ARG 190 CO 0.00 -2.17 0.24 0.21 -0.68 0.00 0.00 175.30 172.90 2vl4 s LYS 191 N 3.95 0.58 -0.26 3.54 2.20 -1.26 -1.29 119.74 127.20 2vl4 s LYS 191 Ca 0.50 -0.26 -0.37 0.00 -0.36 0.00 0.00 55.97 55.49 2vl4 s LYS 191 Cb 0.02 0.25 -0.13 0.00 -1.51 0.00 0.00 37.83 36.46 2vl4 s LYS 191 CO 0.03 -0.15 1.95 0.00 -0.36 0.00 0.00 175.35 176.82 2vl4 n ALA 192 N 1.42 0.57 -0.21 3.13 0.00 -1.26 -4.84 120.51 119.32 2vl4 n ALA 192 Ca -0.22 0.20 0.01 0.00 0.00 0.00 0.00 53.44 53.43 2vl4 n ALA 192 Cb 0.56 -2.42 0.12 0.00 0.00 0.00 0.00 19.45 17.71 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 9.67 0.20 0.00 0.00 0.11 -1.71 -2.00 132.00 138.26 2vl4 h PRO 193 Ca -0.40 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2vl4 h PRO 193 Cb 1.31 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2vl4 h PRO 193 CO 0.98 0.13 0.00 0.10 -0.21 0.00 0.00 178.00 179.00 2vl4 h TYR 194 N 0.20 0.00 0.00 0.65 -0.00 -1.31 -2.17 116.97 114.34 2vl4 h TYR 194 Ca 0.33 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 59.04 2vl4 h TYR 194 Cb 0.52 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.25 2vl4 h TYR 194 CO -0.29 0.00 -0.10 0.66 -0.00 0.00 0.00 178.16 178.43 2vl4 h SER 195 N 0.00 0.00 -0.02 0.10 4.64 -1.64 -0.49 113.55 116.15 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 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2vl4 h SER 195 CO 0.00 0.10 0.00 -1.22 -0.87 0.00 0.00 176.83 174.84 2vl4 n TYR 196 N -3.60 0.02 0.00 4.77 4.01 -0.82 -1.70 117.16 119.84 2vl4 n TYR 196 Ca -0.02 -0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 2vl4 n TYR 196 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.25 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 0.92 2.79 3.74 2.72 0.00 -0.19 -1.18 105.19 113.98 2vl4 n GLY 197 Ca 0.18 -1.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.13 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 -2.87 0.28 -2.00 1.61 -0.11 -1.20 -4.38 118.94 110.27 2vl4 s TRP 198 Ca 0.00 -0.81 0.09 0.00 1.22 0.00 0.00 56.10 56.60 2vl4 s TRP 198 Cb 0.00 0.59 0.54 0.00 -1.50 0.00 0.00 33.47 33.09 2vl4 s TRP 198 CO 0.00 -1.39 1.22 -0.40 -4.62 0.00 0.00 176.95 171.76 2vl4 n ASP 199 N -1.18 0.00 -0.11 5.86 5.68 -1.26 -1.11 116.55 124.42 2vl4 n ASP 199 Ca -0.05 -1.43 0.01 0.00 -0.50 0.00 0.00 54.79 52.82 2vl4 n ASP 199 Cb 0.60 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.60 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 -0.66 0.00 -4.18 2.11 4.27 -1.26 -2.45 117.44 115.26 2vl4 n TRP 200 Ca 0.07 -0.20 -0.17 0.00 -3.89 0.00 0.00 57.50 53.30 2vl4 n TRP 200 Cb 0.03 -0.04 -0.11 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 -0.70 0.89 0.35 -1.67 0.00 -0.27 -4.84 107.32 101.08 2vl4 s GLY 201 Ca 0.03 -1.09 -0.23 0.00 0.00 0.00 0.00 44.72 43.43 2vl4 s GLY 201 CO 0.00 -1.14 0.90 -1.50 0.00 0.00 0.00 173.10 171.36 2vl4 s ILE 202 N -1.73 4.36 -0.39 0.90 2.07 -1.26 -3.23 121.20 121.92 2vl4 s ILE 202 Ca 0.02 1.57 -0.23 0.00 -1.41 0.00 0.00 60.65 60.59 2vl4 s ILE 202 Cb -0.07 -3.81 0.01 0.00 0.13 0.00 0.00 42.46 38.72 2vl4 s ILE 202 CO 0.02 -0.04 0.79 -0.60 -1.91 0.00 0.00 174.94 173.20 2vl4 s ARG 203 N -2.52 3.66 -0.39 3.50 3.52 -1.26 -4.04 118.95 121.42 2vl4 s ARG 203 Ca 0.54 0.20 0.03 0.00 -0.13 0.00 0.00 55.73 56.37 2vl4 s ARG 203 Cb -0.14 -3.84 0.16 0.00 -1.56 0.00 0.00 34.95 29.56 2vl4 s ARG 203 CO 0.19 -0.93 0.29 -1.64 -0.81 0.00 0.00 175.30 172.40 2vl4 s MET 204 N 3.17 0.79 -1.00 5.12 -1.94 -0.69 -4.89 119.30 119.86 2vl4 s MET 204 Ca 0.31 -1.83 -0.23 0.00 -1.71 0.00 0.00 55.69 52.23 2vl4 s MET 204 Cb -0.13 -1.40 0.03 0.00 2.01 0.00 0.00 34.83 35.34 2vl4 s MET 204 CO 0.19 -1.32 1.57 0.08 -0.01 0.00 0.00 175.02 175.53 2vl4 s VAL 205 N 0.42 3.81 0.63 -6.03 1.01 -1.19 -4.77 120.40 114.29 2vl4 s VAL 205 Ca 0.27 -0.69 0.07 0.00 0.00 0.00 0.00 61.98 61.63 2vl4 s VAL 205 Cb -0.06 -4.81 0.11 0.00 0.00 0.00 0.00 36.38 31.61 2vl4 s VAL 205 CO -0.12 -1.70 0.87 0.28 0.00 0.00 0.00 175.10 174.43 2vl4 s THR 206 N 6.19 2.06 0.10 3.92 -1.32 -1.26 -4.47 115.64 120.87 2vl4 s THR 206 Ca 0.52 -0.89 -0.10 0.00 -1.21 0.00 0.00 61.69 60.01 2vl4 s THR 206 Cb -0.01 -2.17 0.01 0.00 -1.51 0.00 0.00 72.50 68.81 2vl4 s THR 206 CO -0.07 0.00 0.24 -0.44 -2.21 0.00 0.00 174.62 172.14 2vl4 s SER 207 N -4.72 0.04 0.00 8.08 0.01 -1.26 -4.80 113.70 111.05 2vl4 s SER 207 Ca 0.64 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 57.31 2vl4 s SER 207 Cb -0.05 0.37 0.00 0.00 0.21 0.00 0.00 66.02 66.55 2vl4 s SER 207 CO 0.41 -0.76 0.00 0.61 0.41 0.00 0.00 173.24 173.91 2vl4 n GLY 208 N -0.10 0.64 3.43 3.44 0.00 0.31 -1.25 105.19 111.65 2vl4 n GLY 208 Ca -0.15 -1.82 -0.44 0.00 0.00 0.00 0.00 46.02 43.60 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 -1.97 4.83 -0.71 1.61 1.01 -1.24 -0.87 120.40 123.06 2vl4 s VAL 209 Ca 0.00 -1.59 0.24 0.00 0.00 0.00 0.00 61.98 60.64 2vl4 s VAL 209 Cb 0.00 -4.71 0.04 0.00 0.00 0.00 0.00 36.38 31.71 2vl4 s VAL 209 CO 0.00 -1.42 1.35 -2.67 0.00 0.00 0.00 175.10 172.36 2vl4 n TRP 210 N 6.26 0.44 -4.37 5.22 4.27 -0.97 -1.23 117.44 127.07 2vl4 n TRP 210 Ca 0.19 0.13 -0.19 0.00 -3.89 0.00 0.00 57.50 53.74 2vl4 n TRP 210 Cb 0.48 -0.58 -0.10 0.00 -1.36 0.00 0.00 31.31 29.75 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 -3.13 1.54 0.71 -2.67 0.52 -1.21 -4.55 118.95 110.16 2vl4 s ARG 211 Ca 0.07 -1.86 -0.15 0.00 -0.52 0.00 0.00 55.73 53.27 2vl4 s ARG 211 Cb 0.14 -0.39 0.03 0.00 0.52 0.00 0.00 34.95 35.25 2vl4 s ARG 211 CO 0.71 -0.32 1.20 -2.14 0.02 0.00 0.00 175.30 174.78 2vl4 s PRO 212 N -3.94 2.31 -0.11 3.54 0.02 -1.26 -4.38 135.00 131.19 2vl4 s PRO 212 Ca 0.36 1.74 0.03 0.00 0.02 0.00 0.00 61.00 63.15 2vl4 s PRO 212 Cb 0.07 -1.86 -0.00 0.00 0.02 0.00 0.00 34.50 32.73 2vl4 s PRO 212 CO 0.15 -1.70 -0.22 0.08 -0.33 0.00 0.00 177.00 174.98 2vl4 s VAL 213 N -1.96 2.27 0.01 3.83 1.01 -1.26 -1.52 120.40 122.79 2vl4 s VAL 213 Ca 0.74 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.80 2vl4 s VAL 213 Cb -0.29 -1.89 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 2vl4 s VAL 213 CO 0.43 0.55 -0.07 -0.89 0.00 0.00 0.00 175.10 175.13 2vl4 s THR 214 N 0.37 0.52 -0.16 3.92 2.01 -0.38 -1.00 115.64 120.92 2vl4 s THR 214 Ca -0.17 -0.59 -0.04 0.00 0.31 0.00 0.00 61.69 61.21 2vl4 s THR 214 Cb -0.17 -0.50 -0.03 0.00 0.01 0.00 0.00 72.50 71.81 2vl4 s THR 214 CO 0.08 -0.06 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.16 2vl4 s LEU 215 N -0.71 3.33 -0.18 4.42 1.43 0.11 -0.40 118.68 126.67 2vl4 s LEU 215 Ca -0.02 -0.10 0.01 0.00 -1.03 0.00 0.00 54.13 52.99 2vl4 s LEU 215 Cb -0.05 -1.81 0.02 0.00 0.03 0.00 0.00 46.19 44.39 2vl4 s LEU 215 CO 0.00 0.18 -0.18 -0.60 0.23 0.00 0.00 176.35 175.98 2vl4 s ARG 216 N 0.33 2.78 -0.23 1.70 3.52 -0.25 -0.06 118.95 126.73 2vl4 s ARG 216 Ca -0.03 -0.83 -0.07 0.00 -0.13 0.00 0.00 55.73 54.68 2vl4 s ARG 216 Cb -0.14 -2.51 -0.03 0.00 -1.56 0.00 0.00 34.95 30.71 2vl4 s ARG 216 CO 0.03 -0.25 0.05 -0.06 -0.81 0.00 0.00 175.30 174.26 2vl4 s PHE 217 N 1.31 3.09 0.16 5.12 0.08 -0.12 -0.62 117.98 127.00 2vl4 s PHE 217 Ca 0.04 -0.38 -0.07 0.00 0.12 0.00 0.00 56.93 56.63 2vl4 s PHE 217 Cb -0.14 -2.19 -0.02 0.00 -0.57 0.00 0.00 43.02 40.11 2vl4 s PHE 217 CO -0.12 -0.28 0.23 1.52 -0.10 0.00 0.00 175.22 176.47 2vl4 s TYR 218 N 1.36 0.54 0.02 0.36 -0.85 -0.53 -0.97 117.35 117.29 2vl4 s TYR 218 Ca 0.05 -0.90 0.06 0.00 -0.52 0.00 0.00 57.07 55.75 2vl4 s TYR 218 Cb -0.15 -0.17 -0.03 0.00 0.38 0.00 0.00 41.96 41.99 2vl4 s TYR 218 CO 0.03 -0.68 -0.14 -0.51 -1.52 0.00 0.00 175.55 172.73 2vl4 s ASP 219 N -3.00 4.08 0.00 -0.18 1.01 -1.26 -1.61 116.67 115.72 2vl4 s ASP 219 Ca 0.20 -0.32 0.00 0.00 0.71 0.00 0.00 52.55 53.14 2vl4 s ASP 219 Cb 0.04 -0.78 0.00 0.00 1.01 0.00 0.00 42.92 43.19 2vl4 s ASP 219 CO 0.01 0.27 0.00 -0.38 0.21 0.00 0.00 175.17 175.28 2vl4 n ILE 220 N 1.60 0.00 -3.58 0.77 2.08 -1.26 -4.77 119.36 114.20 2vl4 n ILE 220 Ca -0.16 0.00 -0.10 0.00 0.56 0.00 0.00 62.75 63.05 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 -1.43 0.15 -1.39 0.00 -1.26 -0.72 121.76 117.11 2vl4 s ALA 221 Ca 0.00 0.18 0.10 0.00 0.00 0.00 0.00 51.96 52.24 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 -0.86 -0.23 0.95 0.00 0.00 0.00 175.76 175.63 2vl4 s THR 222 N -3.81 2.08 -0.47 0.00 -4.23 -0.42 -4.57 115.64 104.20 2vl4 s THR 222 Ca 0.05 -1.85 -0.23 0.00 -1.18 0.00 0.00 61.69 58.48 2vl4 s THR 222 Cb -0.03 -1.92 0.03 0.00 1.34 0.00 0.00 72.50 71.93 2vl4 s THR 222 CO -0.06 -0.11 0.80 -0.63 -0.54 0.00 0.00 174.62 174.08 2vl4 s ILE 223 N -1.52 4.62 -0.14 2.99 1.01 -1.26 -0.87 121.20 126.02 2vl4 s ILE 223 Ca 0.15 0.31 0.18 0.00 0.00 0.00 0.00 60.65 61.29 2vl4 s ILE 223 Cb -0.08 -4.36 0.13 0.00 0.01 0.00 0.00 42.46 38.16 2vl4 s ILE 223 CO 0.07 -0.80 1.54 0.28 0.00 0.00 0.00 174.94 176.03 2vl4 h SER 224 N 9.05 0.00 -3.87 3.58 0.02 -1.08 -3.46 113.55 117.78 2vl4 h SER 224 Ca -0.25 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.63 2vl4 h SER 224 Cb 1.08 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 63.40 2vl4 h SER 224 CO 0.98 0.38 -0.02 -0.62 -1.14 0.00 0.00 176.83 176.41 2vl4 s ASP 225 N -6.38 -0.64 -0.10 3.07 2.15 -1.09 -4.99 116.67 108.70 2vl4 s ASP 225 Ca 0.04 1.21 -0.01 0.00 0.43 0.00 0.00 52.55 54.22 2vl4 s ASP 225 Cb 0.08 1.21 0.03 0.00 -0.30 0.00 0.00 42.92 43.93 2vl4 s ASP 225 CO 0.72 -0.21 -0.05 -0.47 -0.17 0.00 0.00 175.17 174.99 2vl4 s TYR 226 N 0.43 1.20 -0.20 -5.34 5.04 -1.26 -1.20 117.35 116.02 2vl4 s TYR 226 Ca -0.01 -0.53 0.02 0.00 -2.44 0.00 0.00 57.07 54.10 2vl4 s TYR 226 Cb -0.04 -1.07 0.03 0.00 0.35 0.00 0.00 41.96 41.23 2vl4 s TYR 226 CO -0.01 -0.44 -0.16 -0.47 -1.34 0.00 0.00 175.55 173.13 2vl4 s TYR 227 N 1.76 2.87 -0.57 4.97 5.04 0.11 -4.94 117.35 126.58 2vl4 s TYR 227 Ca 0.04 -1.83 -0.21 0.00 -2.44 0.00 0.00 57.07 52.64 2vl4 s TYR 227 Cb -0.13 -1.88 0.07 0.00 0.35 0.00 0.00 41.96 40.37 2vl4 s TYR 227 CO -0.07 -0.82 0.79 0.08 -1.34 0.00 0.00 175.55 174.19 2vl4 s VAL 228 N 1.25 4.63 -0.20 3.14 1.01 -1.26 -0.89 120.40 128.07 2vl4 s VAL 228 Ca 0.00 -0.43 -0.15 0.00 0.00 0.00 0.00 61.98 61.40 2vl4 s VAL 228 Cb -0.15 -4.49 -0.04 0.00 0.00 0.00 0.00 36.38 31.70 2vl4 s VAL 228 CO -0.10 -1.11 0.37 -0.60 0.00 0.00 0.00 175.10 173.66 2vl4 s ARG 229 N 3.27 4.17 -0.34 2.72 3.52 0.03 -4.93 118.95 127.38 2vl4 s ARG 229 Ca 0.19 0.15 -0.22 0.00 -0.13 0.00 0.00 55.73 55.72 2vl4 s ARG 229 Cb -0.19 -3.53 0.00 0.00 -1.56 0.00 0.00 34.95 29.68 2vl4 s ARG 229 CO 0.11 -0.02 0.73 -1.14 -0.81 0.00 0.00 175.30 174.18 2vl4 s GLN 230 N 1.25 3.80 -0.08 5.12 0.74 -1.26 -0.29 119.66 128.94 2vl4 s GLN 230 Ca 0.18 0.32 -0.14 0.00 0.05 0.00 0.00 55.36 55.76 2vl4 s GLN 230 Cb -0.15 -3.78 -0.29 0.00 1.10 0.00 0.00 33.01 29.89 2vl4 s GLN 230 CO 0.07 -0.75 0.63 -0.07 -0.55 0.00 0.00 175.29 174.62 2vl4 h LEU 231 N 9.53 0.49 -7.00 3.68 3.38 -1.05 -3.49 115.31 120.85 2vl4 h LEU 231 Ca -0.25 -0.89 -0.02 0.00 0.09 0.00 0.00 57.88 56.80 2vl4 h LEU 231 Cb 1.10 -0.16 -0.13 0.00 0.09 0.00 0.00 40.66 41.56 2vl4 h LEU 231 CO 0.88 1.67 0.22 -0.94 0.09 0.00 0.00 178.44 180.36 2vl4 s SER 232 N -7.14 -0.57 -0.15 -0.43 1.04 -1.07 -4.99 113.70 100.39 2vl4 s SER 232 Ca -0.18 0.12 -0.06 0.00 0.48 0.00 0.00 55.95 56.31 2vl4 s SER 232 Cb 0.04 0.58 0.07 0.00 0.10 0.00 0.00 66.02 66.81 2vl4 s SER 232 CO 0.81 -0.90 0.31 -0.22 0.98 0.00 0.00 173.24 174.23 2vl4 s LEU 233 N -2.48 -0.23 0.31 2.42 2.96 -1.26 -0.95 118.68 119.45 2vl4 s LEU 233 Ca -0.01 0.71 0.03 0.00 -0.22 0.00 0.00 54.13 54.64 2vl4 s LEU 233 Cb -0.01 0.94 -0.04 0.00 0.50 0.00 0.00 46.19 47.58 2vl4 s LEU 233 CO -0.09 -0.22 0.12 0.42 -1.32 0.00 0.00 176.35 175.26 2vl4 s THR 234 N 2.13 0.58 0.56 3.68 -4.23 -0.37 -5.01 115.64 112.97 2vl4 s THR 234 Ca -0.03 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.73 2vl4 s THR 234 Cb -0.11 -2.56 0.32 0.00 1.34 0.00 0.00 72.50 71.49 2vl4 s THR 234 CO -0.10 0.00 2.21 0.44 -0.54 0.00 0.00 174.62 176.63 2vl4 h ASP 235 N 2.17 0.00 0.44 3.99 3.32 -2.00 -2.98 116.42 121.35 2vl4 h ASP 235 Ca -0.36 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.38 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 0.58 0.01 -1.73 -0.33 -1.72 0.00 0.00 179.24 176.04 2vl4 h GLU 236 N 0.00 0.06 -2.45 3.56 3.07 -1.95 -3.35 114.58 113.52 2vl4 h GLU 236 Ca -0.00 -0.11 -0.09 0.00 -0.50 0.00 0.00 59.36 58.67 2vl4 h GLU 236 Cb 0.01 0.04 -0.22 0.00 -0.84 0.00 0.00 28.75 27.74 2vl4 h GLU 236 CO 0.00 0.68 -0.07 1.21 -1.40 0.00 0.00 179.01 179.42 2vl4 s ASN 237 N -6.33 -0.53 -0.16 1.42 2.47 -1.13 0.05 114.94 110.73 2vl4 s ASN 237 Ca -0.08 0.93 -0.01 0.00 0.42 0.00 0.00 52.86 54.12 2vl4 s ASN 237 Cb 0.08 0.94 -0.01 0.00 -1.45 0.00 0.00 41.25 40.81 2vl4 s ASN 237 CO 0.82 -0.27 -0.11 0.00 -3.72 0.00 0.00 177.10 173.81 2vl4 s ALA 238 N -0.07 2.64 -0.18 1.71 0.00 0.19 -1.24 121.76 124.81 2vl4 s ALA 238 Ca -0.03 -1.01 -0.04 0.00 0.00 0.00 0.00 51.96 50.88 2vl4 s ALA 238 Cb -0.03 -1.35 -0.03 0.00 0.00 0.00 0.00 23.12 21.71 2vl4 s ALA 238 CO 0.02 -0.01 -0.02 1.03 0.00 0.00 0.00 175.76 176.78 2vl4 s ARG 239 N 0.78 3.65 0.05 0.00 0.52 -0.12 -0.48 118.95 123.34 2vl4 s ARG 239 Ca -0.04 -0.52 0.08 0.00 -0.52 0.00 0.00 55.73 54.73 2vl4 s ARG 239 Cb -0.15 -3.00 -0.03 0.00 0.52 0.00 0.00 34.95 32.30 2vl4 s ARG 239 CO 0.01 0.13 -0.22 -0.51 0.02 0.00 0.00 175.30 174.73 2vl4 s LEU 240 N 0.67 2.18 -0.22 2.53 2.01 0.97 -0.35 118.68 126.47 2vl4 s LEU 240 Ca -0.01 -0.56 -0.02 0.00 0.01 0.00 0.00 54.13 53.55 2vl4 s LEU 240 Cb -0.14 -1.05 0.00 0.00 0.01 0.00 0.00 46.19 45.01 2vl4 s LEU 240 CO 0.02 0.18 -0.08 -0.55 1.01 0.00 0.00 176.35 176.93 2vl4 s SER 241 N -1.26 4.05 -0.33 2.29 0.15 0.60 -0.37 113.70 118.82 2vl4 s SER 241 Ca 0.09 -0.53 -0.20 0.00 0.70 0.00 0.00 55.95 56.01 2vl4 s SER 241 Cb -0.09 -1.67 -0.00 0.00 -1.71 0.00 0.00 66.02 62.54 2vl4 s SER 241 CO 0.02 -0.04 0.62 0.20 1.20 0.00 0.00 173.24 175.25 2vl4 s ASN 242 N 1.41 6.45 -0.27 5.45 0.01 0.70 -0.79 114.94 127.91 2vl4 s ASN 242 Ca 0.05 0.27 -0.02 0.00 -0.71 0.00 0.00 52.86 52.45 2vl4 s ASN 242 Cb -0.14 -2.32 0.03 0.00 0.41 0.00 0.00 41.25 39.22 2vl4 s ASN 242 CO -0.06 -0.52 -0.03 -1.61 -1.51 0.00 0.00 177.10 173.37 2vl4 s GLU 243 N 2.63 2.77 -0.09 -0.60 2.02 -0.07 -1.12 118.70 124.24 2vl4 s GLU 243 Ca 0.24 -1.03 0.01 0.00 0.02 0.00 0.00 54.97 54.21 2vl4 s GLU 243 Cb -0.15 -3.08 -0.03 0.00 0.10 0.00 0.00 34.13 30.98 2vl4 s GLU 243 CO 0.13 -0.46 -0.10 -0.51 0.02 0.00 0.00 175.26 174.35 2vl4 s LEU 244 N 1.33 2.97 -0.25 1.80 1.43 0.52 -0.71 118.68 125.76 2vl4 s LEU 244 Ca -0.01 -0.14 -0.05 0.00 -1.03 0.00 0.00 54.13 52.90 2vl4 s LEU 244 Cb -0.17 -1.65 -0.00 0.00 0.03 0.00 0.00 46.19 44.40 2vl4 s LEU 244 CO -0.03 0.30 0.02 -0.63 0.23 0.00 0.00 176.35 176.23 2vl4 s ILE 245 N -0.42 3.68 -0.14 -0.59 1.01 -0.34 -0.99 121.20 123.42 2vl4 s ILE 245 Ca 0.06 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.18 2vl4 s ILE 245 Cb -0.12 -2.78 0.01 0.00 0.01 0.00 0.00 42.46 39.58 2vl4 s ILE 245 CO 0.02 0.28 -0.21 -0.69 0.00 0.00 0.00 174.94 174.33 2vl4 s VAL 246 N 1.50 2.04 -0.34 2.92 1.01 -0.49 -0.38 120.40 126.65 2vl4 s VAL 246 Ca 0.04 -0.96 -0.10 0.00 0.00 0.00 0.00 61.98 60.96 2vl4 s VAL 246 Cb -0.16 -1.81 0.01 0.00 0.00 0.00 0.00 36.38 34.43 2vl4 s VAL 246 CO -0.00 0.54 0.17 0.21 0.00 0.00 0.00 175.10 176.02 2vl4 s ASN 247 N 0.89 5.57 -0.18 3.32 3.84 -0.05 -0.07 114.94 128.25 2vl4 s ASN 247 Ca -0.05 -0.80 -0.14 0.00 0.21 0.00 0.00 52.86 52.08 2vl4 s ASN 247 Cb -0.15 -1.99 -0.05 0.00 -0.55 0.00 0.00 41.25 38.51 2vl4 s ASN 247 CO -0.04 -0.29 0.29 -1.58 -2.79 0.00 0.00 177.10 172.70 2vl4 s GLN 248 N 1.56 4.22 0.09 0.43 0.74 -0.60 -1.31 119.66 124.79 2vl4 s GLN 248 Ca 0.03 0.06 0.22 0.00 0.05 0.00 0.00 55.36 55.72 2vl4 s GLN 248 Cb -0.18 -3.46 -0.15 0.00 1.10 0.00 0.00 33.01 30.32 2vl4 s GLN 248 CO 0.06 0.16 0.78 1.51 -0.55 0.00 0.00 175.29 177.25 2vl4 n ILE 249 N 3.82 0.45 -3.02 -2.34 0.13 0.10 -0.94 119.36 117.57 2vl4 n ILE 249 Ca -0.12 -0.55 -0.31 0.00 -1.10 0.00 0.00 62.75 60.68 2vl4 n ILE 249 Cb 0.52 -0.24 -0.04 0.00 -0.84 0.00 0.00 39.64 39.03 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 -3.36 4.80 -0.30 9.51 -7.23 -1.24 -4.96 120.40 117.61 2vl4 s VAL 250 Ca -0.04 0.62 0.27 0.00 -1.81 0.00 0.00 61.98 61.02 2vl4 s VAL 250 Cb 0.11 -3.70 0.35 0.00 0.56 0.00 0.00 36.38 33.70 2vl4 s VAL 250 CO 0.84 -0.39 1.75 1.55 -0.31 0.00 0.00 175.10 178.54 2vl4 h PRO 251 N 1.63 0.00 -6.80 4.82 0.13 -1.97 -3.38 132.00 126.42 2vl4 h PRO 251 Ca -0.47 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.21 2vl4 h PRO 251 Cb 1.18 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.35 2vl4 h PRO 251 CO 0.65 0.00 -0.05 1.14 -0.23 0.00 0.00 178.00 179.51 2vl4 s GLN 252 N -3.35 2.70 -0.02 0.86 0.00 -1.26 -4.70 119.66 113.89 2vl4 s GLN 252 Ca 0.05 -0.68 -0.30 0.00 -0.00 0.00 0.00 55.36 54.44 2vl4 s GLN 252 Cb 0.07 -2.50 -0.05 0.00 0.00 0.00 0.00 33.01 30.53 2vl4 s GLN 252 CO 0.61 -0.58 1.35 0.15 0.00 0.00 0.00 175.29 176.81 2vl4 s LYS 253 N -4.71 4.29 -0.22 9.60 -0.14 -1.26 -4.32 119.74 122.99 2vl4 s LYS 253 Ca 0.55 1.89 -0.03 0.00 -1.36 0.00 0.00 55.97 57.01 2vl4 s LYS 253 Cb -0.10 -3.59 -0.01 0.00 -1.68 0.00 0.00 37.83 32.46 2vl4 s LYS 253 CO 0.38 -0.56 -0.05 0.42 -0.76 0.00 0.00 175.35 174.79 2vl4 s ILE 254 N 2.44 3.27 0.18 2.17 -1.09 -0.41 -4.95 121.20 122.80 2vl4 s ILE 254 Ca 0.62 -0.54 -0.30 0.00 -2.23 0.00 0.00 60.65 58.19 2vl4 s ILE 254 Cb -0.29 -2.49 -0.08 0.00 -1.58 0.00 0.00 42.46 38.01 2vl4 s ILE 254 CO 0.25 0.42 1.29 -2.16 -1.23 0.00 0.00 174.94 173.50 2vl4 s PRO 255 N 1.46 4.41 0.09 2.79 0.04 -1.26 -0.03 135.00 142.50 2vl4 s PRO 255 Ca 0.06 2.00 -0.08 0.00 0.04 0.00 0.00 61.00 63.01 2vl4 s PRO 255 Cb -0.14 -3.22 -0.00 0.00 0.04 0.00 0.00 34.50 31.17 2vl4 s PRO 255 CO -0.04 -0.24 0.18 0.00 0.04 0.00 0.00 177.00 176.94 2vl4 s ALA 256 N 0.24 -0.17 -0.16 8.56 0.00 -0.00 -4.63 121.76 125.61 2vl4 s ALA 256 Ca 0.57 -0.67 -0.01 0.00 0.00 0.00 0.00 51.96 51.85 2vl4 s ALA 256 Cb -0.35 0.48 -0.01 0.00 0.00 0.00 0.00 23.12 23.24 2vl4 s ALA 256 CO 0.36 -0.50 -0.12 -2.00 0.00 0.00 0.00 175.76 173.50 2vl4 s GLU 257 N -3.87 3.33 -0.16 0.00 2.12 -0.11 -0.11 118.70 119.91 2vl4 s GLU 257 Ca 0.05 -0.69 -0.15 0.00 0.36 0.00 0.00 54.97 54.54 2vl4 s GLU 257 Cb 0.05 -2.72 -0.04 0.00 0.26 0.00 0.00 34.13 31.68 2vl4 s GLU 257 CO -0.11 0.06 0.35 0.08 -0.54 0.00 0.00 175.26 175.10 2vl4 s VAL 258 N 0.75 5.26 -0.07 3.70 1.01 0.66 -0.93 120.40 130.79 2vl4 s VAL 258 Ca -0.05 0.67 0.04 0.00 0.00 0.00 0.00 61.98 62.64 2vl4 s VAL 258 Cb -0.15 -3.69 -0.00 0.00 0.00 0.00 0.00 36.38 32.54 2vl4 s VAL 258 CO 0.01 0.34 -0.21 -0.13 0.00 0.00 0.00 175.10 175.12 2vl4 s ARG 259 N 0.70 2.42 -0.18 2.72 0.52 -0.60 -1.09 118.95 123.44 2vl4 s ARG 259 Ca 0.19 -0.74 0.01 0.00 -0.52 0.00 0.00 55.73 54.67 2vl4 s ARG 259 Cb -0.14 -1.94 0.02 0.00 0.52 0.00 0.00 34.95 33.41 2vl4 s ARG 259 CO 0.06 0.21 -0.19 0.08 0.02 0.00 0.00 175.30 175.48 2vl4 s VAL 260 N 0.23 2.19 -0.18 3.52 1.01 0.79 -0.30 120.40 127.66 2vl4 s VAL 260 Ca -0.12 -0.90 -0.08 0.00 0.00 0.00 0.00 61.98 60.89 2vl4 s VAL 260 Cb -0.15 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 2vl4 s VAL 260 CO 0.05 0.53 0.08 0.21 0.00 0.00 0.00 175.10 175.97 2vl4 s ASN 261 N 1.27 5.76 -0.18 3.32 3.84 0.83 -1.21 114.94 128.57 2vl4 s ASN 261 Ca 0.04 0.13 -0.02 0.00 0.21 0.00 0.00 52.86 53.23 2vl4 s ASN 261 Cb -0.13 -1.98 -0.00 0.00 -0.55 0.00 0.00 41.25 38.59 2vl4 s ASN 261 CO -0.11 0.19 -0.10 -0.69 -2.79 0.00 0.00 177.10 173.60 2vl4 s VAL 262 N 0.26 2.97 0.09 -5.21 1.01 0.28 0.12 120.40 119.92 2vl4 s VAL 262 Ca 0.05 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.40 2vl4 s VAL 262 Cb -0.12 -2.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 2vl4 s VAL 262 CO -0.00 0.48 -0.06 -0.94 0.00 0.00 0.00 175.10 174.57 2vl4 s SER 263 N 1.11 1.09 -0.06 3.32 1.04 -0.20 0.18 113.70 120.18 2vl4 s SER 263 Ca 0.01 -0.98 -0.01 0.00 0.48 0.00 0.00 55.95 55.44 2vl4 s SER 263 Cb -0.14 0.10 0.03 0.00 0.10 0.00 0.00 66.02 66.10 2vl4 s SER 263 CO -0.03 -0.46 0.01 -0.22 0.98 0.00 0.00 173.24 173.53 2vl4 s LEU 264 N -2.95 0.51 -1.52 2.42 2.96 -0.47 -0.17 118.68 119.45 2vl4 s LEU 264 Ca 0.10 -0.05 -0.11 0.00 -0.22 0.00 0.00 54.13 53.86 2vl4 s LEU 264 Cb 0.05 -0.38 0.08 0.00 0.50 0.00 0.00 46.19 46.44 2vl4 s LEU 264 CO -0.05 -0.20 0.81 0.59 -1.32 0.00 0.00 176.35 176.18 2vl4 n ASN 265 N 5.16 -3.19 0.00 3.68 3.02 -1.26 -2.28 115.26 120.39 2vl4 n ASN 265 Ca -0.07 -0.88 0.00 0.00 -0.03 0.00 0.00 54.58 53.61 2vl4 n ASN 265 Cb 0.50 -3.52 0.00 0.00 -0.61 0.00 0.00 39.78 36.15 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 -1.65 0.89 3.23 7.41 0.00 -1.26 -5.04 105.19 108.77 2vl4 n GLY 266 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.91 2.28 0.20 2.61 2.01 -0.97 -5.10 115.64 113.76 2vl4 s THR 267 Ca 0.00 -0.92 -0.32 0.00 0.31 0.00 0.00 61.69 60.76 2vl4 s THR 267 Cb 0.00 -1.91 -0.12 0.00 0.01 0.00 0.00 72.50 70.48 2vl4 s THR 267 CO 0.00 0.54 1.72 0.41 -0.69 0.00 0.00 174.62 176.60 2vl4 n THR 268 N 3.81 0.01 -0.11 -0.82 -1.04 -1.26 -1.37 114.28 113.50 2vl4 n THR 268 Ca -0.19 -0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 61.64 2vl4 n THR 268 Cb 0.52 -1.95 -0.10 0.00 -1.82 0.00 0.00 70.33 66.99 2vl4 n THR 268 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2vl4 n VAL 269 N 3.95 1.26 -3.90 12.58 0.24 0.13 -4.90 118.33 127.68 2vl4 n VAL 269 Ca 0.16 -0.43 -0.10 0.00 -2.04 0.00 0.00 64.34 61.93 2vl4 n VAL 269 Cb 0.34 -1.43 -0.09 0.00 -1.47 0.00 0.00 33.84 31.20 2vl4 n VAL 269 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2vl4 s THR 270 N -2.43 0.13 -0.04 3.34 -1.32 -0.93 -5.01 115.64 109.38 2vl4 s THR 270 Ca -0.30 -1.05 0.01 0.00 -1.21 0.00 0.00 61.69 59.14 2vl4 s THR 270 Cb 0.09 -0.93 0.02 0.00 -1.51 0.00 0.00 72.50 70.17 2vl4 s THR 270 CO 0.48 -0.58 -0.04 -1.61 -2.21 0.00 0.00 174.62 170.66 2vl4 s GLU 271 N -2.68 0.70 0.12 7.08 0.41 -1.26 -0.56 118.70 122.52 2vl4 s GLU 271 Ca -0.04 -0.08 0.06 0.00 -0.41 0.00 0.00 54.97 54.50 2vl4 s GLU 271 Cb -0.01 -0.74 -0.04 0.00 -1.78 0.00 0.00 34.13 31.57 2vl4 s GLU 271 CO -0.05 -0.07 -0.14 0.14 -0.49 0.00 0.00 175.26 174.65 2vl4 s VAL 272 N 0.84 1.31 0.09 2.63 -7.23 -0.35 -4.99 120.40 112.70 2vl4 s VAL 272 Ca -0.11 -1.68 -0.13 0.00 -1.81 0.00 0.00 61.98 58.26 2vl4 s VAL 272 Cb -0.14 -1.49 0.02 0.00 0.56 0.00 0.00 36.38 35.33 2vl4 s VAL 272 CO -0.00 -0.40 0.30 -1.59 -0.31 0.00 0.00 175.10 173.10 2vl4 s LYS 273 N -2.59 0.91 -0.20 4.82 -2.85 -1.26 -0.15 119.74 118.42 2vl4 s LYS 273 Ca 0.08 -0.73 -0.11 0.00 -1.00 0.00 0.00 55.97 54.21 2vl4 s LYS 273 Cb -0.05 0.39 0.07 0.00 -2.06 0.00 0.00 37.83 36.17 2vl4 s LYS 273 CO 0.03 -0.31 0.50 -1.14 0.10 0.00 0.00 175.35 174.52 2vl4 s GLN 274 N -3.42 0.49 0.24 1.78 0.74 -0.25 -4.98 119.66 114.26 2vl4 s GLN 274 Ca 0.01 0.92 -0.30 0.00 0.05 0.00 0.00 55.36 56.05 2vl4 s GLN 274 Cb 0.02 0.03 -0.09 0.00 1.10 0.00 0.00 33.01 34.07 2vl4 s GLN 274 CO -0.09 -0.16 1.05 -0.65 -0.55 0.00 0.00 175.29 174.90 2vl4 s GLN 275 N 1.47 4.69 0.07 1.67 -1.52 -1.26 -0.24 119.66 124.53 2vl4 s GLN 275 Ca -0.10 1.69 -0.00 0.00 -1.95 0.00 0.00 55.36 55.00 2vl4 s GLN 275 Cb -0.07 -3.24 -0.04 0.00 -0.22 0.00 0.00 33.01 29.44 2vl4 s GLN 275 CO -0.15 0.26 -0.02 0.14 -0.25 0.00 0.00 175.29 175.27 2vl4 s VAL 276 N -0.91 0.31 -0.22 1.09 -7.23 0.85 -4.92 120.40 109.38 2vl4 s VAL 276 Ca 0.45 -1.85 -0.02 0.00 -1.81 0.00 0.00 61.98 58.74 2vl4 s VAL 276 Cb -0.29 -1.64 0.01 0.00 0.56 0.00 0.00 36.38 35.02 2vl4 s VAL 276 CO 0.37 -0.89 -0.08 -0.89 -0.31 0.00 0.00 175.10 173.30 2vl4 s THR 277 N -3.87 2.91 0.11 5.32 2.01 -1.26 -0.82 115.64 120.03 2vl4 s THR 277 Ca 0.11 -0.80 -0.26 0.00 0.31 0.00 0.00 61.69 61.05 2vl4 s THR 277 Cb 0.07 -2.37 -0.07 0.00 0.01 0.00 0.00 72.50 70.14 2vl4 s THR 277 CO -0.07 0.35 0.79 -0.76 -0.69 0.00 0.00 174.62 174.24 2vl4 s LEU 278 N 1.38 4.53 0.17 4.42 1.43 0.96 -4.88 118.68 126.68 2vl4 s LEU 278 Ca 0.03 1.58 0.03 0.00 -1.03 0.00 0.00 54.13 54.74 2vl4 s LEU 278 Cb -0.15 -3.30 -0.03 0.00 0.03 0.00 0.00 46.19 42.74 2vl4 s LEU 278 CO -0.06 0.10 0.29 -1.10 0.23 0.00 0.00 176.35 175.82 2vl4 s GLN 279 N -0.58 3.42 0.31 1.70 -0.21 -1.26 -1.29 119.66 121.75 2vl4 s GLN 279 Ca 0.38 -0.64 -0.28 0.00 0.02 0.00 0.00 55.36 54.84 2vl4 s GLN 279 Cb -0.22 -2.94 -0.13 0.00 1.00 0.00 0.00 33.01 30.72 2vl4 s GLN 279 CO 0.25 0.50 1.07 -2.30 -2.12 0.00 0.00 175.29 172.69 2vl4 n PRO 280 N -0.71 1.52 0.00 2.91 -0.02 -1.26 -4.44 135.00 133.00 2vl4 n PRO 280 Ca -0.07 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 2vl4 n PRO 280 Cb 0.55 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 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 1.12 -0.36 3.72 -1.23 0.00 -0.11 -4.89 105.19 103.43 2vl4 n GLY 281 Ca 0.08 -1.35 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 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 3.99 -0.04 -0.61 -1.09 -1.26 -1.56 121.20 120.64 2vl4 s ILE 282 Ca 0.00 1.56 0.06 0.00 -2.23 0.00 0.00 60.65 60.04 2vl4 s ILE 282 Cb 0.00 -4.00 -0.01 0.00 -1.58 0.00 0.00 42.46 36.87 2vl4 s ILE 282 CO 0.00 0.19 -0.22 0.20 -1.23 0.00 0.00 174.94 173.88 2vl4 s ASN 283 N 0.51 2.67 -0.24 3.58 0.01 0.90 -4.91 114.94 117.46 2vl4 s ASN 283 Ca 0.54 -0.43 -0.05 0.00 -0.71 0.00 0.00 52.86 52.21 2vl4 s ASN 283 Cb -0.29 -0.58 -0.01 0.00 0.41 0.00 0.00 41.25 40.78 2vl4 s ASN 283 CO 0.32 0.23 -0.00 -1.00 -1.51 0.00 0.00 177.10 175.14 2vl4 s HIS 284 N -0.24 3.02 -0.03 2.20 3.76 -1.26 -1.40 115.29 121.34 2vl4 s HIS 284 Ca 0.01 -0.84 0.07 0.00 -0.15 0.00 0.00 55.06 54.14 2vl4 s HIS 284 Cb -0.11 -2.15 -0.01 0.00 1.11 0.00 0.00 32.58 31.41 2vl4 s HIS 284 CO 0.02 -0.51 -0.23 0.42 -0.85 0.00 0.00 174.74 173.59 2vl4 s ILE 285 N 1.51 1.82 -0.09 0.60 1.01 -0.16 -5.01 121.20 120.88 2vl4 s ILE 285 Ca 0.05 -0.97 0.00 0.00 0.00 0.00 0.00 60.65 59.73 2vl4 s ILE 285 Cb -0.15 -1.52 0.02 0.00 0.01 0.00 0.00 42.46 40.83 2vl4 s ILE 285 CO -0.01 0.51 -0.07 -0.89 0.00 0.00 0.00 174.94 174.48 2vl4 s THR 286 N -0.40 0.92 -0.12 2.92 2.01 -1.26 -0.35 115.64 119.35 2vl4 s THR 286 Ca 0.05 -0.25 0.02 0.00 0.31 0.00 0.00 61.69 61.82 2vl4 s THR 286 Cb -0.10 -0.93 0.01 0.00 0.01 0.00 0.00 72.50 71.49 2vl4 s THR 286 CO 0.00 0.34 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.33 2vl4 s LEU 287 N 1.48 1.91 0.53 4.42 1.02 -0.27 -4.94 118.68 122.82 2vl4 s LEU 287 Ca 0.00 -0.51 -0.19 0.00 0.02 0.00 0.00 54.13 53.45 2vl4 s LEU 287 Cb -0.13 -1.26 -0.06 0.00 0.02 0.00 0.00 46.19 44.76 2vl4 s LEU 287 CO -0.05 0.05 1.06 -2.16 0.02 0.00 0.00 176.35 175.27 2vl4 s PRO 288 N 0.88 3.56 0.01 1.29 0.04 -1.26 -0.21 135.00 139.31 2vl4 s PRO 288 Ca -0.07 1.36 -0.07 0.00 0.04 0.00 0.00 61.00 62.25 2vl4 s PRO 288 Cb -0.15 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.33 2vl4 s PRO 288 CO -0.01 -0.63 0.14 0.00 0.04 0.00 0.00 177.00 176.53 2vl4 s ALA 289 N -2.10 -0.30 0.08 8.56 0.00 0.50 -4.87 121.76 123.63 2vl4 s ALA 289 Ca 0.67 -0.20 0.07 0.00 0.00 0.00 0.00 51.96 52.51 2vl4 s ALA 289 Cb -0.18 0.14 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 2vl4 s ALA 289 CO 0.27 -0.24 -0.20 -1.21 0.00 0.00 0.00 175.76 174.38 2vl4 s GLU 290 N -1.65 1.16 -0.16 0.00 2.02 -1.26 -0.02 118.70 118.79 2vl4 s GLU 290 Ca -0.13 -1.05 0.01 0.00 0.02 0.00 0.00 54.97 53.81 2vl4 s GLU 290 Cb -0.06 -1.34 0.02 0.00 0.10 0.00 0.00 34.13 32.85 2vl4 s GLU 290 CO 0.00 0.32 -0.15 0.08 0.02 0.00 0.00 175.26 175.54 2vl4 s VAL 291 N -1.05 1.67 0.27 2.63 1.01 0.36 -4.80 120.40 120.50 2vl4 s VAL 291 Ca 0.06 -0.74 -0.24 0.00 0.00 0.00 0.00 61.98 61.06 2vl4 s VAL 291 Cb -0.10 -1.58 -0.09 0.00 0.00 0.00 0.00 36.38 34.62 2vl4 s VAL 291 CO 0.03 0.44 0.86 0.42 0.00 0.00 0.00 175.10 176.85 2vl4 s THR 292 N 1.44 4.33 -1.36 3.92 -4.23 -1.26 0.54 115.64 119.02 2vl4 s THR 292 Ca 0.04 1.66 -0.07 0.00 -1.18 0.00 0.00 61.69 62.14 2vl4 s THR 292 Cb -0.13 -3.99 0.00 0.00 1.34 0.00 0.00 72.50 69.72 2vl4 s THR 292 CO -0.11 0.21 0.45 0.59 -0.54 0.00 0.00 174.62 175.23 2vl4 n ASN 293 N 0.75 -1.35 -4.76 3.99 5.03 0.11 -4.83 115.26 114.19 2vl4 n ASN 293 Ca -0.00 -1.07 -0.40 0.00 0.87 0.00 0.00 54.58 53.98 2vl4 n ASN 293 Cb 0.50 -2.81 0.02 0.00 -1.02 0.00 0.00 39.78 36.47 2vl4 n ASN 293 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 2vl4 s PRO 294 N -6.63 3.59 -0.37 3.52 0.04 -1.26 -4.96 135.00 128.94 2vl4 s PRO 294 Ca 0.13 2.38 -0.19 0.00 0.04 0.00 0.00 61.00 63.36 2vl4 s PRO 294 Cb -0.05 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.91 2vl4 s PRO 294 CO 0.90 -0.88 0.54 0.08 0.04 0.00 0.00 177.00 177.69 2vl4 s VAL 295 N -1.22 4.98 0.37 -0.36 1.01 -1.26 -4.98 120.40 118.93 2vl4 s VAL 295 Ca 0.63 0.30 -0.26 0.00 0.00 0.00 0.00 61.98 62.65 2vl4 s VAL 295 Cb -0.43 -4.02 -0.09 0.00 0.00 0.00 0.00 36.38 31.84 2vl4 s VAL 295 CO 0.54 -0.30 1.08 -0.13 0.00 0.00 0.00 175.10 176.30 2vl4 s ARG 296 N 2.48 4.27 -0.03 2.72 0.52 -1.26 -4.59 118.95 123.06 2vl4 s ARG 296 Ca 0.20 1.64 -0.30 0.00 -0.52 0.00 0.00 55.73 56.75 2vl4 s ARG 296 Cb -0.15 -2.73 -0.04 0.00 0.52 0.00 0.00 34.95 32.55 2vl4 s ARG 296 CO 0.14 -0.08 1.18 -0.46 0.02 0.00 0.00 175.30 176.10 2vl4 s TRP 297 N -1.48 3.29 0.10 -0.53 -0.00 -0.61 -4.23 118.94 115.47 2vl4 s TRP 297 Ca 0.54 1.28 0.05 0.00 -0.00 0.00 0.00 56.10 57.98 2vl4 s TRP 297 Cb -0.26 -3.39 -0.04 0.00 -0.00 0.00 0.00 33.47 29.78 2vl4 s TRP 297 CO 0.33 -1.17 0.00 -1.64 -0.00 0.00 0.00 176.95 174.47 2vl4 s MET 298 N 1.86 2.54 0.60 5.86 -1.94 -0.35 -4.70 119.30 123.18 2vl4 s MET 298 Ca 0.56 -0.86 -0.14 0.00 -1.71 0.00 0.00 55.69 53.54 2vl4 s MET 298 Cb -0.25 -2.53 -0.04 0.00 2.01 0.00 0.00 34.83 34.02 2vl4 s MET 298 CO 0.24 0.53 1.03 -1.25 -0.01 0.00 0.00 175.02 175.56 2vl4 s PRO 299 N -2.37 3.47 -0.08 2.03 0.04 -1.26 -3.82 135.00 133.01 2vl4 s PRO 299 Ca 0.26 0.99 -0.37 0.00 0.04 0.00 0.00 61.00 61.92 2vl4 s PRO 299 Cb -0.11 -2.06 -0.14 0.00 0.04 0.00 0.00 34.50 32.22 2vl4 s PRO 299 CO 0.18 -0.68 1.67 -1.71 0.04 0.00 0.00 177.00 176.51 2vl4 n ASN 300 N -2.30 2.64 0.00 6.66 5.15 0.48 -0.48 115.26 127.41 2vl4 n ASN 300 Ca 0.07 1.06 0.00 0.00 -0.60 0.00 0.00 54.58 55.11 2vl4 n ASN 300 Cb 0.54 -1.26 0.00 0.00 -0.53 0.00 0.00 39.78 38.53 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 3.79 2.95 0.58 8.20 0.00 -1.26 -4.72 105.19 114.73 2vl4 n GLY 301 Ca 0.22 0.00 0.07 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 -1.15 0.13 -0.01 1.61 7.02 0.37 -4.92 117.44 120.48 2vl4 n TRP 302 Ca 0.00 -0.12 0.00 0.00 -1.02 0.00 0.00 57.50 56.36 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 0.73 0.81 3.76 6.99 0.00 -1.23 -4.83 105.19 111.42 2vl4 n GLY 303 Ca 0.09 -1.69 -0.40 0.00 0.00 0.00 0.00 46.02 44.02 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 -3.62 4.59 -1.44 2.61 2.01 -1.26 -4.77 115.64 113.76 2vl4 s THR 304 Ca 0.00 1.66 -0.11 0.00 0.31 0.00 0.00 61.69 63.55 2vl4 s THR 304 Cb 0.00 -4.12 0.05 0.00 0.01 0.00 0.00 72.50 68.43 2vl4 s THR 304 CO 0.00 0.43 2.35 -0.81 -0.69 0.00 0.00 174.62 175.89 2vl4 n PRO 305 N 2.33 3.43 -1.81 4.92 -0.04 -1.25 -1.20 135.00 141.39 2vl4 n PRO 305 Ca -0.04 -2.81 -0.42 0.00 -0.04 0.00 0.00 63.50 60.19 2vl4 n PRO 305 Cb 0.50 -3.01 -0.03 0.00 -0.04 0.00 0.00 33.50 30.91 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 1.81 2.50 -0.17 0.52 2.01 -1.26 -4.76 115.64 116.28 2vl4 s THR 306 Ca 0.52 0.21 0.00 0.00 0.31 0.00 0.00 61.69 62.73 2vl4 s THR 306 Cb 0.15 -3.14 0.04 0.00 0.01 0.00 0.00 72.50 69.56 2vl4 s THR 306 CO -0.06 0.01 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.03 2vl4 s LEU 307 N 1.89 1.86 0.54 4.42 1.43 -1.26 -4.06 118.68 123.49 2vl4 s LEU 307 Ca 0.75 -0.71 -0.17 0.00 -1.03 0.00 0.00 54.13 52.97 2vl4 s LEU 307 Cb -0.45 -1.06 -0.06 0.00 0.03 0.00 0.00 46.19 44.64 2vl4 s LEU 307 CO 0.33 -0.15 1.03 -0.31 0.23 0.00 0.00 176.35 177.48 2vl4 s TYR 308 N 1.53 3.12 -0.31 0.29 2.02 0.43 -4.65 117.35 119.78 2vl4 s TYR 308 Ca 0.01 1.52 -0.11 0.00 -0.37 0.00 0.00 57.07 58.12 2vl4 s TYR 308 Cb -0.15 -2.96 -0.03 0.00 -0.40 0.00 0.00 41.96 38.42 2vl4 s TYR 308 CO -0.08 -0.81 0.20 -0.51 -1.57 0.00 0.00 175.55 172.78 2vl4 s ASP 309 N -2.62 5.92 -0.25 2.29 1.01 0.76 -0.24 116.67 123.53 2vl4 s ASP 309 Ca 0.63 -0.25 -0.07 0.00 0.71 0.00 0.00 52.55 53.57 2vl4 s ASP 309 Cb -0.14 -2.10 -0.02 0.00 1.01 0.00 0.00 42.92 41.66 2vl4 s ASP 309 CO 0.30 -0.14 0.06 -0.36 0.21 0.00 0.00 175.17 175.24 2vl4 s PHE 310 N 1.72 3.08 -0.13 4.23 0.40 -0.39 -1.03 117.98 125.85 2vl4 s PHE 310 Ca 0.06 -0.50 0.03 0.00 -0.60 0.00 0.00 56.93 55.92 2vl4 s PHE 310 Cb -0.17 -2.23 0.01 0.00 0.51 0.00 0.00 43.02 41.15 2vl4 s PHE 310 CO 0.10 -0.39 -0.21 0.45 0.70 0.00 0.00 175.22 175.87 2vl4 s SER 311 N 1.60 2.97 -0.17 1.36 0.15 0.12 -1.59 113.70 118.15 2vl4 s SER 311 Ca 0.06 -0.56 -0.05 0.00 0.70 0.00 0.00 55.95 56.10 2vl4 s SER 311 Cb -0.15 -1.37 -0.03 0.00 -1.71 0.00 0.00 66.02 62.76 2vl4 s SER 311 CO 0.03 0.08 -0.01 0.00 1.20 0.00 0.00 173.24 174.53 2vl4 s ALA 312 N 0.78 3.07 0.07 5.45 0.00 -0.14 -0.12 121.76 130.87 2vl4 s ALA 312 Ca -0.09 -0.84 0.08 0.00 0.00 0.00 0.00 51.96 51.11 2vl4 s ALA 312 Cb -0.16 -1.65 -0.03 0.00 0.00 0.00 0.00 23.12 21.28 2vl4 s ALA 312 CO -0.00 0.14 -0.21 -0.65 0.00 0.00 0.00 175.76 175.04 2vl4 s GLN 313 N 0.48 1.30 -0.34 0.00 -0.21 0.59 -1.33 119.66 120.14 2vl4 s GLN 313 Ca -0.02 -1.06 -0.07 0.00 0.02 0.00 0.00 55.36 54.24 2vl4 s GLN 313 Cb -0.14 -1.50 0.03 0.00 1.00 0.00 0.00 33.01 32.41 2vl4 s GLN 313 CO 0.02 0.37 0.11 0.42 -2.12 0.00 0.00 175.29 174.09 2vl4 s ILE 314 N -0.96 3.87 -0.19 1.08 -1.09 0.34 -1.55 121.20 122.69 2vl4 s ILE 314 Ca 0.08 -1.06 -0.08 0.00 -2.23 0.00 0.00 60.65 57.36 2vl4 s ILE 314 Cb -0.09 -3.16 -0.04 0.00 -1.58 0.00 0.00 42.46 37.58 2vl4 s ILE 314 CO 0.03 -0.15 0.07 0.00 -1.23 0.00 0.00 174.94 173.66 2vl4 s ALA 315 N 1.43 3.39 -0.27 9.38 0.00 -0.10 -1.43 121.76 134.15 2vl4 s ALA 315 Ca -0.01 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.17 2vl4 s ALA 315 Cb -0.19 -1.97 0.07 0.00 0.00 0.00 0.00 23.12 21.03 2vl4 s ALA 315 CO 0.03 0.07 -0.04 0.00 0.00 0.00 0.00 175.76 175.82 2vl4 n GLY 317 N 4.50 3.66 0.22 0.00 0.00 -1.26 -1.02 105.19 111.28 2vl4 n GLY 317 Ca -0.09 -0.06 0.10 0.00 0.00 0.00 0.00 46.02 45.98 2vl4 n GLY 317 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2vl4 h ASP 318 N 0.00 0.00 -3.37 1.61 3.32 -2.02 -3.47 116.42 112.50 2vl4 h ASP 318 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 2vl4 h ASP 318 Cb 0.00 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.48 2vl4 h ASP 318 CO 0.00 0.20 0.08 -0.13 -1.72 0.00 0.00 179.24 177.67 2vl4 s ARG 319 N -3.56 4.35 -0.83 3.56 0.52 -0.19 -4.99 118.95 117.79 2vl4 s ARG 319 Ca 0.01 0.74 -0.22 0.00 -0.52 0.00 0.00 55.73 55.74 2vl4 s ARG 319 Cb 0.09 -3.49 0.08 0.00 0.52 0.00 0.00 34.95 32.16 2vl4 s ARG 319 CO 0.64 -0.03 1.16 0.42 0.02 0.00 0.00 175.30 177.51 2vl4 s ILE 320 N 1.17 4.29 0.08 1.52 -1.09 -1.26 -0.47 121.20 125.43 2vl4 s ILE 320 Ca 0.33 -0.74 0.12 0.00 -2.23 0.00 0.00 60.65 58.12 2vl4 s ILE 320 Cb -0.17 -4.83 -0.05 0.00 -1.58 0.00 0.00 42.46 35.84 2vl4 s ILE 320 CO 0.14 -1.63 1.45 -0.37 -1.23 0.00 0.00 174.94 173.31 2vl4 h VAL 321 N 6.11 1.30 -3.13 2.92 -1.51 -1.58 -0.40 116.25 119.97 2vl4 h VAL 321 Ca -0.04 -2.57 -0.17 0.00 -1.23 0.00 0.00 66.70 62.68 2vl4 h VAL 321 Cb 1.04 2.47 -0.27 0.00 -2.13 0.00 0.00 31.29 32.40 2vl4 h VAL 321 CO 1.22 0.69 -0.45 0.00 -1.23 0.00 0.00 177.57 177.80 2vl4 s ALA 322 N -3.07 -0.58 -0.02 5.19 0.00 -1.22 -4.27 121.76 117.78 2vl4 s ALA 322 Ca 0.01 0.75 -0.06 0.00 0.00 0.00 0.00 51.96 52.66 2vl4 s ALA 322 Cb 0.10 -0.45 0.01 0.00 0.00 0.00 0.00 23.12 22.78 2vl4 s ALA 322 CO 0.77 -0.13 0.14 -2.00 0.00 0.00 0.00 175.76 174.54 2vl4 s GLU 323 N 0.40 0.35 -0.04 0.00 -6.30 -1.26 -0.51 118.70 111.34 2vl4 s GLU 323 Ca -0.02 -0.14 -0.03 0.00 -2.50 0.00 0.00 54.97 52.27 2vl4 s GLU 323 Cb -0.04 0.15 0.01 0.00 0.00 0.00 0.00 34.13 34.26 2vl4 s GLU 323 CO -0.02 -0.07 0.10 -1.14 0.02 0.00 0.00 175.26 174.15 2vl4 s GLN 324 N -0.76 0.11 0.11 4.30 2.00 -0.44 -2.85 119.66 122.13 2vl4 s GLN 324 Ca -0.08 0.16 0.07 0.00 -2.00 0.00 0.00 55.36 53.51 2vl4 s GLN 324 Cb -0.05 0.03 -0.04 0.00 0.80 0.00 0.00 33.01 33.76 2vl4 s GLN 324 CO 0.01 -0.03 -0.18 -1.12 -0.50 0.00 0.00 175.29 173.47 2vl4 s SER 325 N 0.16 2.31 0.03 6.67 0.01 -1.26 -0.96 113.70 120.66 2vl4 s SER 325 Ca -0.01 -0.72 0.01 0.00 1.31 0.00 0.00 55.95 56.54 2vl4 s SER 325 Cb -0.02 -0.11 -0.02 0.00 0.21 0.00 0.00 66.02 66.07 2vl4 s SER 325 CO -0.00 -0.01 -0.05 -1.00 0.41 0.00 0.00 173.24 172.58 2vl4 s HIS 326 N -1.47 0.45 -0.06 2.43 3.76 -0.62 -5.01 115.29 114.77 2vl4 s HIS 326 Ca 0.07 -0.58 -0.23 0.00 -0.15 0.00 0.00 55.06 54.17 2vl4 s HIS 326 Cb -0.09 -0.29 -0.04 0.00 1.11 0.00 0.00 32.58 33.27 2vl4 s HIS 326 CO 0.04 -0.16 0.69 1.03 -0.85 0.00 0.00 174.74 175.49 2vl4 s ARG 327 N -1.79 4.43 -0.09 1.40 0.52 -1.26 -1.27 118.95 120.90 2vl4 s ARG 327 Ca -0.11 0.88 0.03 0.00 -0.52 0.00 0.00 55.73 56.01 2vl4 s ARG 327 Cb -0.08 -3.44 0.00 0.00 0.52 0.00 0.00 34.95 31.96 2vl4 s ARG 327 CO -0.01 0.10 -0.20 0.42 0.02 0.00 0.00 175.30 175.63 2vl4 s ILE 328 N 0.68 1.72 -0.23 1.52 -1.09 0.66 -4.67 121.20 119.80 2vl4 s ILE 328 Ca 0.37 -0.83 -0.10 0.00 -2.23 0.00 0.00 60.65 57.87 2vl4 s ILE 328 Cb -0.18 -1.51 -0.05 0.00 -1.58 0.00 0.00 42.46 39.15 2vl4 s ILE 328 CO 0.18 0.49 0.13 -0.83 -1.23 0.00 0.00 174.94 173.68 2vl4 s GLY 329 N 0.43 1.95 -0.51 6.18 0.00 -1.26 -0.43 107.32 113.67 2vl4 s GLY 329 Ca -0.17 -0.87 -0.23 0.00 0.00 0.00 0.00 44.72 43.45 2vl4 s GLY 329 CO 0.07 0.33 0.84 1.08 0.00 0.00 0.00 173.10 175.41 2vl4 s LEU 330 N 0.93 4.31 0.18 0.66 1.43 -1.26 -4.78 118.68 120.15 2vl4 s LEU 330 Ca 0.06 -0.39 -0.23 0.00 -1.03 0.00 0.00 54.13 52.55 2vl4 s LEU 330 Cb -0.13 -2.79 0.06 0.00 0.03 0.00 0.00 46.19 43.35 2vl4 s LEU 330 CO 0.03 -1.08 0.61 0.00 0.23 0.00 0.00 176.35 176.15 2vl4 s ARG 331 N 3.52 1.35 -0.06 1.70 3.03 -1.26 -1.57 118.95 125.66 2vl4 s ARG 331 Ca 0.27 -0.55 0.00 0.00 2.03 0.00 0.00 55.73 57.48 2vl4 s ARG 331 Cb -0.14 0.59 -0.03 0.00 -1.03 0.00 0.00 34.95 34.34 2vl4 s ARG 331 CO 0.19 -0.60 -0.04 0.95 -1.13 0.00 0.00 175.30 174.68 2vl4 s THR 332 N -3.78 3.96 -0.12 4.99 -4.23 -1.26 -4.96 115.64 110.24 2vl4 s THR 332 Ca 0.03 -0.45 0.01 0.00 -1.18 0.00 0.00 61.69 60.09 2vl4 s THR 332 Cb -0.02 -2.67 0.02 0.00 1.34 0.00 0.00 72.50 71.17 2vl4 s THR 332 CO -0.10 0.55 -0.13 -0.63 -0.54 0.00 0.00 174.62 173.77 2vl4 s ILE 333 N -0.90 1.39 -0.10 2.99 1.01 -1.26 -0.25 121.20 124.09 2vl4 s ILE 333 Ca 0.14 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.27 2vl4 s ILE 333 Cb -0.11 -1.31 0.02 0.00 0.01 0.00 0.00 42.46 41.06 2vl4 s ILE 333 CO 0.04 0.42 -0.12 -0.60 0.00 0.00 0.00 174.94 174.68 2vl4 s ARG 334 N 1.35 1.88 -0.25 2.79 3.52 -0.24 -4.92 118.95 123.09 2vl4 s ARG 334 Ca 0.01 -0.44 -0.19 0.00 -0.13 0.00 0.00 55.73 54.98 2vl4 s ARG 334 Cb -0.13 -1.66 -0.02 0.00 -1.56 0.00 0.00 34.95 31.57 2vl4 s ARG 334 CO -0.07 -0.08 0.56 0.08 -0.81 0.00 0.00 175.30 174.98 2vl4 s VAL 335 N 1.05 5.04 -0.34 7.11 1.01 -1.26 -0.59 120.40 132.42 2vl4 s VAL 335 Ca -0.06 0.99 -0.13 0.00 0.00 0.00 0.00 61.98 62.78 2vl4 s VAL 335 Cb -0.15 -3.87 -0.01 0.00 0.00 0.00 0.00 36.38 32.35 2vl4 s VAL 335 CO -0.02 0.07 0.23 -0.69 0.00 0.00 0.00 175.10 174.70 2vl4 s VAL 336 N 2.31 5.20 -0.38 2.92 1.01 0.28 -4.97 120.40 126.77 2vl4 s VAL 336 Ca 0.23 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.94 2vl4 s VAL 336 Cb -0.16 -3.68 0.13 0.00 0.00 0.00 0.00 36.38 32.67 2vl4 s VAL 336 CO 0.09 -0.02 0.20 0.21 0.00 0.00 0.00 175.10 175.58 2vl4 s ASN 337 N 1.70 3.39 0.02 3.32 2.47 -1.26 -1.96 114.94 122.62 2vl4 s ASN 337 Ca 0.06 -2.23 0.00 0.00 0.42 0.00 0.00 52.86 51.10 2vl4 s ASN 337 Cb -0.17 -0.69 -0.02 0.00 -1.45 0.00 0.00 41.25 38.91 2vl4 s ASN 337 CO 0.10 -0.31 -0.03 -1.61 -3.72 0.00 0.00 177.10 171.53 2vl4 s GLU 338 N 0.92 0.30 0.24 0.43 2.02 -1.23 -4.91 118.70 116.48 2vl4 s GLU 338 Ca 0.16 -0.59 -0.31 0.00 0.02 0.00 0.00 54.97 54.25 2vl4 s GLU 338 Cb -0.23 0.10 -0.12 0.00 0.10 0.00 0.00 34.13 33.99 2vl4 s GLU 338 CO -0.05 -0.05 1.68 0.15 0.02 0.00 0.00 175.26 177.02 2vl4 s LYS 339 N -1.42 4.12 0.12 1.61 1.02 -1.26 -0.69 119.74 123.23 2vl4 s LYS 339 Ca -0.15 2.61 0.01 0.00 0.02 0.00 0.00 55.97 58.46 2vl4 s LYS 339 Cb -0.10 -3.05 -0.00 0.00 -0.52 0.00 0.00 37.83 34.16 2vl4 s LYS 339 CO -0.01 -0.72 0.13 -0.40 -0.92 0.00 0.00 175.35 173.44 2vl4 n ASP 340 N 3.26 -0.36 0.23 2.83 5.68 -0.37 -4.88 116.55 122.95 2vl4 n ASP 340 Ca 0.13 -1.69 0.16 0.00 -0.50 0.00 0.00 54.79 52.89 2vl4 n ASP 340 Cb 0.36 0.72 0.80 0.00 -1.14 0.00 0.00 41.12 41.86 2vl4 n ASP 340 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2vl4 h LYS 341 N 0.00 0.00 -0.01 0.11 2.10 -2.01 -2.24 116.57 114.53 2vl4 h LYS 341 Ca -0.09 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.56 2vl4 h LYS 341 Cb 0.40 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.73 2vl4 h LYS 341 CO 0.12 0.00 -0.44 -0.25 -2.00 0.00 0.00 179.45 176.88 2vl4 n ASP 342 N -2.66 1.65 0.00 7.07 8.00 -1.26 -5.06 116.55 124.29 2vl4 n ASP 342 Ca -0.01 -1.33 0.00 0.00 0.71 0.00 0.00 54.79 54.16 2vl4 n ASP 342 Cb 0.13 0.54 0.00 0.00 -0.02 0.00 0.00 41.12 41.76 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 1.27 0.94 2.72 0.44 0.00 -0.84 -4.55 105.19 105.16 2vl4 n GLY 343 Ca 0.07 -0.50 -0.23 0.00 0.00 0.00 0.00 46.02 45.35 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 0.37 0.92 1.61 2.02 -0.39 -1.23 118.70 122.01 2vl4 s GLU 344 Ca 0.00 0.08 -0.11 0.00 0.02 0.00 0.00 54.97 54.96 2vl4 s GLU 344 Cb 0.00 -1.12 0.15 0.00 0.10 0.00 0.00 34.13 33.25 2vl4 s GLU 344 CO 0.00 -0.40 1.10 -1.54 0.02 0.00 0.00 175.26 174.43 2vl4 s SER 345 N 2.03 3.07 -0.33 -0.19 1.04 0.14 -1.15 113.70 118.31 2vl4 s SER 345 Ca 0.04 1.77 0.05 0.00 0.48 0.00 0.00 55.95 58.29 2vl4 s SER 345 Cb -0.13 -2.38 0.18 0.00 0.10 0.00 0.00 66.02 63.79 2vl4 s SER 345 CO -0.06 -2.94 0.53 0.12 0.98 0.00 0.00 173.24 171.88 2vl4 s PHE 346 N -2.76 -1.42 0.17 5.02 5.36 -1.22 -3.55 117.98 119.57 2vl4 s PHE 346 Ca 0.65 0.45 -0.09 0.00 -0.96 0.00 0.00 56.93 56.97 2vl4 s PHE 346 Cb -0.20 0.11 -0.01 0.00 -0.34 0.00 0.00 43.02 42.58 2vl4 s PHE 346 CO 0.58 -1.07 0.30 1.52 -1.46 0.00 0.00 175.22 175.09 2vl4 s TYR 347 N 2.34 0.38 -0.15 10.12 -0.85 -0.83 -4.58 117.35 123.78 2vl4 s TYR 347 Ca 0.12 -0.74 -0.05 0.00 -0.52 0.00 0.00 57.07 55.88 2vl4 s TYR 347 Cb -0.10 -0.04 -0.04 0.00 0.38 0.00 0.00 41.96 42.17 2vl4 s TYR 347 CO -0.20 -0.73 0.03 -0.06 -1.52 0.00 0.00 175.55 173.07 2vl4 s PHE 348 N -3.97 3.21 -0.19 -3.49 0.08 -1.26 -0.56 117.98 111.80 2vl4 s PHE 348 Ca 0.17 0.06 -0.02 0.00 0.12 0.00 0.00 56.93 57.26 2vl4 s PHE 348 Cb 0.03 -1.98 -0.00 0.00 -0.57 0.00 0.00 43.02 40.50 2vl4 s PHE 348 CO 0.00 0.23 -0.11 -2.00 -0.10 0.00 0.00 175.22 173.25 2vl4 s GLU 349 N -0.02 3.26 -0.16 0.44 2.12 0.24 -0.35 118.70 124.24 2vl4 s GLU 349 Ca 0.05 -0.70 0.02 0.00 0.36 0.00 0.00 54.97 54.70 2vl4 s GLU 349 Cb -0.12 -2.80 0.01 0.00 0.26 0.00 0.00 34.13 31.48 2vl4 s GLU 349 CO 0.01 -0.12 -0.21 0.08 -0.54 0.00 0.00 175.26 174.48 2vl4 s VAL 350 N 1.21 2.10 -1.63 3.70 1.01 0.30 -1.08 120.40 126.01 2vl4 s VAL 350 Ca 0.02 -0.95 -0.13 0.00 0.00 0.00 0.00 61.98 60.92 2vl4 s VAL 350 Cb -0.14 -1.86 0.12 0.00 0.00 0.00 0.00 36.38 34.50 2vl4 s VAL 350 CO -0.04 0.54 0.67 0.59 0.00 0.00 0.00 175.10 176.86 2vl4 n ASN 351 N 4.28 -2.43 0.00 3.32 3.02 0.66 -1.68 115.26 122.42 2vl4 n ASN 351 Ca -0.20 -1.02 0.00 0.00 -0.03 0.00 0.00 54.58 53.32 2vl4 n ASN 351 Cb 0.51 -2.78 0.00 0.00 -0.61 0.00 0.00 39.78 36.90 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 -1.59 0.91 3.30 7.41 0.00 -1.26 -4.99 105.19 108.97 2vl4 n GLY 352 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 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 -3.62 3.15 0.09 -0.61 1.01 -0.68 -5.06 121.20 115.49 2vl4 s ILE 353 Ca 0.00 -0.58 -0.32 0.00 0.00 0.00 0.00 60.65 59.75 2vl4 s ILE 353 Cb 0.00 -2.40 -0.11 0.00 0.01 0.00 0.00 42.46 39.96 2vl4 s ILE 353 CO 0.00 0.46 1.80 -2.65 0.00 0.00 0.00 174.94 174.55 2vl4 n PRO 354 N 4.47 2.57 -4.05 2.79 -0.02 -1.26 -0.54 135.00 138.97 2vl4 n PRO 354 Ca -0.19 0.94 -0.33 0.00 -2.02 0.00 0.00 63.50 61.90 2vl4 n PRO 354 Cb 0.51 -2.80 -0.15 0.00 -0.02 0.00 0.00 33.50 31.04 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 2.62 2.60 0.02 -0.52 1.75 0.53 -4.91 119.30 121.39 2vl4 s MET 355 Ca 0.83 -1.11 -0.30 0.00 -1.25 0.00 0.00 55.69 53.85 2vl4 s MET 355 Cb -0.55 -2.85 -0.07 0.00 2.84 0.00 0.00 34.83 34.20 2vl4 s MET 355 CO 0.40 -0.44 1.61 0.12 -0.65 0.00 0.00 175.02 176.07 2vl4 s PHE 356 N 1.22 2.34 0.06 4.11 5.36 -1.26 -4.26 117.98 125.55 2vl4 s PHE 356 Ca -0.03 0.36 -0.29 0.00 -0.96 0.00 0.00 56.93 56.01 2vl4 s PHE 356 Cb -0.17 -3.90 -0.05 0.00 -0.34 0.00 0.00 43.02 38.56 2vl4 s PHE 356 CO -0.07 -3.63 0.92 0.00 -1.46 0.00 0.00 175.22 170.98 2vl4 s ALA 357 N 3.06 3.25 -0.14 11.12 0.00 -0.73 -4.94 121.76 133.37 2vl4 s ALA 357 Ca 0.72 0.49 -0.02 0.00 0.00 0.00 0.00 51.96 53.15 2vl4 s ALA 357 Cb -0.36 -3.23 0.05 0.00 0.00 0.00 0.00 23.12 19.58 2vl4 s ALA 357 CO 0.31 -0.07 0.01 0.15 0.00 0.00 0.00 175.76 176.15 2vl4 s LYS 358 N 0.33 0.73 0.00 0.00 1.02 -1.26 -0.64 119.74 119.91 2vl4 s LYS 358 Ca 0.46 -0.23 0.00 0.00 0.02 0.00 0.00 55.97 56.22 2vl4 s LYS 358 Cb -0.22 -1.67 0.00 0.00 -0.52 0.00 0.00 37.83 35.42 2vl4 s LYS 358 CO 0.27 -0.49 0.00 0.41 -0.92 0.00 0.00 175.35 174.62 2vl4 n GLY 359 N 5.07 -0.87 3.38 -3.33 0.00 -0.72 -0.34 105.19 108.38 2vl4 n GLY 359 Ca -0.09 -0.19 -0.11 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.14 -0.06 4.61 0.00 -1.20 -1.97 121.76 120.99 2vl4 s ALA 360 Ca 0.00 0.10 -0.26 0.00 0.00 0.00 0.00 51.96 51.79 2vl4 s ALA 360 Cb 0.00 0.78 -0.03 0.00 0.00 0.00 0.00 23.12 23.87 2vl4 s ALA 360 CO 0.00 -0.70 0.83 -0.80 0.00 0.00 0.00 175.76 175.09 2vl4 s ASN 361 N -2.80 7.13 -0.16 0.00 0.01 -0.24 -1.72 114.94 117.16 2vl4 s ASN 361 Ca 0.03 1.36 -0.07 0.00 -0.71 0.00 0.00 52.86 53.48 2vl4 s ASN 361 Cb 0.01 -2.48 -0.04 0.00 0.41 0.00 0.00 41.25 39.15 2vl4 s ASN 361 CO -0.11 -0.22 0.06 -0.47 -1.51 0.00 0.00 177.10 174.84 2vl4 s TYR 362 N 1.14 3.27 0.41 2.20 5.04 0.22 -0.00 117.35 129.62 2vl4 s TYR 362 Ca 0.43 0.12 0.07 0.00 -2.44 0.00 0.00 57.07 55.26 2vl4 s TYR 362 Cb -0.19 -2.02 -0.06 0.00 0.35 0.00 0.00 41.96 40.04 2vl4 s TYR 362 CO 0.21 0.25 0.12 0.96 -1.34 0.00 0.00 175.55 175.74 2vl4 s ILE 363 N 0.07 2.20 0.63 3.14 -4.36 -1.26 -2.61 121.20 119.01 2vl4 s ILE 363 Ca 0.05 -1.81 -0.19 0.00 -0.26 0.00 0.00 60.65 58.44 2vl4 s ILE 363 Cb -0.12 -3.00 -0.02 0.00 1.25 0.00 0.00 42.46 40.57 2vl4 s ILE 363 CO 0.01 -0.00 1.30 -2.84 0.24 0.00 0.00 174.94 173.64 2vl4 s PRO 364 N -3.83 2.66 0.00 0.37 0.02 -1.26 -4.88 135.00 128.08 2vl4 s PRO 364 Ca 0.39 2.08 0.28 0.00 0.02 0.00 0.00 61.00 63.77 2vl4 s PRO 364 Cb 0.06 -1.91 1.16 0.00 0.02 0.00 0.00 34.50 33.83 2vl4 s PRO 364 CO 0.21 -1.52 1.83 1.04 -0.33 0.00 0.00 177.00 178.23 2vl4 n GLN 365 N -1.75 0.49 -3.56 5.54 6.02 -1.26 -3.61 117.38 119.25 2vl4 n GLN 365 Ca 0.15 -0.16 -0.17 0.00 -0.01 0.00 0.00 57.00 56.81 2vl4 n GLN 365 Cb 0.48 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 30.18 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 -2.62 -0.69 0.56 1.08 -1.08 -1.26 -4.41 116.67 108.26 2vl4 s ASP 366 Ca 0.25 0.95 0.25 0.00 -0.52 0.00 0.00 52.55 53.48 2vl4 s ASP 366 Cb 0.20 0.84 1.53 0.00 -1.46 0.00 0.00 42.92 44.02 2vl4 s ASP 366 CO 0.51 -0.49 2.12 0.00 0.52 0.00 0.00 175.17 177.83 2vl4 h ALA 367 N 3.65 1.94 -3.63 3.66 0.00 -1.75 -3.37 119.26 119.77 2vl4 h ALA 367 Ca -0.28 -0.01 -0.65 0.00 0.00 0.00 0.00 54.91 53.98 2vl4 h ALA 367 Cb 1.15 0.01 -0.40 0.00 0.00 0.00 0.00 17.79 18.55 2vl4 h ALA 367 CO 0.28 -0.22 -0.72 -0.51 0.00 0.00 0.00 179.25 178.08 2vl4 s LEU 368 N -8.25 4.54 0.24 0.00 1.43 -1.26 -4.95 118.68 110.43 2vl4 s LEU 368 Ca -0.05 -2.19 -0.05 0.00 -1.03 0.00 0.00 54.13 50.81 2vl4 s LEU 368 Cb 0.17 -1.57 0.35 0.00 0.03 0.00 0.00 46.19 45.16 2vl4 s LEU 368 CO 0.62 -0.37 1.83 -0.07 0.23 0.00 0.00 176.35 178.58 2vl4 h LEU 369 N 7.56 0.72 -0.19 1.79 3.38 -1.97 -1.90 115.31 124.71 2vl4 h LEU 369 Ca -0.05 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2vl4 h LEU 369 Cb 1.01 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.65 2vl4 h LEU 369 CO 0.53 0.44 0.00 -2.65 0.09 0.00 0.00 178.44 176.85 2vl4 n PRO 370 N -4.70 0.05 0.28 1.13 -0.02 -1.26 -1.82 135.00 128.66 2vl4 n PRO 370 Ca 0.12 0.29 0.18 0.00 -2.02 0.00 0.00 63.50 62.08 2vl4 n PRO 370 Cb 0.22 -1.60 0.78 0.00 -0.02 0.00 0.00 33.50 32.88 2vl4 n PRO 370 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2vl4 h ASN 371 N 0.00 0.00 -3.23 2.55 2.35 -1.71 -3.43 115.58 112.11 2vl4 h ASN 371 Ca 0.00 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.18 2vl4 h ASN 371 Cb 0.28 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.60 2vl4 h ASN 371 CO 0.00 0.00 0.94 -0.69 -1.65 0.00 0.00 177.43 176.03 2vl4 s VAL 372 N -3.74 4.24 0.61 2.81 1.01 -0.76 -5.00 120.40 119.57 2vl4 s VAL 372 Ca 0.00 1.40 -0.07 0.00 0.00 0.00 0.00 61.98 63.31 2vl4 s VAL 372 Cb 0.10 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 32.23 2vl4 s VAL 372 CO 0.51 -0.52 0.94 0.42 0.00 0.00 0.00 175.10 176.45 2vl4 s THR 373 N 4.20 3.64 0.24 3.92 -4.23 -1.26 -4.91 115.64 117.24 2vl4 s THR 373 Ca 0.53 0.10 -0.05 0.00 -1.18 0.00 0.00 61.69 61.09 2vl4 s THR 373 Cb -0.15 -3.46 0.22 0.00 1.34 0.00 0.00 72.50 70.45 2vl4 s THR 373 CO 0.22 -0.51 1.71 0.74 -0.54 0.00 0.00 174.62 176.24 2vl4 h THR 374 N -0.27 0.60 -0.96 3.99 2.02 -1.98 -1.18 112.91 115.14 2vl4 h THR 374 Ca -0.45 -0.12 0.02 0.00 0.77 0.00 0.00 66.41 66.63 2vl4 h THR 374 Cb 1.25 0.21 -0.05 0.00 -1.74 0.00 0.00 68.15 67.82 2vl4 h THR 374 CO 0.61 0.07 0.63 -0.33 0.37 0.00 0.00 175.52 176.87 2vl4 h GLU 375 N 0.36 1.22 -0.49 6.66 3.07 -1.99 -1.29 114.58 122.12 2vl4 h GLU 375 Ca 0.41 -0.07 -0.06 0.00 -0.50 0.00 0.00 59.36 59.13 2vl4 h GLU 375 Cb 0.65 -0.28 -0.02 0.00 -0.84 0.00 0.00 28.75 28.27 2vl4 h GLU 375 CO -0.44 0.81 0.07 0.00 -1.40 0.00 0.00 179.01 178.04 2vl4 h ARG 376 N 1.26 0.82 -0.16 2.33 3.08 -1.60 -0.94 114.38 119.16 2vl4 h ARG 376 Ca 0.37 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2vl4 h ARG 376 Cb -0.08 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 2vl4 h ARG 376 CO -0.10 0.82 0.11 1.88 -1.07 0.00 0.00 179.97 181.61 2vl4 h TYR 377 N 0.69 0.20 -0.74 3.04 0.05 -0.97 -2.04 116.97 117.20 2vl4 h TYR 377 Ca 0.15 0.01 0.07 0.00 0.05 0.00 0.00 58.73 59.01 2vl4 h TYR 377 Cb 0.41 -0.07 -0.06 0.00 1.01 0.00 0.00 36.73 38.02 2vl4 h TYR 377 CO 0.03 0.12 0.42 1.96 -1.05 0.00 0.00 178.16 179.64 2vl4 h GLN 378 N 0.22 0.72 -0.55 4.88 4.20 -1.08 -1.86 115.11 121.64 2vl4 h GLN 378 Ca 0.06 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 2vl4 h GLN 378 Cb -0.02 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.58 2vl4 h GLN 378 CO -0.02 0.48 0.03 1.15 -0.67 0.00 0.00 178.83 179.80 2vl4 h THR 379 N 0.74 1.26 -0.87 -0.54 2.02 -1.05 -1.09 112.91 113.39 2vl4 h THR 379 Ca 0.34 -1.06 -0.01 0.00 0.77 0.00 0.00 66.41 66.45 2vl4 h THR 379 Cb 0.26 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 2vl4 h THR 379 CO -0.21 0.38 0.50 0.25 0.37 0.00 0.00 175.52 176.81 2vl4 h LEU 380 N 0.82 1.07 -0.77 2.58 5.85 -1.08 0.18 115.31 123.96 2vl4 h LEU 380 Ca 0.16 -0.08 -0.10 0.00 0.84 0.00 0.00 57.88 58.69 2vl4 h LEU 380 Cb 0.49 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 2vl4 h LEU 380 CO 0.02 0.84 -0.19 -0.26 -0.34 0.00 0.00 178.44 178.52 2vl4 h PHE 381 N 1.21 0.81 -0.53 1.25 -1.00 -1.11 -1.80 116.94 115.78 2vl4 h PHE 381 Ca 0.31 -0.17 0.05 0.00 2.81 0.00 0.00 57.97 60.97 2vl4 h PHE 381 Cb -0.01 -0.20 -0.05 0.00 3.61 0.00 0.00 35.95 39.30 2vl4 h PHE 381 CO 0.00 0.86 0.26 -0.09 -1.61 0.00 0.00 178.31 177.74 2vl4 h ARG 382 N 0.65 0.49 -0.65 1.51 2.43 -0.74 0.13 114.38 118.20 2vl4 h ARG 382 Ca 0.10 -0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.33 2vl4 h ARG 382 Cb 0.67 -0.11 -0.07 0.00 -0.42 0.00 0.00 29.97 30.04 2vl4 h ARG 382 CO 0.05 0.33 0.29 -0.44 -1.51 0.00 0.00 179.97 178.69 2vl4 h ASP 383 N 0.51 0.35 -0.18 -3.80 3.32 -0.32 0.35 116.42 116.65 2vl4 h ASP 383 Ca 0.23 0.07 -0.08 0.00 0.02 0.00 0.00 57.03 57.27 2vl4 h ASP 383 Cb 0.15 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.71 2vl4 h ASP 383 CO -0.17 0.20 -0.19 0.24 -1.72 0.00 0.00 179.24 177.60 2vl4 h MET 384 N 0.51 0.45 -0.43 3.56 2.86 -1.06 -2.73 114.93 118.09 2vl4 h MET 384 Ca 0.32 -0.24 0.01 0.00 -2.06 0.00 0.00 59.70 57.73 2vl4 h MET 384 Cb 0.36 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.00 2vl4 h MET 384 CO -0.28 0.82 0.26 -0.22 1.06 0.00 0.00 176.91 178.56 2vl4 h LYS 385 N 0.11 0.52 0.00 1.72 3.64 -0.86 -2.14 116.57 119.55 2vl4 h LYS 385 Ca 0.03 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 2vl4 h LYS 385 Cb 0.74 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 2vl4 h LYS 385 CO 0.05 0.34 -0.27 0.93 -2.27 0.00 0.00 179.45 178.23 2vl4 h GLU 386 N 0.54 0.00 -0.31 1.90 5.08 -0.97 -1.04 114.58 119.78 2vl4 h GLU 386 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2vl4 h GLU 386 Cb -0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2vl4 h GLU 386 CO -0.06 0.27 0.00 0.00 -1.00 0.00 0.00 179.01 178.22 2vl4 n ALA 387 N -2.33 2.54 -1.44 3.43 0.00 -0.95 -4.89 120.51 116.86 2vl4 n ALA 387 Ca -0.01 -0.32 -0.11 0.00 0.00 0.00 0.00 53.44 52.99 2vl4 n ALA 387 Cb 0.38 -0.99 -0.04 0.00 0.00 0.00 0.00 19.45 18.79 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 0.02 -4.26 -4.80 0.00 5.03 -0.39 -4.01 115.26 106.84 2vl4 n ASN 388 Ca 0.06 0.24 -0.34 0.00 0.87 0.00 0.00 54.58 55.41 2vl4 n ASN 388 Cb 0.20 -2.85 -0.03 0.00 -1.02 0.00 0.00 39.78 36.08 2vl4 n ASN 388 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 2vl4 s MET 389 N -3.17 3.77 0.00 3.52 -1.94 -0.85 -4.91 119.30 115.72 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 -2.09 0.00 0.00 2.01 0.00 0.00 34.83 34.75 2vl4 s MET 389 CO 0.00 -0.45 0.42 0.27 -0.01 0.00 0.00 175.02 175.25 2vl4 n ASN 390 N -1.12 0.74 -3.83 3.03 0.23 0.54 -4.72 115.26 110.13 2vl4 n ASN 390 Ca 0.09 -1.15 -0.12 0.00 -0.53 0.00 0.00 54.58 52.87 2vl4 n ASN 390 Cb 0.53 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.12 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 -0.15 0.36 0.00 -3.83 0.00 -1.07 -0.55 119.30 114.06 2vl4 s MET 391 Ca 0.00 -0.06 0.04 0.00 0.00 0.00 0.00 55.69 55.67 2vl4 s MET 391 Cb 0.00 0.16 -0.01 0.00 0.00 0.00 0.00 34.83 34.98 2vl4 s MET 391 CO 0.00 -0.07 -0.13 0.54 0.00 0.00 0.00 175.02 175.35 2vl4 s VAL 392 N -0.64 1.06 -0.25 10.11 0.11 0.48 -3.26 120.40 127.99 2vl4 s VAL 392 Ca -0.07 -0.68 -0.10 0.00 -2.93 0.00 0.00 61.98 58.20 2vl4 s VAL 392 Cb -0.04 -0.90 -0.04 0.00 -1.53 0.00 0.00 36.38 33.86 2vl4 s VAL 392 CO 0.01 0.21 0.14 -0.60 -3.33 0.00 0.00 175.10 171.53 2vl4 s ARG 393 N -0.54 3.91 -0.78 1.54 3.52 -0.70 -0.98 118.95 124.92 2vl4 s ARG 393 Ca 0.04 -0.35 -0.20 0.00 -0.13 0.00 0.00 55.73 55.10 2vl4 s ARG 393 Cb -0.06 -3.51 0.11 0.00 -1.56 0.00 0.00 34.95 29.93 2vl4 s ARG 393 CO -0.00 -0.09 0.99 0.42 -0.81 0.00 0.00 175.30 175.81 2vl4 s ILE 394 N 1.44 4.66 0.43 4.11 1.01 0.47 -0.61 121.20 132.70 2vl4 s ILE 394 Ca 0.07 -1.13 -0.25 0.00 0.00 0.00 0.00 60.65 59.34 2vl4 s ILE 394 Cb -0.15 -4.69 -0.08 0.00 0.01 0.00 0.00 42.46 37.56 2vl4 s ILE 394 CO 0.07 -1.40 1.25 0.86 0.00 0.00 0.00 174.94 175.72 2vl4 s TRP 395 N 3.00 2.81 -1.69 3.97 -0.00 -1.07 -1.97 118.94 123.99 2vl4 s TRP 395 Ca 0.25 1.46 0.00 0.00 -0.00 0.00 0.00 56.10 57.81 2vl4 s TRP 395 Cb -0.12 -3.57 0.00 0.00 -0.00 0.00 0.00 33.47 29.78 2vl4 s TRP 395 CO -0.01 -1.91 0.84 0.41 -0.00 0.00 0.00 176.95 176.28 2vl4 n GLY 396 N 0.62 -0.23 1.13 5.86 0.00 -1.26 -2.56 105.19 108.75 2vl4 n GLY 396 Ca 0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.19 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 0.34 1.64 0.00 -0.02 0.00 -1.26 -1.79 105.19 104.10 2vl4 n GLY 397 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 1.49 0.76 3.12 -0.02 0.00 -1.06 -1.09 105.19 108.39 2vl4 n GLY 398 Ca 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 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 2.83 0.64 0.02 2.61 -4.23 -1.26 -4.18 115.64 112.06 2vl4 s THR 399 Ca 0.00 -1.55 -0.30 0.00 -1.18 0.00 0.00 61.69 58.66 2vl4 s THR 399 Cb 0.00 -1.20 -0.08 0.00 1.34 0.00 0.00 72.50 72.56 2vl4 s THR 399 CO 0.00 -0.65 1.89 -0.31 -0.54 0.00 0.00 174.62 175.02 2vl4 s TYR 400 N -2.60 1.44 0.91 3.99 2.02 -1.26 -4.95 117.35 116.91 2vl4 s TYR 400 Ca 0.02 -0.31 -0.12 0.00 -0.37 0.00 0.00 57.07 56.29 2vl4 s TYR 400 Cb -0.02 -4.17 0.14 0.00 -0.40 0.00 0.00 41.96 37.51 2vl4 s TYR 400 CO -0.02 -5.18 1.11 -1.21 -1.57 0.00 0.00 175.55 168.68 2vl4 s GLU 401 N 4.36 1.15 0.99 -0.62 0.41 -1.26 -4.99 118.70 118.73 2vl4 s GLU 401 Ca 0.85 0.47 -0.12 0.00 -0.41 0.00 0.00 54.97 55.76 2vl4 s GLU 401 Cb -0.40 -1.83 0.18 0.00 -1.78 0.00 0.00 34.13 30.30 2vl4 s GLU 401 CO 0.39 -2.23 1.09 0.54 -0.49 0.00 0.00 175.26 174.56 2vl4 s ASN 402 N -3.80 2.71 0.33 -0.19 4.22 -1.26 -4.89 114.94 112.06 2vl4 s ASN 402 Ca 0.64 1.26 0.04 0.00 -2.14 0.00 0.00 52.86 52.66 2vl4 s ASN 402 Cb -0.16 -1.93 0.56 0.00 1.28 0.00 0.00 41.25 41.01 2vl4 s ASN 402 CO 0.55 -3.09 1.84 0.78 -2.04 0.00 0.00 177.10 175.14 2vl4 h ASN 403 N -1.86 0.47 -0.68 3.54 2.35 -1.99 -2.83 115.58 114.57 2vl4 h ASN 403 Ca -0.54 -0.11 0.04 0.00 -0.55 0.00 0.00 56.30 55.15 2vl4 h ASN 403 Cb 1.32 -0.12 -0.05 0.00 0.05 0.00 0.00 38.32 39.52 2vl4 h ASN 403 CO 0.57 0.59 0.41 0.25 -1.65 0.00 0.00 177.43 177.60 2vl4 h LEU 404 N 0.46 0.65 -0.15 1.61 5.85 -1.99 -1.73 115.31 120.01 2vl4 h LEU 404 Ca 0.09 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.87 2vl4 h LEU 404 Cb 0.42 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.27 2vl4 h LEU 404 CO 0.02 0.44 -0.29 0.15 -0.34 0.00 0.00 178.44 178.42 2vl4 h PHE 405 N 0.78 -0.78 -0.55 1.25 3.57 -1.85 0.23 116.94 119.57 2vl4 h PHE 405 Ca 0.29 0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.74 2vl4 h PHE 405 Cb 0.09 0.37 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 2vl4 h PHE 405 CO -0.06 -0.37 0.03 1.88 -2.23 0.00 0.00 178.31 177.56 2vl4 h TYR 406 N -0.35 0.99 -0.99 0.41 0.05 -1.49 -1.65 116.97 113.93 2vl4 h TYR 406 Ca 0.10 -0.14 0.06 0.00 0.05 0.00 0.00 58.73 58.80 2vl4 h TYR 406 Cb 0.51 -0.27 -0.07 0.00 1.01 0.00 0.00 36.73 37.92 2vl4 h TYR 406 CO -0.39 0.88 0.64 -0.44 -1.05 0.00 0.00 178.16 177.81 2vl4 h ASP 407 N 0.86 1.03 -0.36 3.88 3.32 -1.05 0.12 116.42 124.22 2vl4 h ASP 407 Ca 0.17 0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.13 2vl4 h ASP 407 Cb 0.47 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2vl4 h ASP 407 CO 0.02 0.66 -0.14 -0.07 -1.72 0.00 0.00 179.24 177.99 2vl4 h LEU 408 N 1.17 0.75 -0.90 1.55 3.38 -0.59 -2.27 115.31 118.41 2vl4 h LEU 408 Ca 0.43 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 2vl4 h LEU 408 Cb 0.15 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2vl4 h LEU 408 CO -0.16 0.98 0.54 0.00 0.09 0.00 0.00 178.44 179.89 2vl4 h ALA 409 N 0.80 1.14 -0.03 1.53 0.00 -1.06 -0.71 119.26 120.94 2vl4 h ALA 409 Ca 0.08 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2vl4 h ALA 409 Cb 0.68 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2vl4 h ALA 409 CO 0.05 0.60 -0.10 -0.44 0.00 0.00 0.00 179.25 179.36 2vl4 h ASP 410 N 1.23 -0.28 1.04 0.00 3.32 -0.79 -1.08 116.42 119.87 2vl4 h ASP 410 Ca 0.32 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.42 2vl4 h ASP 410 Cb -0.06 0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2vl4 h ASP 410 CO -0.06 -0.14 -0.04 -1.84 -1.72 0.00 0.00 179.24 175.44 2vl4 n GLU 411 N -5.22 0.05 0.00 3.56 0.28 -0.87 -3.28 120.64 115.15 2vl4 n GLU 411 Ca -0.05 0.04 0.10 0.00 -0.16 0.00 0.00 57.16 57.08 2vl4 n GLU 411 Cb 0.15 -1.55 0.06 0.00 1.43 0.00 0.00 31.44 31.53 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 -1.63 2.46 -1.00 -1.84 3.02 -0.29 -4.81 115.26 111.17 2vl4 n ASN 412 Ca 0.07 -1.73 -0.07 0.00 -0.03 0.00 0.00 54.58 52.82 2vl4 n ASN 412 Cb 0.36 0.11 0.01 0.00 -0.61 0.00 0.00 39.78 39.64 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 1.15 0.22 3.32 7.41 0.00 -0.51 -4.30 105.19 112.48 2vl4 n GLY 413 Ca 0.11 -0.53 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.59 3.54 0.47 -0.61 1.01 -0.58 -0.39 121.20 122.06 2vl4 s ILE 414 Ca 0.06 -0.58 -0.24 0.00 0.00 0.00 0.00 60.65 59.89 2vl4 s ILE 414 Cb -0.03 -2.70 -0.07 0.00 0.01 0.00 0.00 42.46 39.68 2vl4 s ILE 414 CO 0.08 0.30 1.30 -0.76 0.00 0.00 0.00 174.94 175.86 2vl4 s LEU 415 N 1.48 4.03 -0.13 2.97 1.02 0.29 -4.58 118.68 123.75 2vl4 s LEU 415 Ca 0.04 2.64 0.02 0.00 0.02 0.00 0.00 54.13 56.85 2vl4 s LEU 415 Cb -0.15 -4.12 -0.00 0.00 0.02 0.00 0.00 46.19 41.94 2vl4 s LEU 415 CO -0.01 -1.15 -0.19 -0.69 0.02 0.00 0.00 176.35 174.32 2vl4 s VAL 416 N -1.34 2.42 -0.36 -1.59 1.01 0.64 -0.39 120.40 120.79 2vl4 s VAL 416 Ca 0.64 -0.87 -0.12 0.00 0.00 0.00 0.00 61.98 61.63 2vl4 s VAL 416 Cb -0.37 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.04 2vl4 s VAL 416 CO 0.46 0.54 0.22 0.86 0.00 0.00 0.00 175.10 177.17 2vl4 s TRP 417 N 0.55 3.22 -0.39 5.22 -0.11 -0.15 -0.66 118.94 126.62 2vl4 s TRP 417 Ca -0.12 -0.67 -0.11 0.00 1.22 0.00 0.00 56.10 56.42 2vl4 s TRP 417 Cb -0.16 -2.45 0.04 0.00 -1.50 0.00 0.00 33.47 29.39 2vl4 s TRP 417 CO 0.04 -0.54 0.24 -1.14 -4.62 0.00 0.00 176.95 170.92 2vl4 s GLN 418 N 1.62 2.79 0.42 5.86 2.00 -0.30 -0.40 119.66 131.65 2vl4 s GLN 418 Ca 0.04 -1.19 -0.24 0.00 -2.00 0.00 0.00 55.36 51.97 2vl4 s GLN 418 Cb -0.18 -3.79 -0.08 0.00 0.80 0.00 0.00 33.01 29.76 2vl4 s GLN 418 CO 0.08 -0.79 1.13 -0.51 -0.50 0.00 0.00 175.29 174.70 2vl4 s ASP 419 N 1.76 6.50 0.80 6.67 1.11 -0.83 -1.22 116.67 131.46 2vl4 s ASP 419 Ca 0.02 2.24 -0.11 0.00 0.18 0.00 0.00 52.55 54.89 2vl4 s ASP 419 Cb -0.20 -2.60 0.08 0.00 1.07 0.00 0.00 42.92 41.26 2vl4 s ASP 419 CO 0.06 -0.69 1.11 -0.36 1.18 0.00 0.00 175.17 176.47 2vl4 s PHE 420 N -1.52 2.30 -1.35 4.23 0.08 0.52 -4.72 117.98 117.52 2vl4 s PHE 420 Ca 0.59 1.62 -0.09 0.00 0.12 0.00 0.00 56.93 59.17 2vl4 s PHE 420 Cb -0.28 -3.15 0.11 0.00 -0.57 0.00 0.00 43.02 39.14 2vl4 s PHE 420 CO 0.34 -2.09 2.14 -1.33 -0.10 0.00 0.00 175.22 174.17 2vl4 n MET 421 N -3.63 3.69 -4.24 0.44 2.81 -1.26 -4.35 117.12 110.59 2vl4 n MET 421 Ca 0.10 -3.24 -0.21 0.00 -1.81 0.00 0.00 57.70 52.55 2vl4 n MET 421 Cb 0.53 -2.92 -0.16 0.00 -0.71 0.00 0.00 33.22 29.95 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 0.71 0.88 -0.17 2.03 0.08 -0.74 -4.87 117.98 115.91 2vl4 s PHE 422 Ca 0.46 -0.27 -0.06 0.00 0.12 0.00 0.00 56.93 57.18 2vl4 s PHE 422 Cb 0.13 -0.74 0.08 0.00 -0.57 0.00 0.00 43.02 41.92 2vl4 s PHE 422 CO -0.04 -0.21 0.35 0.00 -0.10 0.00 0.00 175.22 175.22 2vl4 s ALA 423 N 0.87 -0.89 0.00 5.36 0.00 -1.25 -1.51 121.76 124.34 2vl4 s ALA 423 Ca -0.12 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.10 2vl4 s ALA 423 Cb -0.15 -1.16 0.00 0.00 0.00 0.00 0.00 23.12 21.81 2vl4 s ALA 423 CO 0.01 -0.67 0.00 0.00 0.00 0.00 0.00 175.76 175.10 2vl4 s THR 425 N -3.27 0.43 0.73 0.00 -1.32 -1.26 -4.86 115.64 106.10 2vl4 s THR 425 Ca 0.00 -0.90 -0.13 0.00 -1.21 0.00 0.00 61.69 59.44 2vl4 s THR 425 Cb 0.00 -0.50 0.04 0.00 -1.51 0.00 0.00 72.50 70.53 2vl4 s THR 425 CO 0.00 -0.33 1.13 -2.16 -2.21 0.00 0.00 174.62 171.05 2vl4 s PRO 426 N -1.32 2.32 0.35 7.08 0.04 -1.26 -4.88 135.00 137.32 2vl4 s PRO 426 Ca -0.09 1.41 0.09 0.00 0.04 0.00 0.00 61.00 62.45 2vl4 s PRO 426 Cb -0.09 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.51 2vl4 s PRO 426 CO 0.00 -1.63 -0.04 0.71 0.04 0.00 0.00 177.00 176.08 2vl4 s TYR 427 N -2.47 2.47 0.87 0.56 2.02 -1.26 -4.85 117.35 114.69 2vl4 s TYR 427 Ca 0.67 -0.48 -0.12 0.00 -0.37 0.00 0.00 57.07 56.77 2vl4 s TYR 427 Cb -0.21 -1.45 0.10 0.00 -0.40 0.00 0.00 41.96 39.99 2vl4 s TYR 427 CO 0.48 0.53 1.01 -2.30 -1.57 0.00 0.00 175.55 173.70 2vl4 n PRO 428 N -0.88 -0.16 -1.28 -1.71 -0.02 -1.26 -4.82 135.00 124.88 2vl4 n PRO 428 Ca -0.05 0.02 0.02 0.00 -2.02 0.00 0.00 63.50 61.48 2vl4 n PRO 428 Cb 0.63 -2.28 0.01 0.00 -0.02 0.00 0.00 33.50 31.84 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 -3.17 0.66 -4.78 2.55 3.41 -1.26 -4.90 113.62 106.12 2vl4 n SER 429 Ca 0.12 -1.98 -0.33 0.00 -0.26 0.00 0.00 58.87 56.41 2vl4 n SER 429 Cb 0.52 -0.23 0.02 0.00 -0.26 0.00 0.00 64.21 64.25 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 -1.72 5.59 0.26 4.04 -4.77 -1.26 -4.78 116.67 114.03 2vl4 s ASP 430 Ca 0.25 1.98 -0.01 0.00 -3.30 0.00 0.00 52.55 51.46 2vl4 s ASP 430 Cb 0.29 -2.55 0.56 0.00 -1.09 0.00 0.00 42.92 40.12 2vl4 s ASP 430 CO -0.13 -1.30 1.71 -0.65 0.70 0.00 0.00 175.17 175.51 2vl4 h PRO 431 N 0.59 0.39 -0.25 2.11 0.11 -1.99 0.29 132.00 133.25 2vl4 h PRO 431 Ca -0.48 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 65.44 2vl4 h PRO 431 Cb 1.24 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 2vl4 h PRO 431 CO 0.56 0.26 -0.51 1.79 -0.21 0.00 0.00 178.00 179.89 2vl4 h THR 432 N 0.40 1.30 -0.40 -1.15 1.35 -1.99 -0.42 112.91 112.00 2vl4 h THR 432 Ca 0.47 -1.72 -0.04 0.00 -0.55 0.00 0.00 66.41 64.57 2vl4 h THR 432 Cb 0.80 1.65 -0.02 0.00 -1.73 0.00 0.00 68.15 68.85 2vl4 h THR 432 CO -0.47 0.55 0.08 0.15 -0.25 0.00 0.00 175.52 175.57 2vl4 h PHE 433 N 0.55 0.68 -0.87 4.73 3.57 -1.80 -2.23 116.94 121.57 2vl4 h PHE 433 Ca 0.02 -0.09 -0.02 0.00 3.53 0.00 0.00 57.97 61.41 2vl4 h PHE 433 Cb 1.07 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.58 2vl4 h PHE 433 CO 0.05 0.67 0.45 -0.07 -2.23 0.00 0.00 178.31 177.18 2vl4 h LEU 434 N 0.50 1.11 -0.53 0.59 3.38 -0.79 -0.04 115.31 119.53 2vl4 h LEU 434 Ca 0.12 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.04 2vl4 h LEU 434 Cb 0.34 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 2vl4 h LEU 434 CO 0.00 0.91 0.24 0.50 0.09 0.00 0.00 178.44 180.18 2vl4 h LYS 435 N 1.23 0.44 -0.42 1.13 1.63 -0.87 -0.03 116.57 119.68 2vl4 h LYS 435 Ca 0.30 -0.03 0.03 0.00 -0.85 0.00 0.00 60.65 60.11 2vl4 h LYS 435 Cb 0.07 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 31.57 2vl4 h LYS 435 CO -0.04 0.29 0.22 0.00 -3.45 0.00 0.00 179.45 176.47 2vl4 h ARG 436 N 0.45 0.43 -0.85 1.90 3.08 -0.83 -2.56 114.38 115.99 2vl4 h ARG 436 Ca 0.25 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.26 2vl4 h ARG 436 Cb 0.21 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.13 2vl4 h ARG 436 CO -0.21 0.28 0.48 0.28 -1.07 0.00 0.00 179.97 179.74 2vl4 h VAL 437 N 0.44 1.24 -0.21 2.04 2.07 -0.57 -2.57 116.25 118.70 2vl4 h VAL 437 Ca 0.18 -0.58 0.04 0.00 0.82 0.00 0.00 66.70 67.16 2vl4 h VAL 437 Cb 0.07 0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 29.88 2vl4 h VAL 437 CO -0.12 0.27 -0.04 -0.08 0.02 0.00 0.00 177.57 177.62 2vl4 h GLU 438 N 1.19 0.01 -0.58 1.57 4.81 -0.74 0.84 114.58 121.68 2vl4 h GLU 438 Ca 0.30 -0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.64 2vl4 h GLU 438 Cb 0.00 -0.00 -0.08 0.00 0.63 0.00 0.00 28.75 29.30 2vl4 h GLU 438 CO -0.05 0.01 0.13 0.00 -0.73 0.00 0.00 179.01 178.37 2vl4 h ALA 439 N 1.20 0.69 -0.42 2.92 0.00 -1.24 -0.17 119.26 122.24 2vl4 h ALA 439 Ca 0.10 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 2vl4 h ALA 439 Cb 0.15 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2vl4 h ALA 439 CO -0.20 -0.30 0.03 1.49 0.00 0.00 0.00 179.25 180.27 2vl4 h GLU 440 N 0.27 0.73 0.05 0.00 4.81 -1.04 -0.61 114.58 118.79 2vl4 h GLU 440 Ca 0.30 -0.22 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2vl4 h GLU 440 Cb 0.44 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.74 2vl4 h GLU 440 CO -0.38 0.79 -0.03 0.00 -0.73 0.00 0.00 179.01 178.66 2vl4 h ALA 441 N 0.91 -0.07 -0.31 2.92 0.00 -0.50 -1.14 119.26 121.07 2vl4 h ALA 441 Ca 0.12 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2vl4 h ALA 441 Cb 0.44 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2vl4 h ALA 441 CO 0.02 -0.45 0.17 0.28 0.00 0.00 0.00 179.25 179.27 2vl4 h VAL 442 N -0.25 1.02 0.26 0.00 2.07 -0.98 0.02 116.25 118.38 2vl4 h VAL 442 Ca -0.01 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 2vl4 h VAL 442 Cb 0.22 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 2vl4 h VAL 442 CO 0.01 0.07 -0.17 0.22 0.02 0.00 0.00 177.57 177.72 2vl4 h TYR 443 N 0.36 -0.44 -0.00 1.57 3.20 -1.02 -1.32 116.97 119.32 2vl4 h TYR 443 Ca 0.13 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.86 2vl4 h TYR 443 Cb 0.01 0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 2vl4 h TYR 443 CO -0.08 -0.26 -0.63 -0.91 -1.64 0.00 0.00 178.16 174.63 2vl4 h ASN 444 N -0.42 0.01 0.08 -2.11 2.35 -1.08 -0.17 115.58 114.24 2vl4 h ASN 444 Ca -0.02 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2vl4 h ASN 444 Cb 0.35 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 2vl4 h ASN 444 CO 0.02 0.64 -0.04 0.40 -1.65 0.00 0.00 177.43 176.80 2vl4 h ILE 445 N 0.01 1.02 -0.46 2.81 2.04 -0.89 -0.39 117.51 121.66 2vl4 h ILE 445 Ca -0.01 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 2vl4 h ILE 445 Cb 1.12 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 38.44 2vl4 h ILE 445 CO 0.08 0.09 0.16 0.03 0.00 0.00 0.00 178.15 178.51 2vl4 h ARG 446 N -0.27 0.66 -0.40 2.37 3.08 -1.13 -0.25 114.38 118.44 2vl4 h ARG 446 Ca -0.01 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 59.87 2vl4 h ARG 446 Cb 0.23 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 2vl4 h ARG 446 CO 0.02 0.57 -0.03 -0.09 -1.07 0.00 0.00 179.97 179.37 2vl4 h ARG 447 N 0.66 0.66 0.00 0.04 2.43 -0.74 -3.34 114.38 114.09 2vl4 h ARG 447 Ca 0.16 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2vl4 h ARG 447 Cb 0.18 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 2vl4 h ARG 447 CO -0.01 0.70 -1.35 1.28 -1.51 0.00 0.00 179.97 179.08 2vl4 n LEU 448 N -4.23 0.41 0.00 3.80 4.77 -0.18 -4.64 117.00 116.93 2vl4 n LEU 448 Ca 0.02 -0.24 0.08 0.00 -0.03 0.00 0.00 56.01 55.83 2vl4 n LEU 448 Cb 0.29 0.00 0.37 0.00 -2.33 0.00 0.00 43.42 41.75 2vl4 n LEU 448 CO 0.41 0.10 0.73 -2.11 -1.33 0.00 0.00 177.39 175.19 2vl4 n ARG 449 N -1.79 0.13 0.00 3.23 1.85 -0.15 -1.81 116.66 118.11 2vl4 n ARG 449 Ca -0.00 0.18 0.13 0.00 -1.00 0.00 0.00 57.85 57.16 2vl4 n ARG 449 Cb 0.38 -1.50 0.39 0.00 -1.05 0.00 0.00 32.46 30.68 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 -1.38 1.73 -4.68 2.89 3.02 -1.26 -4.93 115.26 110.65 2vl4 n ASN 450 Ca 0.06 -1.49 -0.43 0.00 -0.03 0.00 0.00 54.58 52.69 2vl4 n ASN 450 Cb 0.15 0.05 -0.02 0.00 -0.61 0.00 0.00 39.78 39.34 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 -2.11 3.44 0.34 3.10 3.76 -0.75 -4.70 115.29 118.37 2vl4 s HIS 451 Ca 0.33 1.53 0.11 0.00 -0.15 0.00 0.00 55.06 56.87 2vl4 s HIS 451 Cb 0.20 -3.21 0.90 0.00 1.11 0.00 0.00 32.58 31.58 2vl4 s HIS 451 CO 0.37 -0.33 1.78 0.00 -0.85 0.00 0.00 174.74 175.72 2vl4 h ALA 452 N 7.25 1.90 0.00 -1.40 0.00 -1.86 -2.01 119.26 123.14 2vl4 h ALA 452 Ca -0.26 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 2vl4 h ALA 452 Cb 1.11 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2vl4 h ALA 452 CO 0.90 -0.28 -0.26 0.66 0.00 0.00 0.00 179.25 180.27 2vl4 h SER 453 N 0.60 0.00 -2.57 0.00 4.64 -1.87 -3.44 113.55 110.91 2vl4 h SER 453 Ca 0.58 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 61.34 2vl4 h SER 453 Cb 1.13 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 2vl4 h SER 453 CO -0.35 0.26 1.19 -0.22 -0.87 0.00 0.00 176.83 176.85 2vl4 s LEU 454 N -7.09 4.00 -0.11 5.97 2.96 -0.76 -0.26 118.68 123.38 2vl4 s LEU 454 Ca -0.01 1.94 0.12 0.00 -0.22 0.00 0.00 54.13 55.97 2vl4 s LEU 454 Cb 0.11 -3.53 -0.17 0.00 0.50 0.00 0.00 46.19 43.10 2vl4 s LEU 454 CO 0.65 -1.26 0.09 0.00 -1.32 0.00 0.00 176.35 174.51 2vl4 n ALA 455 N 8.51 1.82 -3.57 5.97 0.00 0.17 -4.88 120.51 128.53 2vl4 n ALA 455 Ca 0.20 -0.78 -0.05 0.00 0.00 0.00 0.00 53.44 52.80 2vl4 n ALA 455 Cb 0.44 -0.11 -0.02 0.00 0.00 0.00 0.00 19.45 19.76 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 -2.43 0.53 0.12 0.00 0.23 -1.20 -4.33 119.30 112.22 2vl4 s MET 456 Ca -0.06 -0.21 0.08 0.00 -1.03 0.00 0.00 55.69 54.47 2vl4 s MET 456 Cb 0.05 0.23 -0.04 0.00 -1.53 0.00 0.00 34.83 33.54 2vl4 s MET 456 CO 0.55 -0.23 -0.12 -1.58 -2.03 0.00 0.00 175.02 171.61 2vl4 s TRP 457 N -2.70 2.66 -0.05 3.16 0.52 -0.16 -1.15 118.94 121.23 2vl4 s TRP 457 Ca 0.08 -0.20 0.00 0.00 0.02 0.00 0.00 56.10 56.01 2vl4 s TRP 457 Cb -0.01 -1.38 0.02 0.00 -1.15 0.00 0.00 33.47 30.96 2vl4 s TRP 457 CO -0.06 0.43 -0.03 0.00 0.02 0.00 0.00 176.95 177.32 2vl4 h GLY 459 N 7.50 1.36 -2.42 0.00 0.00 -0.29 0.15 103.07 109.37 2vl4 h GLY 459 Ca -0.34 -0.29 0.15 0.00 0.00 0.00 0.00 47.33 46.85 2vl4 h GLY 459 CO 0.42 0.05 0.45 0.54 0.00 0.00 0.00 176.54 177.99 2vl4 s ASN 460 N -5.52 -0.21 -0.33 0.19 2.20 -1.13 -4.08 114.94 106.05 2vl4 s ASN 460 Ca -0.12 -0.38 -0.14 0.00 -0.94 0.00 0.00 52.86 51.28 2vl4 s ASN 460 Cb 0.21 0.51 -0.02 0.00 -2.00 0.00 0.00 41.25 39.95 2vl4 s ASN 460 CO 0.78 -0.93 0.29 0.21 -2.94 0.00 0.00 177.10 174.52 2vl4 s ASN 461 N -2.89 6.11 -1.06 3.54 2.47 -0.57 -1.80 114.94 120.74 2vl4 s ASN 461 Ca 0.11 -0.28 0.00 0.00 0.42 0.00 0.00 52.86 53.11 2vl4 s ASN 461 Cb -0.02 -2.16 0.00 0.00 -1.45 0.00 0.00 41.25 37.62 2vl4 s ASN 461 CO 0.01 -0.26 0.00 -0.62 -3.72 0.00 0.00 177.10 172.51 2vl4 n GLU 462 N 5.23 -1.23 -0.02 0.43 1.02 0.28 -0.72 120.64 125.63 2vl4 n GLU 462 Ca -0.11 0.81 -0.16 0.00 -0.02 0.00 0.00 57.16 57.68 2vl4 n GLU 462 Cb 0.50 -4.95 -0.12 0.00 -0.02 0.00 0.00 31.44 26.85 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 1.52 -0.71 -3.67 2.04 -1.85 -0.16 117.51 114.68 2vl4 h ILE 463 Ca -0.21 -2.03 -0.02 0.00 1.00 0.00 0.00 64.86 63.60 2vl4 h ILE 463 Cb 0.92 2.77 -0.03 0.00 -0.74 0.00 0.00 36.82 39.74 2vl4 h ILE 463 CO 0.30 0.57 0.36 0.25 0.00 0.00 0.00 178.15 179.63 2vl4 h LEU 464 N -0.41 0.91 -0.56 1.44 5.85 -1.90 0.01 115.31 120.65 2vl4 h LEU 464 Ca -0.05 -0.12 0.10 0.00 0.84 0.00 0.00 57.88 58.66 2vl4 h LEU 464 Cb 1.12 -0.23 -0.08 0.00 0.37 0.00 0.00 40.66 41.84 2vl4 h LEU 464 CO 0.07 0.77 0.10 -0.08 -0.34 0.00 0.00 178.44 178.96 2vl4 h GLU 465 N 0.99 0.22 -0.30 1.25 4.81 -1.81 0.24 114.58 119.97 2vl4 h GLU 465 Ca 0.25 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 2vl4 h GLU 465 Cb 0.08 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2vl4 h GLU 465 CO -0.03 0.15 0.19 0.00 -0.73 0.00 0.00 179.01 178.58 2vl4 h ALA 466 N 1.46 0.39 -0.84 2.92 0.00 -0.48 0.22 119.26 122.92 2vl4 h ALA 466 Ca 0.29 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.20 2vl4 h ALA 466 Cb 0.43 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 2vl4 h ALA 466 CO -0.39 -0.13 0.55 -0.07 0.00 0.00 0.00 179.25 179.21 2vl4 h LEU 467 N 0.40 0.89 0.10 0.00 3.38 -0.64 -2.44 115.31 117.00 2vl4 h LEU 467 Ca 0.11 -0.01 -0.32 0.00 0.09 0.00 0.00 57.88 57.75 2vl4 h LEU 467 Cb -0.01 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 2vl4 h LEU 467 CO -0.02 0.60 -1.71 0.11 0.09 0.00 0.00 178.44 177.51 2vl4 h LYS 468 N 1.03 0.22 0.00 1.13 1.57 -0.76 -3.44 116.57 116.32 2vl4 h LYS 468 Ca 0.34 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2vl4 h LYS 468 Cb 0.06 0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.51 2vl4 h LYS 468 CO -0.10 1.05 0.00 0.66 -0.57 0.00 0.00 179.45 180.48 2vl4 n TYR 469 N -3.40 0.00 -0.47 -1.35 4.01 0.76 -4.74 117.16 111.97 2vl4 n TYR 469 Ca -0.21 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.63 2vl4 n TYR 469 Cb 1.05 0.00 0.34 0.00 -0.31 0.00 0.00 39.34 40.42 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 -0.74 1.28 -2.24 -0.72 8.01 -0.92 -4.94 117.44 117.17 2vl4 n TRP 470 Ca 0.00 -0.55 0.00 0.00 -1.31 0.00 0.00 57.50 55.64 2vl4 n TRP 470 Cb 0.00 -0.14 0.00 0.00 -2.01 0.00 0.00 31.31 29.16 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 1.36 0.74 0.32 6.99 0.00 -1.26 -4.97 105.19 108.36 2vl4 n GLY 471 Ca 0.25 -0.75 0.14 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.84 -3.25 116.94 113.49 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 0.98 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.13 2vl4 h PHE 472 CO 0.00 0.00 -0.61 -1.91 -0.60 0.00 0.00 178.31 175.19 2vl4 n GLU 473 N -4.33 2.42 0.26 1.51 2.13 -1.26 -0.10 120.64 121.27 2vl4 n GLU 473 Ca 0.02 0.00 0.17 0.00 0.66 0.00 0.00 57.16 58.01 2vl4 n GLU 473 Cb 0.31 -0.80 0.65 0.00 0.27 0.00 0.00 31.44 31.87 2vl4 n GLU 473 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 2vl4 h LYS 474 N 0.00 0.00 0.00 5.31 6.56 -1.99 -3.34 116.57 123.12 2vl4 h LYS 474 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2vl4 h LYS 474 Cb 0.60 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.26 2vl4 h LYS 474 CO 0.00 0.00 -0.67 1.63 -2.06 0.00 0.00 179.45 178.35 2vl4 n LYS 475 N -2.98 0.09 -4.08 3.15 5.02 0.86 -4.96 118.16 115.27 2vl4 n LYS 475 Ca 0.01 0.01 -0.08 0.00 -2.02 0.00 0.00 58.31 56.23 2vl4 n LYS 475 Cb 0.30 -1.54 -0.10 0.00 -0.02 0.00 0.00 35.03 33.67 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 -3.06 0.52 0.80 2.13 0.08 -1.15 -5.05 117.98 112.24 2vl4 s PHE 476 Ca 0.09 -0.96 -0.13 0.00 0.12 0.00 0.00 56.93 56.04 2vl4 s PHE 476 Cb 0.16 -0.37 0.08 0.00 -0.57 0.00 0.00 43.02 42.32 2vl4 s PHE 476 CO 0.74 -0.32 1.20 0.95 -0.10 0.00 0.00 175.22 177.68 2vl4 s THR 477 N -3.48 2.16 0.31 0.64 -4.23 -1.26 -4.76 115.64 105.02 2vl4 s THR 477 Ca 0.04 0.07 0.01 0.00 -1.18 0.00 0.00 61.69 60.62 2vl4 s THR 477 Cb 0.05 -2.48 0.28 0.00 1.34 0.00 0.00 72.50 71.69 2vl4 s THR 477 CO -0.08 -0.05 1.94 -0.65 -0.54 0.00 0.00 174.62 175.24 2vl4 h PRO 478 N -0.86 0.97 -0.22 3.99 0.11 -2.00 -1.53 132.00 132.47 2vl4 h PRO 478 Ca -0.46 -0.06 -0.20 0.00 0.11 0.00 0.00 66.00 65.39 2vl4 h PRO 478 Cb 1.29 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2vl4 h PRO 478 CO 0.47 0.64 -0.65 1.05 -0.21 0.00 0.00 178.00 179.29 2vl4 h GLU 479 N 1.00 0.79 -0.49 1.05 9.09 -1.99 -1.45 114.58 122.58 2vl4 h GLU 479 Ca 0.34 -0.57 0.07 0.00 0.05 0.00 0.00 59.36 59.25 2vl4 h GLU 479 Cb 0.10 0.09 -0.06 0.00 -1.65 0.00 0.00 28.75 27.24 2vl4 h GLU 479 CO -0.11 1.19 0.17 0.28 0.05 0.00 0.00 179.01 180.58 2vl4 h VAL 480 N 0.58 0.83 -0.51 -1.06 2.07 -1.88 -1.19 116.25 115.08 2vl4 h VAL 480 Ca -0.02 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.34 2vl4 h VAL 480 Cb 1.26 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 2vl4 h VAL 480 CO 0.14 0.06 0.14 0.22 0.02 0.00 0.00 177.57 178.15 2vl4 h TYR 481 N 0.34 0.84 -0.19 1.57 3.20 -1.20 -0.99 116.97 120.53 2vl4 h TYR 481 Ca 0.23 -0.09 -0.04 0.00 3.14 0.00 0.00 58.73 61.97 2vl4 h TYR 481 Cb 0.25 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 2vl4 h TYR 481 CO -0.17 0.73 -0.05 1.96 -1.64 0.00 0.00 178.16 178.99 2vl4 h GLN 482 N 0.70 0.28 -0.24 1.82 1.08 -1.12 -1.34 115.11 116.29 2vl4 h GLN 482 Ca 0.16 -0.05 0.01 0.00 -1.45 0.00 0.00 58.65 57.32 2vl4 h GLN 482 Cb 0.30 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.67 2vl4 h GLN 482 CO -0.00 0.36 0.14 0.78 -0.95 0.00 0.00 178.83 179.15 2vl4 h GLY 483 N 0.66 0.33 0.91 3.46 0.00 -0.74 -1.53 103.07 106.16 2vl4 h GLY 483 Ca 0.06 -0.10 0.02 0.00 0.00 0.00 0.00 47.33 47.31 2vl4 h GLY 483 CO 0.01 0.09 0.24 1.41 0.00 0.00 0.00 176.54 178.29 2vl4 h LEU 484 N 0.28 0.39 -0.15 3.11 3.38 -0.35 -1.12 115.31 120.86 2vl4 h LEU 484 Ca 0.10 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.10 2vl4 h LEU 484 Cb 0.00 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2vl4 h LEU 484 CO -0.05 0.28 -0.04 0.24 0.09 0.00 0.00 178.44 178.97 2vl4 h MET 485 N 0.49 0.00 -0.51 1.13 2.86 -1.20 -1.09 114.93 116.61 2vl4 h MET 485 Ca 0.16 -0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.69 2vl4 h MET 485 Cb 0.01 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 2vl4 h MET 485 CO -0.07 0.00 -0.14 0.45 1.06 0.00 0.00 176.91 178.21 2vl4 h HIS 486 N 0.00 1.10 -0.36 -0.22 3.86 -1.17 -2.78 115.15 115.58 2vl4 h HIS 486 Ca 0.07 -0.23 -0.04 0.00 -1.16 0.00 0.00 60.37 59.01 2vl4 h HIS 486 Cb 0.11 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.29 2vl4 h HIS 486 CO -0.18 1.04 0.05 0.78 0.86 0.00 0.00 177.93 180.48 2vl4 h GLY 487 N 0.93 0.59 0.36 2.45 0.00 -1.06 -2.01 103.07 104.34 2vl4 h GLY 487 Ca 0.13 -0.32 0.05 0.00 0.00 0.00 0.00 47.33 47.19 2vl4 h GLY 487 CO 0.05 0.30 -0.17 -1.82 0.00 0.00 0.00 176.54 174.91 2vl4 h TYR 488 N 0.53 -0.42 -0.72 5.60 3.20 -0.92 -1.96 116.97 122.27 2vl4 h TYR 488 Ca 0.12 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 2vl4 h TYR 488 Cb 0.26 0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.72 2vl4 h TYR 488 CO 0.01 -0.24 0.38 -0.44 -1.64 0.00 0.00 178.16 176.23 2vl4 h ASP 489 N -0.18 0.91 -0.85 -2.11 3.32 -1.33 0.19 116.42 116.36 2vl4 h ASP 489 Ca 0.11 -0.11 0.07 0.00 0.02 0.00 0.00 57.03 57.12 2vl4 h ASP 489 Cb 0.35 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 39.61 2vl4 h ASP 489 CO -0.29 0.76 0.53 0.11 -1.72 0.00 0.00 179.24 178.62 2vl4 h LYS 490 N 0.99 0.92 0.00 3.56 1.57 -0.82 -1.00 116.57 121.80 2vl4 h LYS 490 Ca 0.25 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.87 2vl4 h LYS 490 Cb 0.06 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 2vl4 h LYS 490 CO -0.04 0.61 -0.70 1.25 -0.57 0.00 0.00 179.45 180.00 2vl4 h LEU 491 N 0.95 0.00 0.00 2.94 5.85 -1.07 -2.20 115.31 121.78 2vl4 h LEU 491 Ca 0.38 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2vl4 h LEU 491 Cb 0.20 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.23 2vl4 h LEU 491 CO -0.18 1.09 -1.38 0.49 -0.34 0.00 0.00 178.44 178.12 2vl4 n PHE 492 N -4.55 0.22 0.77 1.25 3.72 0.63 -1.48 117.46 118.02 2vl4 n PHE 492 Ca -0.18 0.06 0.09 0.00 -0.05 0.00 0.00 57.45 57.37 2vl4 n PHE 492 Cb 0.45 -0.46 0.04 0.00 -0.94 0.00 0.00 39.48 38.57 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 -2.09 1.57 0.05 -1.08 1.74 -0.45 -4.51 116.66 111.89 2vl4 n ARG 493 Ca -0.00 -1.28 0.00 0.00 -0.77 0.00 0.00 57.85 55.80 2vl4 n ARG 493 Cb 0.48 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.59 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 0.55 0.00 0.44 5.56 1.02 -0.79 -4.80 120.64 122.62 2vl4 n GLU 494 Ca 0.09 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 57.06 2vl4 n GLU 494 Cb 0.42 -0.09 -0.08 0.00 -0.02 0.00 0.00 31.44 31.67 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 -0.96 0.05 -4.62 5.85 -1.33 -2.38 115.31 111.93 2vl4 h LEU 495 Ca 0.00 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.76 2vl4 h LEU 495 Cb 0.00 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 2vl4 h LEU 495 CO 0.00 -0.62 -0.11 -0.07 -0.34 0.00 0.00 178.44 177.30 2vl4 h LEU 496 N -1.28 -0.31 -1.31 2.25 3.38 -1.53 -1.16 115.31 115.35 2vl4 h LEU 496 Ca -0.12 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 2vl4 h LEU 496 Cb 0.87 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 2vl4 h LEU 496 CO 0.19 -0.17 0.40 1.55 0.09 0.00 0.00 178.44 180.51 2vl4 h PRO 497 N -0.22 0.86 0.00 1.13 0.13 -1.79 -1.14 132.00 130.97 2vl4 h PRO 497 Ca 0.02 -0.07 -0.10 0.00 -0.87 0.00 0.00 66.00 64.99 2vl4 h PRO 497 Cb 0.24 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 31.17 2vl4 h PRO 497 CO -0.07 0.60 -0.46 0.66 -0.23 0.00 0.00 178.00 178.49 2vl4 h SER 498 N 0.88 0.00 -0.27 1.44 4.64 -1.19 -0.48 113.55 118.57 2vl4 h SER 498 Ca 0.23 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.40 2vl4 h SER 498 Cb -0.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2vl4 h SER 498 CO -0.05 0.46 -0.41 0.74 -0.87 0.00 0.00 176.83 176.70 2vl4 h THR 499 N 0.00 1.30 -0.80 2.95 2.02 -0.66 -1.28 112.91 116.44 2vl4 h THR 499 Ca -0.00 -1.61 -0.04 0.00 0.77 0.00 0.00 66.41 65.52 2vl4 h THR 499 Cb 0.91 1.66 -0.04 0.00 -1.74 0.00 0.00 68.15 68.95 2vl4 h THR 499 CO 0.06 0.52 0.33 0.58 0.37 0.00 0.00 175.52 177.37 2vl4 h VAL 500 N 0.51 1.26 -0.61 3.16 2.07 -1.05 -0.60 116.25 120.99 2vl4 h VAL 500 Ca 0.03 -0.81 -0.07 0.00 0.82 0.00 0.00 66.70 66.66 2vl4 h VAL 500 Cb 1.01 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 2vl4 h VAL 500 CO 0.10 0.33 0.08 0.50 0.02 0.00 0.00 177.57 178.60 2vl4 h LYS 501 N 1.16 1.00 -0.18 1.57 1.63 -0.96 0.45 116.57 121.23 2vl4 h LYS 501 Ca 0.27 -0.26 -0.06 0.00 -0.85 0.00 0.00 60.65 59.75 2vl4 h LYS 501 Cb 0.20 -0.12 -0.00 0.00 -0.60 0.00 0.00 32.23 31.71 2vl4 h LYS 501 CO -0.02 0.93 -0.13 1.49 -3.45 0.00 0.00 179.45 178.26 2vl4 h GLU 502 N 0.93 0.41 0.00 1.90 4.81 -0.88 -3.29 114.58 118.46 2vl4 h GLU 502 Ca 0.19 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2vl4 h GLU 502 Cb 0.43 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.81 2vl4 h GLU 502 CO 0.01 0.74 -0.97 1.19 -0.73 0.00 0.00 179.01 179.25 2vl4 n PHE 503 N -4.54 0.00 -2.90 0.92 3.72 -0.26 -4.64 117.46 109.75 2vl4 n PHE 503 Ca -0.05 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.22 2vl4 n PHE 503 Cb 0.35 -0.10 0.03 0.00 -0.94 0.00 0.00 39.48 38.82 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 -1.54 0.02 0.29 4.37 -0.08 0.15 -4.89 116.55 114.87 2vl4 n ASP 504 Ca 0.01 -3.01 0.15 0.00 -1.51 0.00 0.00 54.79 50.43 2vl4 n ASP 504 Cb 0.27 0.11 0.87 0.00 2.34 0.00 0.00 41.12 44.72 2vl4 n ASP 504 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2vl4 h SER 505 N 2.88 0.00 -0.49 1.67 0.02 -1.60 -0.44 113.55 115.60 2vl4 h SER 505 Ca -0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2vl4 h SER 505 Cb 1.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.63 2vl4 h SER 505 CO 0.36 0.03 0.00 0.47 -1.14 0.00 0.00 176.83 176.55 2vl4 n ASP 506 N -3.79 3.21 -4.75 3.07 8.00 -1.26 -4.92 116.55 116.10 2vl4 n ASP 506 Ca -0.03 -1.96 -0.35 0.00 0.71 0.00 0.00 54.79 53.16 2vl4 n ASP 506 Cb 0.12 -0.32 -0.08 0.00 -0.02 0.00 0.00 41.12 40.82 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 -1.36 3.11 0.39 -1.24 0.52 -0.17 -5.00 118.95 115.19 2vl4 s ARG 507 Ca 0.40 -0.36 -0.27 0.00 -0.52 0.00 0.00 55.73 54.98 2vl4 s ARG 507 Cb 0.22 -2.90 -0.09 0.00 0.52 0.00 0.00 34.95 32.69 2vl4 s ARG 507 CO 0.30 0.71 1.32 0.12 0.02 0.00 0.00 175.30 177.76 2vl4 s PHE 508 N -0.99 2.85 -0.02 -0.53 5.36 -1.26 -4.89 117.98 118.50 2vl4 s PHE 508 Ca 0.16 1.40 0.06 0.00 -0.96 0.00 0.00 56.93 57.58 2vl4 s PHE 508 Cb -0.12 -3.69 -0.01 0.00 -0.34 0.00 0.00 43.02 38.86 2vl4 s PHE 508 CO 0.05 -2.10 -0.19 -0.47 -1.46 0.00 0.00 175.22 171.06 2vl4 s TYR 509 N -1.23 1.71 0.04 10.12 5.04 -1.26 -0.99 117.35 130.78 2vl4 s TYR 509 Ca 0.55 -0.34 0.05 0.00 -2.44 0.00 0.00 57.07 54.89 2vl4 s TYR 509 Cb -0.39 -1.10 -0.02 0.00 0.35 0.00 0.00 41.96 40.80 2vl4 s TYR 509 CO 0.51 -0.04 -0.15 0.54 -1.34 0.00 0.00 175.55 175.06 2vl4 s VAL 510 N -0.41 1.21 0.23 3.14 0.11 -0.76 -5.00 120.40 118.92 2vl4 s VAL 510 Ca 0.06 -1.03 0.23 0.00 -2.93 0.00 0.00 61.98 58.31 2vl4 s VAL 510 Cb -0.08 -1.08 0.21 0.00 -1.53 0.00 0.00 36.38 33.90 2vl4 s VAL 510 CO -0.00 0.04 1.86 1.12 -3.33 0.00 0.00 175.10 174.79 2vl4 h HIS 511 N 4.92 0.00 -2.44 1.54 2.07 -1.89 0.32 115.15 119.67 2vl4 h HIS 511 Ca -0.39 0.00 0.06 0.00 -2.85 0.00 0.00 60.37 57.19 2vl4 h HIS 511 Cb 1.18 0.00 -0.15 0.00 2.57 0.00 0.00 27.41 31.01 2vl4 h HIS 511 CO 0.53 0.25 0.39 0.45 -3.07 0.00 0.00 177.93 176.48 2vl4 s SER 512 N -6.30 -0.44 -0.10 3.10 0.15 -1.26 -2.84 113.70 106.00 2vl4 s SER 512 Ca -0.01 0.07 0.01 0.00 0.70 0.00 0.00 55.95 56.72 2vl4 s SER 512 Cb 0.11 0.45 0.02 0.00 -1.71 0.00 0.00 66.02 64.90 2vl4 s SER 512 CO 0.64 -0.71 -0.10 -0.55 1.20 0.00 0.00 173.24 173.72 2vl4 s SER 513 N -2.40 2.13 0.22 5.45 0.15 -0.75 -2.66 113.70 115.83 2vl4 s SER 513 Ca 0.02 -0.33 -0.30 0.00 0.70 0.00 0.00 55.95 56.05 2vl4 s SER 513 Cb -0.01 -0.89 -0.08 0.00 -1.71 0.00 0.00 66.02 63.33 2vl4 s SER 513 CO -0.08 -0.06 1.09 -2.16 1.20 0.00 0.00 173.24 173.23 2vl4 s PRO 514 N 1.31 4.63 0.27 5.44 0.04 -1.26 -0.56 135.00 144.87 2vl4 s PRO 514 Ca -0.02 1.73 0.11 0.00 0.04 0.00 0.00 61.00 62.86 2vl4 s PRO 514 Cb -0.14 -3.25 0.33 0.00 0.04 0.00 0.00 34.50 31.49 2vl4 s PRO 514 CO -0.04 0.15 1.59 0.10 0.04 0.00 0.00 177.00 178.84 2vl4 h TYR 515 N 4.60 0.00 0.00 0.56 -0.00 -1.70 -3.43 116.97 117.00 2vl4 h TYR 515 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.28 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 0.61 0.63 0.00 -0.11 -0.00 0.00 0.00 178.16 179.29 2vl4 n LEU 516 N -3.72 0.00 -4.73 0.10 7.94 -1.26 -4.94 117.00 110.39 2vl4 n LEU 516 Ca -0.01 0.00 -0.40 0.00 -1.11 0.00 0.00 56.01 54.49 2vl4 n LEU 516 Cb 0.64 0.00 0.02 0.00 0.53 0.00 0.00 43.42 44.61 2vl4 n LEU 516 CO 0.42 -0.09 0.96 0.00 -1.11 0.00 0.00 177.39 177.56 2vl4 n ALA 517 N -1.69 1.59 -2.80 1.96 0.00 -1.24 -5.03 120.51 113.30 2vl4 n ALA 517 Ca 0.00 0.25 -0.15 0.00 0.00 0.00 0.00 53.44 53.55 2vl4 n ALA 517 Cb 0.00 -2.32 -0.14 0.00 0.00 0.00 0.00 19.45 16.99 2vl4 n ALA 517 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2vl4 s ASN 518 N -0.52 0.53 0.33 0.00 3.84 -1.26 -4.75 114.94 113.10 2vl4 s ASN 518 Ca 0.61 -0.16 0.26 0.00 0.21 0.00 0.00 52.86 53.79 2vl4 s ASN 518 Cb -0.48 -0.04 1.07 0.00 -0.55 0.00 0.00 41.25 41.25 2vl4 s ASN 518 CO 0.57 0.00 1.79 4.11 -2.79 0.00 0.00 177.10 180.78 2vl4 h TRP 519 N 5.78 0.00 -0.02 0.43 5.08 -1.96 -1.37 115.95 123.89 2vl4 h TRP 519 Ca -0.28 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.69 2vl4 h TRP 519 Cb 1.20 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.36 2vl4 h TRP 519 CO 0.45 0.00 -0.12 0.41 -1.28 0.00 0.00 178.44 177.90 2vl4 n GLY 520 N 0.08 0.10 2.94 11.11 0.00 -1.26 -4.65 105.19 113.52 2vl4 n GLY 520 Ca 0.02 -0.52 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.17 2.14 0.58 1.61 1.81 -0.52 -4.97 118.95 117.42 2vl4 s ARG 521 Ca 0.30 -2.81 0.27 0.00 -1.72 0.00 0.00 55.73 51.77 2vl4 s ARG 521 Cb 0.20 -3.37 1.72 0.00 -0.45 0.00 0.00 34.95 33.06 2vl4 s ARG 521 CO 0.40 -1.16 2.24 -1.35 -0.68 0.00 0.00 175.30 174.75 2vl4 h PRO 522 N 6.23 0.00 0.00 3.54 0.11 -1.82 -0.43 132.00 139.63 2vl4 h PRO 522 Ca -0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 2vl4 h PRO 522 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2vl4 h PRO 522 CO 0.70 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.64 2vl4 n GLU 523 N -3.97 0.04 0.00 1.05 0.00 -1.26 -2.87 120.64 113.63 2vl4 n GLU 523 Ca -0.03 0.19 0.12 0.00 0.00 0.00 0.00 57.16 57.44 2vl4 n GLU 523 Cb 0.09 -1.56 0.29 0.00 0.00 0.00 0.00 31.44 30.26 2vl4 n GLU 523 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 2vl4 n SER 524 N -1.63 0.64 0.25 -1.84 3.41 -0.17 -4.42 113.62 109.87 2vl4 n SER 524 Ca 0.05 -0.43 0.13 0.00 -0.26 0.00 0.00 58.87 58.35 2vl4 n SER 524 Cb 0.25 0.21 0.60 0.00 -0.26 0.00 0.00 64.21 65.00 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 0.34 0.00 0.00 7.33 6.55 -1.65 -1.48 115.95 127.05 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 0.50 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.80 2vl4 h TRP 525 CO 0.00 0.14 0.00 0.41 -1.05 0.00 0.00 178.44 177.94 2vl4 n GLY 526 N -0.11 -0.96 3.11 1.49 0.00 -1.26 -3.40 105.19 104.06 2vl4 n GLY 526 Ca -0.00 -0.16 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.19 3.28 0.00 2.61 2.01 -0.56 -1.26 115.64 119.53 2vl4 s THR 527 Ca 0.36 -2.18 0.00 0.00 0.31 0.00 0.00 61.69 60.18 2vl4 s THR 527 Cb 0.19 -3.24 0.00 0.00 0.01 0.00 0.00 72.50 69.45 2vl4 s THR 527 CO 0.35 -0.71 0.00 0.61 -0.69 0.00 0.00 174.62 174.18 2vl4 n GLY 528 N 4.44 0.04 3.87 4.40 0.00 -0.30 -3.71 105.19 113.93 2vl4 n GLY 528 Ca -0.01 -0.95 -0.31 0.00 0.00 0.00 0.00 46.02 44.75 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 6.65 -0.01 1.61 -4.77 -1.26 -3.81 116.67 111.08 2vl4 s ASP 529 Ca 0.00 1.11 0.07 0.00 -3.30 0.00 0.00 52.55 50.43 2vl4 s ASP 529 Cb 0.00 -2.31 -0.02 0.00 -1.09 0.00 0.00 42.92 39.50 2vl4 s ASP 529 CO 0.00 -0.22 -0.22 -0.44 0.70 0.00 0.00 175.17 174.99 2vl4 s SER 530 N -2.57 3.44 -1.05 2.11 0.01 0.12 -4.25 113.70 111.51 2vl4 s SER 530 Ca 0.51 -0.41 -0.09 0.00 1.31 0.00 0.00 55.95 57.28 2vl4 s SER 530 Cb -0.10 -0.51 0.26 0.00 0.21 0.00 0.00 66.02 65.88 2vl4 s SER 530 CO 0.23 0.31 1.03 -1.00 0.41 0.00 0.00 173.24 174.21 2vl4 s HIS 531 N -0.72 4.17 -0.88 2.43 3.76 -1.26 -0.20 115.29 122.60 2vl4 s HIS 531 Ca 0.11 -2.67 -0.23 0.00 -0.15 0.00 0.00 55.06 52.12 2vl4 s HIS 531 Cb -0.10 -3.75 0.06 0.00 1.11 0.00 0.00 32.58 29.90 2vl4 s HIS 531 CO 0.01 -0.93 1.27 1.21 -0.85 0.00 0.00 174.74 175.45 2vl4 s ASN 532 N 1.20 6.39 -0.24 1.40 3.84 -0.61 -4.42 114.94 122.50 2vl4 s ASN 532 Ca 0.29 -1.26 0.11 0.00 0.21 0.00 0.00 52.86 52.21 2vl4 s ASN 532 Cb -0.10 -2.51 0.71 0.00 -0.55 0.00 0.00 41.25 38.80 2vl4 s ASN 532 CO -0.09 -1.49 1.64 0.79 -2.79 0.00 0.00 177.10 175.16 2vl4 n TRP 533 N 8.36 1.99 0.00 0.43 7.02 -1.26 -4.33 117.44 129.65 2vl4 n TRP 533 Ca 0.18 -0.81 -0.10 0.00 -1.02 0.00 0.00 57.50 55.75 2vl4 n TRP 533 Cb 0.49 -0.53 -0.05 0.00 -2.42 0.00 0.00 31.31 28.80 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 3.70 0.06 -3.91 6.99 0.00 -1.86 -1.50 103.07 106.55 2vl4 h GLY 534 Ca 0.09 0.04 -0.52 0.00 0.00 0.00 0.00 47.33 46.94 2vl4 h GLY 534 CO 0.52 -0.04 0.63 0.14 0.00 0.00 0.00 176.54 177.80 2vl4 s VAL 535 N -6.19 2.78 0.00 4.60 1.01 -1.26 -1.43 120.40 119.90 2vl4 s VAL 535 Ca -0.13 0.77 0.00 0.00 0.00 0.00 0.00 61.98 62.62 2vl4 s VAL 535 Cb 0.08 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.97 2vl4 s VAL 535 CO 0.67 0.18 0.00 1.87 0.00 0.00 0.00 175.10 177.82 2vl4 n TRP 536 N 0.98 0.00 -0.34 5.22 -0.00 -1.26 -4.48 117.44 117.55 2vl4 n TRP 536 Ca 0.01 0.00 0.01 0.00 -0.00 0.00 0.00 57.50 57.52 2vl4 n TRP 536 Cb 0.42 0.00 0.17 0.00 -0.00 0.00 0.00 31.31 31.90 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 1.17 -0.22 5.87 0.05 -1.63 -1.50 116.97 120.72 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 -0.39 0.00 0.00 1.01 0.00 0.00 36.73 37.35 2vl4 h TYR 537 CO 0.00 0.67 0.00 0.41 -1.05 0.00 0.00 178.16 178.19 2vl4 n GLY 538 N -1.38 0.68 2.13 3.88 0.00 -0.53 -4.95 105.19 105.01 2vl4 n GLY 538 Ca 0.13 -0.51 -0.15 0.00 0.00 0.00 0.00 46.02 45.49 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 0.66 -1.33 -2.27 1.61 5.02 -0.57 -4.89 118.16 116.40 2vl4 n LYS 539 Ca 0.17 0.87 -0.36 0.00 -2.02 0.00 0.00 58.31 56.96 2vl4 n LYS 539 Cb 0.41 -5.14 -0.01 0.00 -0.02 0.00 0.00 35.03 30.27 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 -3.26 3.60 0.69 1.97 1.02 -0.52 -4.90 119.74 118.35 2vl4 s LYS 540 Ca 0.00 1.70 -0.13 0.00 0.02 0.00 0.00 55.97 57.55 2vl4 s LYS 540 Cb 0.00 -2.24 0.01 0.00 -0.52 0.00 0.00 37.83 35.08 2vl4 s LYS 540 CO 0.00 -0.66 1.10 -1.25 -0.92 0.00 0.00 175.35 173.61 2vl4 s PRO 541 N -2.95 2.71 0.50 -1.68 0.04 -1.26 -4.49 135.00 127.88 2vl4 s PRO 541 Ca 0.67 1.28 0.22 0.00 0.04 0.00 0.00 61.00 63.21 2vl4 s PRO 541 Cb -0.26 -1.95 1.29 0.00 0.04 0.00 0.00 34.50 33.62 2vl4 s PRO 541 CO 0.31 -1.30 1.98 0.74 0.04 0.00 0.00 177.00 178.77 2vl4 h PHE 542 N -0.31 0.14 0.00 0.56 0.04 -1.94 -0.45 116.94 114.98 2vl4 h PHE 542 Ca -0.46 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.32 2vl4 h PHE 542 Cb 1.24 -0.05 -0.00 0.00 2.20 0.00 0.00 35.95 39.34 2vl4 h PHE 542 CO 0.56 0.06 -0.01 0.93 -0.60 0.00 0.00 178.31 179.25 2vl4 h GLU 543 N 0.13 0.00 0.00 1.51 3.07 -1.94 -0.58 114.58 116.77 2vl4 h GLU 543 Ca 0.27 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.13 2vl4 h GLU 543 Cb 0.90 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.81 2vl4 h GLU 543 CO -0.03 0.01 -0.00 0.66 -1.40 0.00 0.00 179.01 178.25 2vl4 h SER 544 N 0.00 0.00 0.74 1.42 4.64 -1.42 -2.11 113.55 116.81 2vl4 h SER 544 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2vl4 h SER 544 Cb 0.04 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.13 2vl4 h SER 544 CO 0.00 0.00 -0.04 -0.07 -0.87 0.00 0.00 176.83 175.86 2vl4 h LEU 545 N 0.00 0.00 -0.88 5.97 3.38 -1.27 0.10 115.31 122.61 2vl4 h LEU 545 Ca -0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 2vl4 h LEU 545 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2vl4 h LEU 545 CO 0.00 0.04 -0.53 0.44 0.09 0.00 0.00 178.44 178.48 2vl4 h ASP 546 N 0.00 0.00 0.00 -0.43 3.32 -1.56 -3.38 116.42 114.37 2vl4 h ASP 546 Ca -0.00 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.85 2vl4 h ASP 546 Cb 0.41 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.93 2vl4 h ASP 546 CO 0.00 0.53 -1.77 0.35 -1.72 0.00 0.00 179.24 176.63 2vl4 n THR 547 N -3.78 0.76 -2.51 0.35 -2.24 -0.81 -4.77 114.28 101.28 2vl4 n THR 547 Ca -0.01 -0.47 -0.42 0.00 -2.27 0.00 0.00 64.05 60.88 2vl4 n THR 547 Cb 0.56 -0.70 0.01 0.00 -2.10 0.00 0.00 70.33 68.10 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 -2.41 6.43 -4.80 3.42 8.00 0.29 -5.00 116.55 122.47 2vl4 n ASP 548 Ca -0.18 -3.30 -0.36 0.00 0.71 0.00 0.00 54.79 51.66 2vl4 n ASP 548 Cb 0.86 -1.35 -0.06 0.00 -0.02 0.00 0.00 41.12 40.55 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 -1.97 4.33 0.41 0.64 1.43 -1.26 -4.88 118.68 117.38 2vl4 s LEU 549 Ca 0.40 1.60 0.08 0.00 -1.03 0.00 0.00 54.13 55.17 2vl4 s LEU 549 Cb 0.11 -3.79 -0.03 0.00 0.03 0.00 0.00 46.19 42.51 2vl4 s LEU 549 CO -0.00 -0.02 0.29 -2.16 0.23 0.00 0.00 176.35 174.69 2vl4 s PRO 550 N -2.04 2.40 0.35 1.29 0.04 -1.26 -4.70 135.00 131.08 2vl4 s PRO 550 Ca 0.46 -1.67 0.18 0.00 0.04 0.00 0.00 61.00 60.01 2vl4 s PRO 550 Cb -0.17 -2.20 0.57 0.00 0.04 0.00 0.00 34.50 32.73 2vl4 s PRO 550 CO 0.22 -0.16 1.68 0.00 0.04 0.00 0.00 177.00 178.78 2vl4 h ARG 551 N 1.21 0.00 -1.59 4.56 2.47 -1.65 -3.32 114.38 116.05 2vl4 h ARG 551 Ca -0.42 0.00 0.11 0.00 -1.26 0.00 0.00 59.98 58.41 2vl4 h ARG 551 Cb 1.26 0.00 -0.22 0.00 -1.65 0.00 0.00 29.97 29.36 2vl4 h ARG 551 CO 0.63 0.41 0.08 0.12 0.56 0.00 0.00 179.97 181.77 2vl4 s PHE 552 N -3.50 -0.98 -0.61 3.04 5.36 -1.25 -0.48 117.98 119.56 2vl4 s PHE 552 Ca 0.01 1.75 -0.22 0.00 -0.96 0.00 0.00 56.93 57.51 2vl4 s PHE 552 Cb 0.10 0.59 0.07 0.00 -0.34 0.00 0.00 43.02 43.44 2vl4 s PHE 552 CO 0.70 -0.49 0.87 1.41 -1.46 0.00 0.00 175.22 176.26 2vl4 s MET 553 N 2.38 3.15 0.17 10.12 -2.45 0.13 -0.70 119.30 132.10 2vl4 s MET 553 Ca -0.06 -0.79 0.24 0.00 -1.25 0.00 0.00 55.69 53.83 2vl4 s MET 553 Cb -0.08 -4.18 0.35 0.00 1.25 0.00 0.00 34.83 32.17 2vl4 s MET 553 CO -0.18 -1.62 1.35 0.66 1.05 0.00 0.00 175.02 176.28 2vl4 h SER 554 N 9.38 0.00 -3.79 1.11 4.64 -0.82 0.22 113.55 124.29 2vl4 h SER 554 Ca -0.28 -0.14 -0.08 0.00 -0.47 0.00 0.00 61.79 60.83 2vl4 h SER 554 Cb 1.08 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.94 2vl4 h SER 554 CO 1.12 0.07 -0.07 -1.61 -0.87 0.00 0.00 176.83 175.47 2vl4 s GLU 555 N -3.19 0.64 0.08 4.77 2.02 -1.00 -4.60 118.70 117.41 2vl4 s GLU 555 Ca 0.06 0.82 -0.26 0.00 0.02 0.00 0.00 54.97 55.61 2vl4 s GLU 555 Cb 0.12 0.27 0.08 0.00 0.10 0.00 0.00 34.13 34.70 2vl4 s GLU 555 CO 0.71 -0.09 0.72 -0.59 0.02 0.00 0.00 175.26 176.03 2vl4 s PHE 556 N 0.52 -0.47 -0.03 1.61 -0.12 -1.25 -1.57 117.98 116.67 2vl4 s PHE 556 Ca -0.02 0.33 -0.30 0.00 -0.05 0.00 0.00 56.93 56.88 2vl4 s PHE 556 Cb -0.04 0.54 0.12 0.00 -0.63 0.00 0.00 43.02 43.01 2vl4 s PHE 556 CO -0.02 -0.71 1.32 0.20 -0.05 0.00 0.00 175.22 175.95 2vl4 s GLY 557 N -2.54 -0.38 -0.19 1.99 0.00 -1.26 0.10 107.32 105.05 2vl4 s GLY 557 Ca 0.02 0.62 -0.18 0.00 0.00 0.00 0.00 44.72 45.18 2vl4 s GLY 557 CO -0.10 1.11 0.52 -0.12 0.00 0.00 0.00 173.10 174.51 2vl4 s PHE 558 N -2.28 -0.56 0.57 1.90 5.36 -1.26 -4.38 117.98 117.33 2vl4 s PHE 558 Ca 0.17 1.36 -0.07 0.00 -0.96 0.00 0.00 56.93 57.42 2vl4 s PHE 558 Cb 0.04 0.20 -0.02 0.00 -0.34 0.00 0.00 43.02 42.90 2vl4 s PHE 558 CO -0.04 -0.28 0.91 -0.65 -1.46 0.00 0.00 175.22 173.70 2vl4 s GLN 559 N 0.21 3.28 -0.00 10.12 -0.21 -1.26 -4.42 119.66 127.39 2vl4 s GLN 559 Ca -0.00 0.28 -0.16 0.00 0.02 0.00 0.00 55.36 55.50 2vl4 s GLN 559 Cb -0.04 -2.24 0.03 0.00 1.00 0.00 0.00 33.01 31.76 2vl4 s GLN 559 CO 0.01 -0.53 0.34 -1.54 -2.12 0.00 0.00 175.29 171.45 2vl4 s SER 560 N -4.21 -0.21 0.36 5.90 1.04 -0.28 -4.71 113.70 111.59 2vl4 s SER 560 Ca 0.52 0.06 -0.28 0.00 0.48 0.00 0.00 55.95 56.73 2vl4 s SER 560 Cb -0.11 0.34 -0.11 0.00 0.10 0.00 0.00 66.02 66.25 2vl4 s SER 560 CO 0.48 -0.51 1.47 -0.36 0.98 0.00 0.00 173.24 175.30 2vl4 s PHE 561 N -1.65 2.67 0.85 5.02 0.40 -1.26 -2.87 117.98 121.14 2vl4 s PHE 561 Ca -0.11 1.17 -0.11 0.00 -0.60 0.00 0.00 56.93 57.28 2vl4 s PHE 561 Cb -0.04 -3.98 0.10 0.00 0.51 0.00 0.00 43.02 39.62 2vl4 s PHE 561 CO 0.03 -2.88 1.10 -1.25 0.70 0.00 0.00 175.22 172.92 2vl4 s PRO 562 N -1.92 1.63 1.14 0.24 0.04 -1.26 -4.69 135.00 130.18 2vl4 s PRO 562 Ca 0.53 1.19 -0.13 0.00 0.04 0.00 0.00 61.00 62.64 2vl4 s PRO 562 Cb -0.46 -1.82 0.27 0.00 0.04 0.00 0.00 34.50 32.53 2vl4 s PRO 562 CO 0.60 -2.09 1.04 -1.83 0.04 0.00 0.00 177.00 174.76 2vl4 s GLU 563 N -4.83 -0.73 0.28 4.56 -1.05 -1.26 -4.58 118.70 111.09 2vl4 s GLU 563 Ca 0.63 0.88 -0.01 0.00 -0.15 0.00 0.00 54.97 56.32 2vl4 s GLU 563 Cb -0.19 -1.57 0.40 0.00 -0.44 0.00 0.00 34.13 32.33 2vl4 s GLU 563 CO 0.57 -3.61 1.82 0.52 0.95 0.00 0.00 175.26 175.51 2vl4 h MET 564 N -2.54 0.81 -0.55 -4.83 2.86 -1.95 -2.07 114.93 106.66 2vl4 h MET 564 Ca -0.60 -0.17 0.10 0.00 -2.06 0.00 0.00 59.70 56.97 2vl4 h MET 564 Cb 1.33 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.84 2vl4 h MET 564 CO 0.50 0.74 0.37 1.57 1.06 0.00 0.00 176.91 181.16 2vl4 h LYS 565 N 0.78 0.32 -0.04 1.72 2.10 -1.91 0.16 116.57 119.69 2vl4 h LYS 565 Ca 0.17 -0.02 -0.16 0.00 -2.00 0.00 0.00 60.65 58.64 2vl4 h LYS 565 Cb 0.32 -0.07 0.01 0.00 -0.90 0.00 0.00 32.23 31.59 2vl4 h LYS 565 CO 0.00 0.21 -0.59 1.15 -2.00 0.00 0.00 179.45 178.22 2vl4 h THR 566 N 0.33 1.39 -0.92 0.07 2.02 -1.73 -2.89 112.91 111.18 2vl4 h THR 566 Ca 0.25 -1.98 0.05 0.00 0.77 0.00 0.00 66.41 65.50 2vl4 h THR 566 Cb 0.56 2.41 -0.06 0.00 -1.74 0.00 0.00 68.15 69.32 2vl4 h THR 566 CO -0.06 0.59 0.59 0.40 0.37 0.00 0.00 175.52 177.40 2vl4 h ILE 567 N 0.03 1.10 0.00 3.11 2.04 -0.83 -1.84 117.51 121.12 2vl4 h ILE 567 Ca -0.06 -0.38 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 2vl4 h ILE 567 Cb 1.27 -0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.26 2vl4 h ILE 567 CO 0.12 0.20 -0.11 0.00 0.00 0.00 0.00 178.15 178.36 2vl4 h ALA 568 N 1.40 1.09 0.00 1.87 0.00 -0.75 0.17 119.26 123.05 2vl4 h ALA 568 Ca 0.38 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2vl4 h ALA 568 Cb 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2vl4 h ALA 568 CO -0.15 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.23 2vl4 h ALA 569 N 1.89 1.00 0.00 0.00 0.00 -1.11 -3.34 119.26 117.70 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 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2vl4 h ALA 569 CO 0.01 0.00 0.00 1.97 0.00 0.00 0.00 179.25 181.23 2vl4 n PHE 570 N -2.90 0.00 -3.98 0.00 -1.74 -0.49 -4.75 117.46 103.61 2vl4 n PHE 570 Ca 0.02 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.83 2vl4 n PHE 570 Cb 0.37 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.28 2vl4 n PHE 570 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2vl4 s ALA 571 N -0.29 0.11 0.22 1.98 0.00 0.48 -0.41 121.76 123.86 2vl4 s ALA 571 Ca 0.00 -0.73 0.05 0.00 0.00 0.00 0.00 51.96 51.28 2vl4 s ALA 571 Cb 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 23.12 23.33 2vl4 s ALA 571 CO 0.00 -0.31 0.32 0.00 0.00 0.00 0.00 175.76 175.77 2vl4 s ALA 572 N -2.79 3.88 0.66 0.00 0.00 -1.26 -4.43 121.76 117.82 2vl4 s ALA 572 Ca -0.03 -1.22 0.34 0.00 0.00 0.00 0.00 51.96 51.04 2vl4 s ALA 572 Cb -0.00 -1.67 1.83 0.00 0.00 0.00 0.00 23.12 23.27 2vl4 s ALA 572 CO -0.06 0.30 2.04 -1.35 0.00 0.00 0.00 175.76 176.69 2vl4 h PRO 573 N 1.41 0.00 0.00 0.00 0.11 -1.98 0.24 132.00 131.78 2vl4 h PRO 573 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2vl4 h PRO 573 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2vl4 h PRO 573 CO 0.62 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.80 2vl4 n GLU 574 N -3.01 0.10 0.00 1.05 4.71 -1.26 -2.95 120.64 119.27 2vl4 n GLU 574 Ca -0.02 0.11 0.12 0.00 -0.01 0.00 0.00 57.16 57.36 2vl4 n GLU 574 Cb 0.31 -1.50 0.13 0.00 -1.01 0.00 0.00 31.44 29.37 2vl4 n GLU 574 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2vl4 n ASP 575 N -1.44 2.24 -3.35 1.62 8.00 0.07 -4.78 116.55 118.92 2vl4 n ASP 575 Ca 0.07 -1.63 -0.30 0.00 0.71 0.00 0.00 54.79 53.64 2vl4 n ASP 575 Cb 0.23 0.22 -0.04 0.00 -0.02 0.00 0.00 41.12 41.51 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 0.45 1.40 -4.05 1.24 4.02 -1.15 -4.60 117.16 114.47 2vl4 n TYR 576 Ca 0.12 -1.73 -0.13 0.00 -0.01 0.00 0.00 57.90 56.16 2vl4 n TYR 576 Cb 0.50 -1.56 -0.12 0.00 -0.02 0.00 0.00 39.34 38.14 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 4.30 0.47 0.58 -0.72 1.11 -1.26 -4.68 119.66 119.45 2vl4 s GLN 577 Ca 0.45 -0.66 0.35 0.00 0.01 0.00 0.00 55.36 55.51 2vl4 s GLN 577 Cb 0.11 -0.23 1.68 0.00 -1.01 0.00 0.00 33.01 33.57 2vl4 s GLN 577 CO 0.04 0.04 2.11 -0.84 0.01 0.00 0.00 175.29 176.65 2vl4 h ILE 578 N 4.59 0.14 0.00 1.08 3.07 -1.98 -2.20 117.51 122.21 2vl4 h ILE 578 Ca -0.34 -0.40 -0.04 0.00 1.55 0.00 0.00 64.86 65.63 2vl4 h ILE 578 Cb 1.20 1.34 -0.09 0.00 -0.27 0.00 0.00 36.82 39.00 2vl4 h ILE 578 CO 0.42 0.04 -0.58 -0.62 -1.05 0.00 0.00 178.15 176.35 2vl4 n GLU 579 N -3.21 1.10 -0.66 0.16 1.02 -1.26 -4.64 120.64 113.15 2vl4 n GLU 579 Ca -0.01 -2.82 -0.29 0.00 -0.02 0.00 0.00 57.16 54.03 2vl4 n GLU 579 Cb 0.23 -1.17 0.25 0.00 -0.02 0.00 0.00 31.44 30.73 2vl4 n GLU 579 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2vl4 s SER 580 N -2.81 0.79 0.12 1.62 1.04 -0.83 -4.78 113.70 108.86 2vl4 s SER 580 Ca 0.35 1.25 -0.15 0.00 0.48 0.00 0.00 55.95 57.87 2vl4 s SER 580 Cb 0.35 -1.92 -0.02 0.00 0.10 0.00 0.00 66.02 64.53 2vl4 s SER 580 CO -0.08 -4.28 1.61 -0.08 0.98 0.00 0.00 173.24 171.39 2vl4 h GLU 581 N -2.68 0.65 -0.42 4.02 4.81 -1.90 -1.58 114.58 117.49 2vl4 h GLU 581 Ca -0.57 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 58.41 2vl4 h GLU 581 Cb 1.34 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.62 2vl4 h GLU 581 CO 0.47 0.70 -0.07 0.28 -0.73 0.00 0.00 179.01 179.66 2vl4 h VAL 582 N 0.50 1.25 -0.09 0.32 2.07 -1.91 -1.05 116.25 117.34 2vl4 h VAL 582 Ca 0.12 -1.07 -0.17 0.00 0.82 0.00 0.00 66.70 66.40 2vl4 h VAL 582 Cb 0.36 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2vl4 h VAL 582 CO 0.01 0.37 -0.68 0.24 0.02 0.00 0.00 177.57 177.52 2vl4 h MET 583 N 0.66 0.37 -0.08 1.57 2.86 -1.77 -2.45 114.93 116.10 2vl4 h MET 583 Ca 0.12 -0.29 -0.12 0.00 -2.06 0.00 0.00 59.70 57.35 2vl4 h MET 583 Cb 0.51 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.22 2vl4 h MET 583 CO 0.03 0.92 -0.50 -0.91 1.06 0.00 0.00 176.91 177.51 2vl4 h ASN 584 N 0.26 0.22 0.21 1.22 2.35 -1.23 -2.58 115.58 116.04 2vl4 h ASN 584 Ca -0.02 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.61 2vl4 h ASN 584 Cb 1.24 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 39.54 2vl4 h ASN 584 CO 0.12 0.68 -0.06 0.00 -1.65 0.00 0.00 177.43 176.52 2vl4 h ALA 585 N 1.32 1.35 -0.31 -0.83 0.00 -0.94 -2.77 119.26 117.10 2vl4 h ALA 585 Ca 0.01 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.65 2vl4 h ALA 585 Cb 0.94 -0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.57 2vl4 h ALA 585 CO 0.07 0.08 -0.43 0.72 0.00 0.00 0.00 179.25 179.69 2vl4 n HIS 586 N -3.67 1.07 -3.83 0.00 8.25 -0.94 -4.88 115.22 111.21 2vl4 n HIS 586 Ca -0.02 -1.76 -0.16 0.00 -0.26 0.00 0.00 57.72 55.51 2vl4 n HIS 586 Cb 0.16 -0.38 -0.16 0.00 1.12 0.00 0.00 29.99 30.74 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 -3.36 0.10 0.00 -0.41 2.00 -1.04 -0.33 119.66 116.61 2vl4 s GLN 587 Ca 0.44 0.15 0.00 0.00 -2.00 0.00 0.00 55.36 53.95 2vl4 s GLN 587 Cb 0.39 -0.35 0.00 0.00 0.80 0.00 0.00 33.01 33.85 2vl4 s GLN 587 CO -0.02 -0.16 0.41 1.63 -0.50 0.00 0.00 175.29 176.65 2vl4 n LYS 588 N 4.19 0.06 -2.06 1.67 4.76 -1.25 -4.86 118.16 120.67 2vl4 n LYS 588 Ca -0.27 -0.49 -0.32 0.00 -2.87 0.00 0.00 58.31 54.37 2vl4 n LYS 588 Cb 0.50 -0.77 0.00 0.00 -1.84 0.00 0.00 35.03 32.92 2vl4 n LYS 588 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2vl4 s SER 589 N -0.15 6.04 0.48 4.39 0.15 -1.02 -4.43 113.70 119.16 2vl4 s SER 589 Ca 0.00 1.66 0.14 0.00 0.70 0.00 0.00 55.95 58.45 2vl4 s SER 589 Cb 0.00 -2.51 1.12 0.00 -1.71 0.00 0.00 66.02 62.92 2vl4 s SER 589 CO 0.00 -0.99 2.08 0.77 1.20 0.00 0.00 173.24 176.30 2vl4 h SER 590 N 0.32 0.07 -3.32 5.45 4.64 -1.98 -3.38 113.55 115.34 2vl4 h SER 590 Ca -0.46 -0.01 -0.65 0.00 -0.47 0.00 0.00 61.79 60.21 2vl4 h SER 590 Cb 1.20 -0.02 -0.33 0.00 -0.31 0.00 0.00 62.40 62.94 2vl4 h SER 590 CO 0.59 0.11 -0.87 -0.51 -0.87 0.00 0.00 176.83 175.29 2vl4 s ILE 591 N -4.98 1.89 0.00 0.95 1.10 -1.26 -5.13 121.20 113.77 2vl4 s ILE 591 Ca -0.05 -0.91 0.00 0.00 -0.51 0.00 0.00 60.65 59.18 2vl4 s ILE 591 Cb 0.17 -1.66 0.00 0.00 0.15 0.00 0.00 42.46 41.12 2vl4 s ILE 591 CO 0.69 0.52 0.00 0.61 -2.11 0.00 0.00 174.94 174.65 2vl4 n GLY 592 N 3.72 2.30 0.21 1.50 0.00 -1.26 -4.92 105.19 106.74 2vl4 n GLY 592 Ca -0.20 -1.56 0.07 0.00 0.00 0.00 0.00 46.02 44.33 2vl4 n GLY 592 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2vl4 h ASN 593 N 0.00 0.00 0.20 1.61 2.35 -1.95 -2.82 115.58 114.97 2vl4 h ASN 593 Ca 0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 2vl4 h ASN 593 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2vl4 h ASN 593 CO 0.00 0.29 -0.24 0.77 -1.65 0.00 0.00 177.43 176.59 2vl4 h SER 594 N 0.00 0.07 0.05 5.81 4.64 -1.95 -2.94 113.55 119.24 2vl4 h SER 594 Ca -0.00 -0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.23 2vl4 h SER 594 Cb 0.61 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 2vl4 h SER 594 CO 0.04 0.32 -0.22 0.25 -0.87 0.00 0.00 176.83 176.35 2vl4 h LEU 595 N 0.07 0.29 -0.32 5.97 5.85 -1.85 -1.61 115.31 123.71 2vl4 h LEU 595 Ca 0.01 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 2vl4 h LEU 595 Cb 0.47 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2vl4 h LEU 595 CO 0.03 0.52 0.19 0.40 -0.34 0.00 0.00 178.44 179.25 2vl4 h ILE 596 N 0.27 1.11 -0.74 4.05 2.04 -1.65 -1.04 117.51 121.56 2vl4 h ILE 596 Ca 0.05 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 2vl4 h ILE 596 Cb 0.54 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 2vl4 h ILE 596 CO 0.04 0.11 0.41 -0.09 0.00 0.00 0.00 178.15 178.61 2vl4 h ARG 597 N 0.41 1.03 -0.14 2.37 2.43 -1.39 0.22 114.38 119.31 2vl4 h ARG 597 Ca 0.11 -0.12 0.04 0.00 -0.81 0.00 0.00 59.98 59.20 2vl4 h ARG 597 Cb 0.01 -0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 29.32 2vl4 h ARG 597 CO -0.02 0.77 -0.09 1.15 -1.51 0.00 0.00 179.97 180.27 2vl4 h THR 598 N 1.02 0.74 -0.71 0.20 2.02 -1.06 -1.94 112.91 113.18 2vl4 h THR 598 Ca 0.26 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.37 2vl4 h THR 598 Cb 0.04 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 2vl4 h THR 598 CO -0.04 0.00 0.17 1.88 0.37 0.00 0.00 175.52 177.90 2vl4 h TYR 599 N -0.08 1.19 -0.58 3.16 -1.99 -0.82 -3.13 116.97 114.72 2vl4 h TYR 599 Ca 0.08 -0.14 0.08 0.00 2.00 0.00 0.00 58.73 60.75 2vl4 h TYR 599 Cb 0.21 -0.33 -0.06 0.00 2.00 0.00 0.00 36.73 38.54 2vl4 h TYR 599 CO -0.22 0.97 0.23 1.98 -0.00 0.00 0.00 178.16 181.12 2vl4 h MET 600 N 1.07 0.41 -0.72 4.88 4.05 -0.23 -1.98 114.93 122.42 2vl4 h MET 600 Ca 0.22 -0.02 0.18 0.00 -0.28 0.00 0.00 59.70 59.80 2vl4 h MET 600 Cb 0.38 -0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.05 2vl4 h MET 600 CO 0.00 0.27 0.50 1.49 0.23 0.00 0.00 176.91 179.41 2vl4 h GLU 601 N 0.43 0.15 0.00 0.39 4.22 -1.31 0.15 114.58 118.61 2vl4 h GLU 601 Ca 0.28 -0.01 -0.07 0.00 0.08 0.00 0.00 59.36 59.65 2vl4 h GLU 601 Cb 0.31 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 2vl4 h GLU 601 CO -0.27 0.10 -0.32 0.00 -2.18 0.00 0.00 179.01 176.35 2vl4 h ARG 602 N 0.15 0.00 0.00 1.92 3.08 -1.36 -3.37 114.38 114.80 2vl4 h ARG 602 Ca 0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.40 2vl4 h ARG 602 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.20 2vl4 h ARG 602 CO -0.05 0.32 -0.38 -0.25 -1.07 0.00 0.00 179.97 178.53 2vl4 n ASP 603 N -3.86 1.92 -4.02 7.04 8.00 -0.54 -4.97 116.55 120.12 2vl4 n ASP 603 Ca -0.01 -0.14 -0.08 0.00 0.71 0.00 0.00 54.79 55.27 2vl4 n ASP 603 Cb 0.39 0.65 -0.10 0.00 -0.02 0.00 0.00 41.12 42.05 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 -1.04 0.36 -0.03 1.24 2.02 0.41 -0.58 117.35 119.74 2vl4 s TYR 604 Ca 0.00 -0.76 -0.30 0.00 -0.37 0.00 0.00 57.07 55.64 2vl4 s TYR 604 Cb 0.00 -0.27 -0.03 0.00 -0.40 0.00 0.00 41.96 41.26 2vl4 s TYR 604 CO 0.00 -0.31 1.14 0.42 -1.57 0.00 0.00 175.55 175.23 2vl4 s ILE 605 N -2.80 4.37 -0.16 2.71 1.01 -1.26 -4.14 121.20 120.93 2vl4 s ILE 605 Ca -0.03 1.69 -0.29 0.00 0.00 0.00 0.00 60.65 62.01 2vl4 s ILE 605 Cb -0.00 -4.09 -0.03 0.00 0.01 0.00 0.00 42.46 38.36 2vl4 s ILE 605 CO -0.06 0.05 1.47 -0.63 0.00 0.00 0.00 174.94 175.77 2vl4 s ILE 606 N 1.76 3.91 0.68 2.92 1.01 -1.26 -4.95 121.20 125.28 2vl4 s ILE 606 Ca 0.55 1.08 -0.12 0.00 0.00 0.00 0.00 60.65 62.16 2vl4 s ILE 606 Cb -0.24 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.45 2vl4 s ILE 606 CO 0.24 -0.19 1.06 -2.84 0.00 0.00 0.00 174.94 173.21 2vl4 s PRO 607 N 4.02 2.94 -0.00 2.79 0.02 -1.26 -5.00 135.00 138.51 2vl4 s PRO 607 Ca 0.65 1.05 -0.21 0.00 0.02 0.00 0.00 61.00 62.50 2vl4 s PRO 607 Cb -0.25 -1.99 -0.21 0.00 0.02 0.00 0.00 34.50 32.07 2vl4 s PRO 607 CO 0.24 -1.10 1.15 0.93 -0.33 0.00 0.00 177.00 177.89 2vl4 h GLU 608 N -0.48 0.32 -6.65 5.54 4.39 -1.95 -3.43 114.58 112.32 2vl4 h GLU 608 Ca -0.45 -0.28 -0.51 0.00 0.34 0.00 0.00 59.36 58.47 2vl4 h GLU 608 Cb 1.22 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.90 2vl4 h GLU 608 CO 0.56 0.94 0.20 -1.54 -1.16 0.00 0.00 179.01 178.01 2vl4 s SER 609 N -6.42 7.25 0.19 1.42 1.04 -1.26 -4.96 113.70 110.96 2vl4 s SER 609 Ca -0.14 1.62 -0.15 0.00 0.48 0.00 0.00 55.95 57.76 2vl4 s SER 609 Cb 0.03 -2.49 0.19 0.00 0.10 0.00 0.00 66.02 63.85 2vl4 s SER 609 CO 0.77 0.06 1.64 0.15 0.98 0.00 0.00 173.24 176.85 2vl4 h PHE 610 N 3.62 -0.28 -0.59 5.02 3.57 -1.89 0.76 116.94 127.16 2vl4 h PHE 610 Ca -0.47 0.05 0.06 0.00 3.53 0.00 0.00 57.97 61.14 2vl4 h PHE 610 Cb 1.20 0.21 -0.06 0.00 2.79 0.00 0.00 35.95 40.09 2vl4 h PHE 610 CO 0.63 -0.23 0.29 0.93 -2.23 0.00 0.00 178.31 177.70 2vl4 h GLU 611 N 0.01 0.53 -0.45 1.11 3.07 -1.94 -0.59 114.58 116.32 2vl4 h GLU 611 Ca 0.27 -0.03 -0.12 0.00 -0.50 0.00 0.00 59.36 58.98 2vl4 h GLU 611 Cb 0.41 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 2vl4 h GLU 611 CO -0.56 0.35 -0.18 -0.44 -1.40 0.00 0.00 179.01 176.78 2vl4 h ASP 612 N 0.55 0.93 -0.54 1.42 3.32 -1.87 -2.21 116.42 118.01 2vl4 h ASP 612 Ca 0.27 -0.39 0.08 0.00 0.02 0.00 0.00 57.03 57.01 2vl4 h ASP 612 Cb 0.22 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 39.45 2vl4 h ASP 612 CO -0.20 1.11 0.20 0.15 -1.72 0.00 0.00 179.24 178.77 2vl4 h PHE 613 N 0.74 0.35 -0.50 4.55 3.57 -0.37 -0.48 116.94 124.79 2vl4 h PHE 613 Ca 0.10 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 2vl4 h PHE 613 Cb 0.74 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.39 2vl4 h PHE 613 CO 0.05 0.10 0.18 0.28 -2.23 0.00 0.00 178.31 176.70 2vl4 h VAL 614 N 0.38 1.22 -0.30 1.41 2.07 -1.06 0.24 116.25 120.21 2vl4 h VAL 614 Ca 0.27 -0.71 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 2vl4 h VAL 614 Cb 0.30 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 2vl4 h VAL 614 CO -0.27 0.27 0.17 0.22 0.02 0.00 0.00 177.57 177.98 2vl4 h TYR 615 N 0.68 0.40 -0.25 1.57 3.20 -1.11 -1.93 116.97 119.52 2vl4 h TYR 615 Ca 0.16 -0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.88 2vl4 h TYR 615 Cb 0.23 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 2vl4 h TYR 615 CO 0.01 0.32 -0.45 0.28 -1.64 0.00 0.00 178.16 176.68 2vl4 h VAL 616 N 0.38 1.30 -0.52 1.81 2.07 -0.85 -2.57 116.25 117.87 2vl4 h VAL 616 Ca 0.11 -1.64 0.01 0.00 0.82 0.00 0.00 66.70 66.00 2vl4 h VAL 616 Cb 0.04 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 2vl4 h VAL 616 CO -0.02 0.52 0.35 1.23 0.02 0.00 0.00 177.57 179.67 2vl4 h GLY 617 N 0.99 0.72 0.92 2.17 0.00 -0.36 0.68 103.07 108.19 2vl4 h GLY 617 Ca 0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 2vl4 h GLY 617 CO 0.09 0.25 0.12 1.41 0.00 0.00 0.00 176.54 178.41 2vl4 h LEU 618 N 0.68 0.47 -0.63 3.11 3.38 -1.03 -1.84 115.31 119.45 2vl4 h LEU 618 Ca 0.20 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2vl4 h LEU 618 Cb -0.04 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 2vl4 h LEU 618 CO -0.05 0.53 0.42 0.58 0.09 0.00 0.00 178.44 180.01 2vl4 h VAL 619 N 0.39 1.16 0.19 1.22 2.07 -1.01 -1.59 116.25 118.68 2vl4 h VAL 619 Ca 0.11 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 2vl4 h VAL 619 Cb 0.21 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 2vl4 h VAL 619 CO -0.01 0.15 -0.09 0.25 0.02 0.00 0.00 177.57 177.89 2vl4 h LEU 620 N 0.85 -0.22 -0.74 2.57 5.85 -0.81 0.06 115.31 122.87 2vl4 h LEU 620 Ca 0.23 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.91 2vl4 h LEU 620 Cb -0.09 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 2vl4 h LEU 620 CO -0.05 -0.07 0.48 -0.61 -0.34 0.00 0.00 178.44 177.84 2vl4 h GLN 621 N -0.35 0.93 0.20 1.25 4.15 -1.23 -0.29 115.11 119.77 2vl4 h GLN 621 Ca -0.03 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.33 2vl4 h GLN 621 Cb 0.27 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.76 2vl4 h GLN 621 CO 0.04 0.61 -0.10 0.78 -1.93 0.00 0.00 178.83 178.24 2vl4 h GLY 622 N 0.95 -0.29 0.96 2.39 0.00 -0.92 -1.85 103.07 104.32 2vl4 h GLY 622 Ca 0.28 0.11 -0.10 0.00 0.00 0.00 0.00 47.33 47.62 2vl4 h GLY 622 CO -0.09 -0.10 -0.19 1.46 0.00 0.00 0.00 176.54 177.62 2vl4 h GLN 623 N -0.29 0.71 -0.20 4.80 1.08 -0.83 -1.26 115.11 119.13 2vl4 h GLN 623 Ca -0.03 -0.33 -0.03 0.00 -1.45 0.00 0.00 58.65 56.81 2vl4 h GLN 623 Cb 0.22 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 2vl4 h GLN 623 CO 0.05 0.93 -0.00 0.78 -0.95 0.00 0.00 178.83 179.64 2vl4 h GLY 624 N 0.48 0.37 1.35 3.46 0.00 -1.09 -1.77 103.07 105.88 2vl4 h GLY 624 Ca 0.07 -0.28 -0.13 0.00 0.00 0.00 0.00 47.33 46.99 2vl4 h GLY 624 CO 0.06 0.26 -0.32 -0.33 0.00 0.00 0.00 176.54 176.20 2vl4 h MET 625 N 0.10 0.73 0.00 4.80 2.86 -1.33 -2.64 114.93 119.45 2vl4 h MET 625 Ca 0.06 -0.34 -0.08 0.00 -2.06 0.00 0.00 59.70 57.28 2vl4 h MET 625 Cb 0.40 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 2vl4 h MET 625 CO 0.01 0.95 -0.36 0.07 1.06 0.00 0.00 176.91 178.64 2vl4 h ARG 626 N 0.62 0.00 -0.78 1.72 -0.00 -1.18 -0.08 114.38 114.68 2vl4 h ARG 626 Ca 0.07 0.00 0.07 0.00 -0.00 0.00 0.00 59.98 60.11 2vl4 h ARG 626 Cb 0.84 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 30.76 2vl4 h ARG 626 CO 0.07 0.36 0.51 1.25 -0.00 0.00 0.00 179.97 182.16 2vl4 h HIS 627 N 0.00 0.84 -0.02 4.08 2.76 -0.96 -0.74 115.15 121.11 2vl4 h HIS 627 Ca -0.00 0.02 -0.14 0.00 -2.20 0.00 0.00 60.37 58.05 2vl4 h HIS 627 Cb 0.73 -0.28 0.01 0.00 1.55 0.00 0.00 27.41 29.43 2vl4 h HIS 627 CO 0.00 0.44 -0.52 0.78 -1.30 0.00 0.00 177.93 177.33 2vl4 h GLY 628 N 0.83 0.43 0.39 5.26 0.00 -0.88 -2.19 103.07 106.91 2vl4 h GLY 628 Ca 0.33 -0.72 0.11 0.00 0.00 0.00 0.00 47.33 47.06 2vl4 h GLY 628 CO -0.12 0.64 0.42 1.41 0.00 0.00 0.00 176.54 178.89 2vl4 h LEU 629 N -0.13 0.55 -0.35 3.11 3.38 -0.75 -1.51 115.31 119.60 2vl4 h LEU 629 Ca -0.06 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2vl4 h LEU 629 Cb 1.23 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 2vl4 h LEU 629 CO 0.10 0.29 0.09 -0.33 0.09 0.00 0.00 178.44 178.68 2vl4 h GLU 630 N 0.67 0.56 -0.98 1.13 5.08 -1.19 -2.50 114.58 117.35 2vl4 h GLU 630 Ca 0.41 -0.13 0.08 0.00 -1.00 0.00 0.00 59.36 58.72 2vl4 h GLU 630 Cb 0.47 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.58 2vl4 h GLU 630 CO -0.30 0.60 0.63 0.00 -1.00 0.00 0.00 179.01 178.94 2vl4 h ALA 631 N 0.93 1.48 -0.03 3.43 0.00 -0.68 0.12 119.26 124.52 2vl4 h ALA 631 Ca 0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2vl4 h ALA 631 Cb 0.29 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2vl4 h ALA 631 CO -0.00 0.34 0.00 0.45 0.00 0.00 0.00 179.25 180.04 2vl4 h HIS 632 N 1.07 0.05 -0.56 0.00 3.86 -1.18 -2.06 115.15 116.33 2vl4 h HIS 632 Ca 0.44 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.64 2vl4 h HIS 632 Cb 0.29 -0.01 -0.03 0.00 1.06 0.00 0.00 27.41 28.72 2vl4 h HIS 632 CO -0.00 0.33 0.35 0.00 0.86 0.00 0.00 177.93 179.47 2vl4 h ARG 633 N -0.24 0.75 -0.36 2.45 3.08 -1.35 -2.81 114.38 115.89 2vl4 h ARG 633 Ca 0.01 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 2vl4 h ARG 633 Cb 0.31 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 2vl4 h ARG 633 CO 0.00 0.52 0.21 -0.09 -1.07 0.00 0.00 179.97 179.54 2vl4 h ARG 634 N 0.75 0.48 -0.87 0.04 2.43 -0.70 -2.64 114.38 113.87 2vl4 h ARG 634 Ca 0.20 -0.04 -0.23 0.00 -0.81 0.00 0.00 59.98 59.11 2vl4 h ARG 634 Cb -0.04 -0.10 -0.14 0.00 -0.42 0.00 0.00 29.97 29.27 2vl4 h ARG 634 CO -0.04 0.34 0.29 0.09 -1.51 0.00 0.00 179.97 179.14 2vl4 n ASN 635 N -4.46 3.98 -4.74 -3.80 3.02 -0.78 -4.80 115.26 103.69 2vl4 n ASN 635 Ca 0.02 -2.99 -0.41 0.00 -0.03 0.00 0.00 54.58 51.17 2vl4 n ASN 635 Cb 0.09 -0.71 -0.04 0.00 -0.61 0.00 0.00 39.78 38.51 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 4.58 0.00 3.52 3.52 -1.00 -0.74 118.95 126.43 2vl4 s ARG 636 Ca 0.42 1.79 0.24 0.00 -0.13 0.00 0.00 55.73 58.05 2vl4 s ARG 636 Cb 0.34 -3.24 0.31 0.00 -1.56 0.00 0.00 34.95 30.80 2vl4 s ARG 636 CO 0.10 0.07 1.29 -0.35 -0.81 0.00 0.00 175.30 175.59 2vl4 n PRO 637 N 2.07 1.00 -0.14 5.12 -0.04 -1.26 -4.51 135.00 137.24 2vl4 n PRO 637 Ca 0.02 -0.75 -0.04 0.00 -0.04 0.00 0.00 63.50 62.69 2vl4 n PRO 637 Cb 0.45 -1.48 0.02 0.00 -0.04 0.00 0.00 33.50 32.45 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 1.82 -0.47 -3.02 0.54 3.20 -1.67 -3.38 116.97 114.00 2vl4 h TYR 638 Ca 0.00 0.05 -0.62 0.00 3.14 0.00 0.00 58.73 61.30 2vl4 h TYR 638 Cb 0.64 0.28 -0.08 0.00 1.54 0.00 0.00 36.73 39.11 2vl4 h TYR 638 CO 0.00 -0.28 -0.34 0.00 -1.64 0.00 0.00 178.16 175.91 2vl4 n MET 640 N 2.58 1.98 0.00 0.00 2.81 0.37 -3.66 117.12 121.19 2vl4 n MET 640 Ca -0.15 -1.56 0.00 0.00 -1.81 0.00 0.00 57.70 54.18 2vl4 n MET 640 Cb 0.53 -1.01 0.00 0.00 -0.71 0.00 0.00 33.22 32.03 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 -0.61 0.87 3.02 3.03 0.00 -1.26 -1.77 105.19 108.48 2vl4 n GLY 641 Ca 0.04 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.35 -0.31 2.61 -1.32 0.18 -0.70 115.64 113.76 2vl4 s THR 642 Ca 0.00 0.26 0.02 0.00 -1.21 0.00 0.00 61.69 60.76 2vl4 s THR 642 Cb 0.00 -0.43 0.08 0.00 -1.51 0.00 0.00 72.50 70.64 2vl4 s THR 642 CO 0.00 0.11 0.00 -0.76 -2.21 0.00 0.00 174.62 171.76 2vl4 s LEU 643 N 2.22 4.20 0.64 9.08 1.43 0.78 -1.76 118.68 135.27 2vl4 s LEU 643 Ca -0.01 -1.73 -0.15 0.00 -1.03 0.00 0.00 54.13 51.22 2vl4 s LEU 643 Cb -0.12 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 2vl4 s LEU 643 CO -0.09 -0.31 1.09 -0.72 0.23 0.00 0.00 176.35 176.55 2vl4 s TYR 644 N 1.06 2.77 -0.32 0.29 1.13 -0.83 -3.36 117.35 118.08 2vl4 s TYR 644 Ca 0.01 1.53 -0.11 0.00 -1.41 0.00 0.00 57.07 57.09 2vl4 s TYR 644 Cb -0.20 -3.10 -0.01 0.00 -1.10 0.00 0.00 41.96 37.55 2vl4 s TYR 644 CO -0.05 -1.48 0.19 -0.46 -2.51 0.00 0.00 175.55 171.24 2vl4 s TRP 645 N -2.43 3.20 0.11 -3.49 -0.11 0.12 -1.08 118.94 115.26 2vl4 s TRP 645 Ca 0.65 -0.39 -0.01 0.00 1.22 0.00 0.00 56.10 57.57 2vl4 s TRP 645 Cb -0.19 -2.41 -0.04 0.00 -1.50 0.00 0.00 33.47 29.34 2vl4 s TRP 645 CO 0.41 -0.40 0.03 1.14 -4.62 0.00 0.00 176.95 173.51 2vl4 s GLN 646 N 1.66 0.86 0.04 5.86 -2.07 -0.94 -4.21 119.66 120.87 2vl4 s GLN 646 Ca 0.05 -1.39 -0.22 0.00 -1.82 0.00 0.00 55.36 51.99 2vl4 s GLN 646 Cb -0.17 0.19 -0.14 0.00 -1.09 0.00 0.00 33.01 31.81 2vl4 s GLN 646 CO 0.08 -0.21 1.43 1.25 -1.32 0.00 0.00 175.29 176.52 2vl4 h LEU 647 N 2.93 0.25 -8.56 2.60 5.85 -0.64 -1.91 115.31 115.83 2vl4 h LEU 647 Ca -0.35 -0.37 -0.25 0.00 0.84 0.00 0.00 57.88 57.76 2vl4 h LEU 647 Cb 1.18 -0.07 -0.12 0.00 0.37 0.00 0.00 40.66 42.03 2vl4 h LEU 647 CO 0.61 0.56 -0.40 0.54 -0.34 0.00 0.00 178.44 179.41 2vl4 s ASN 648 N -5.83 0.53 0.07 1.25 4.22 -1.26 -1.74 114.94 112.18 2vl4 s ASN 648 Ca -0.14 -1.38 0.07 0.00 -2.14 0.00 0.00 52.86 49.27 2vl4 s ASN 648 Cb 0.05 0.51 -0.03 0.00 1.28 0.00 0.00 41.25 43.06 2vl4 s ASN 648 CO 0.72 -1.04 -0.19 -1.81 -2.04 0.00 0.00 177.10 172.74 2vl4 s ASP 649 N -3.18 2.35 0.00 3.54 1.01 -1.23 -4.71 116.67 114.44 2vl4 s ASP 649 Ca 0.34 -0.60 0.23 0.00 0.71 0.00 0.00 52.55 53.23 2vl4 s ASP 649 Cb 0.03 -0.15 0.22 0.00 1.01 0.00 0.00 42.92 44.03 2vl4 s ASP 649 CO 0.16 0.08 1.22 -1.54 0.21 0.00 0.00 175.17 175.29 2vl4 n SER 650 N 1.43 0.69 -3.73 0.27 3.41 -1.24 -4.50 113.62 109.96 2vl4 n SER 650 Ca -0.19 -0.54 -0.03 0.00 -0.26 0.00 0.00 58.87 57.86 2vl4 n SER 650 Cb 0.54 0.54 -0.01 0.00 -0.26 0.00 0.00 64.21 65.01 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 -3.00 -0.12 -0.10 7.33 1.48 -1.26 -2.10 118.94 121.17 2vl4 s TRP 651 Ca 0.10 -0.15 -0.30 0.00 -1.06 0.00 0.00 56.10 54.69 2vl4 s TRP 651 Cb 0.17 0.62 -0.04 0.00 -1.16 0.00 0.00 33.47 33.06 2vl4 s TRP 651 CO 0.77 -0.74 1.45 -2.14 -4.06 0.00 0.00 176.95 172.23 2vl4 s PRO 652 N -3.15 4.22 0.13 3.25 0.02 -1.26 -4.51 135.00 133.70 2vl4 s PRO 652 Ca 0.12 1.93 -0.25 0.00 0.02 0.00 0.00 61.00 62.83 2vl4 s PRO 652 Cb -0.00 -3.84 0.07 0.00 0.02 0.00 0.00 34.50 30.75 2vl4 s PRO 652 CO 0.01 -0.75 0.74 0.54 -0.33 0.00 0.00 177.00 177.21 2vl4 s VAL 653 N 3.60 0.00 -0.23 3.83 0.11 -1.26 -4.95 120.40 121.50 2vl4 s VAL 653 Ca 0.64 -0.23 -0.24 0.00 -2.93 0.00 0.00 61.98 59.22 2vl4 s VAL 653 Cb -0.28 -1.27 -0.01 0.00 -1.53 0.00 0.00 36.38 33.29 2vl4 s VAL 653 CO 0.23 0.00 0.81 -0.69 -3.33 0.00 0.00 175.10 172.11 2vl4 s VAL 654 N -3.55 4.86 0.20 2.04 1.01 0.55 -4.38 120.40 121.14 2vl4 s VAL 654 Ca 0.05 1.53 -0.06 0.00 0.00 0.00 0.00 61.98 63.50 2vl4 s VAL 654 Cb -0.02 -4.10 0.02 0.00 0.00 0.00 0.00 36.38 32.29 2vl4 s VAL 654 CO -0.07 -0.04 0.37 -1.54 0.00 0.00 0.00 175.10 173.82 2vl4 n SER 655 N 5.82 -1.08 -0.13 3.32 3.41 -1.14 -4.58 113.62 119.23 2vl4 n SER 655 Ca 0.05 -1.87 0.15 0.00 -0.26 0.00 0.00 58.87 56.94 2vl4 n SER 655 Cb 0.48 1.83 0.80 0.00 -0.26 0.00 0.00 64.21 67.06 2vl4 n SER 655 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2vl4 n TRP 656 N -0.28 0.00 -1.68 7.33 8.01 -1.26 -1.13 117.44 128.42 2vl4 n TRP 656 Ca -0.03 0.00 -0.36 0.00 -1.31 0.00 0.00 57.50 55.80 2vl4 n TRP 656 Cb 0.31 -0.03 0.07 0.00 -2.01 0.00 0.00 31.31 29.65 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 -2.08 4.57 0.03 -0.99 1.04 -1.25 -2.22 113.70 112.80 2vl4 s SER 657 Ca 0.43 2.48 0.23 0.00 0.48 0.00 0.00 55.95 59.56 2vl4 s SER 657 Cb 0.21 -2.60 -0.01 0.00 0.10 0.00 0.00 66.02 63.72 2vl4 s SER 657 CO 0.38 -2.02 0.98 -1.54 0.98 0.00 0.00 173.24 172.02 2vl4 n SER 658 N -2.14 0.63 -3.86 7.02 3.41 -0.72 -4.83 113.62 113.14 2vl4 n SER 658 Ca 0.14 -0.37 -0.23 0.00 -0.26 0.00 0.00 58.87 58.16 2vl4 n SER 658 Cb 0.49 0.90 -0.17 0.00 -0.26 0.00 0.00 64.21 65.17 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 -3.17 0.61 1.02 -1.33 1.01 -0.71 -0.51 121.20 118.12 2vl4 s ILE 659 Ca 0.04 -0.09 -0.16 0.00 0.00 0.00 0.00 60.65 60.44 2vl4 s ILE 659 Cb 0.15 -0.68 0.21 0.00 0.01 0.00 0.00 42.46 42.15 2vl4 s ILE 659 CO 0.82 0.27 1.23 1.51 0.00 0.00 0.00 174.94 178.77 2vl4 s ASP 660 N 1.44 2.60 0.43 3.58 1.47 -0.74 -3.50 116.67 121.95 2vl4 s ASP 660 Ca -0.02 0.50 0.14 0.00 1.18 0.00 0.00 52.55 54.35 2vl4 s ASP 660 Cb -0.13 -0.70 1.03 0.00 -0.34 0.00 0.00 42.92 42.78 2vl4 s ASP 660 CO -0.03 -3.07 1.95 0.22 0.68 0.00 0.00 175.17 174.92 2vl4 h TYR 661 N -1.87 0.47 -0.09 2.11 3.20 -1.79 -1.22 116.97 117.78 2vl4 h TYR 661 Ca -0.45 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.43 2vl4 h TYR 661 Cb 1.27 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 39.39 2vl4 h TYR 661 CO -1.16 0.20 0.00 0.66 -1.64 0.00 0.00 178.16 176.22 2vl4 n TYR 662 N -4.47 0.11 -0.54 -3.82 4.01 -1.26 -4.89 117.16 106.29 2vl4 n TYR 662 Ca 0.12 -0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 2vl4 n TYR 662 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.47 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 1.02 0.72 3.70 2.72 0.00 -0.46 -3.73 105.19 109.16 2vl4 n GLY 663 Ca 0.16 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.08 7.31 0.03 1.61 0.01 -1.26 -4.81 114.94 115.75 2vl4 s ASN 664 Ca 0.00 1.59 -0.30 0.00 -0.71 0.00 0.00 52.86 53.44 2vl4 s ASN 664 Cb 0.00 -2.56 -0.06 0.00 0.41 0.00 0.00 41.25 39.04 2vl4 s ASN 664 CO 0.00 -0.31 1.42 0.26 -1.51 0.00 0.00 177.10 176.95 2vl4 s TRP 665 N 1.32 2.91 0.89 2.20 0.52 -1.26 -1.79 118.94 123.72 2vl4 s TRP 665 Ca 0.50 0.81 -0.13 0.00 0.02 0.00 0.00 56.10 57.30 2vl4 s TRP 665 Cb -0.20 -3.69 0.13 0.00 -1.15 0.00 0.00 33.47 28.56 2vl4 s TRP 665 CO 0.24 -2.53 1.19 0.15 0.02 0.00 0.00 176.95 176.03 2vl4 s LYS 666 N 2.12 1.31 0.33 4.98 1.02 0.33 -4.92 119.74 124.91 2vl4 s LYS 666 Ca 0.65 0.05 0.09 0.00 0.02 0.00 0.00 55.97 56.77 2vl4 s LYS 666 Cb -0.33 -1.88 0.82 0.00 -0.52 0.00 0.00 37.83 35.92 2vl4 s LYS 666 CO 0.28 -2.03 1.79 0.00 -0.92 0.00 0.00 175.35 174.46 2vl4 h ALA 667 N -1.37 1.79 -0.96 5.17 0.00 -1.85 -2.02 119.26 120.02 2vl4 h ALA 667 Ca -0.47 0.07 0.12 0.00 0.00 0.00 0.00 54.91 54.63 2vl4 h ALA 667 Cb 1.31 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.95 2vl4 h ALA 667 CO 0.58 -0.16 0.59 1.25 0.00 0.00 0.00 179.25 181.50 2vl4 h LEU 668 N 0.68 0.85 -0.36 0.00 5.85 -1.84 -0.47 115.31 120.04 2vl4 h LEU 668 Ca 0.57 0.05 -0.06 0.00 0.84 0.00 0.00 57.88 59.28 2vl4 h LEU 668 Cb 0.99 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 2vl4 h LEU 668 CO -0.35 0.45 -0.01 -0.74 -0.34 0.00 0.00 178.44 177.46 2vl4 h HIS 669 N 0.93 0.70 -0.90 1.25 2.76 -1.46 0.12 115.15 118.55 2vl4 h HIS 669 Ca 0.48 -0.12 0.01 0.00 -2.20 0.00 0.00 60.37 58.53 2vl4 h HIS 669 Cb 0.48 -0.18 -0.04 0.00 1.55 0.00 0.00 27.41 29.21 2vl4 h HIS 669 CO -0.02 0.74 0.60 1.88 -1.30 0.00 0.00 177.93 179.83 2vl4 h TYR 670 N 0.45 1.13 -0.22 5.26 0.05 -1.49 -1.04 116.97 121.11 2vl4 h TYR 670 Ca 0.10 0.03 -0.11 0.00 0.05 0.00 0.00 58.73 58.80 2vl4 h TYR 670 Cb 0.47 -0.38 -0.01 0.00 1.01 0.00 0.00 36.73 37.81 2vl4 h TYR 670 CO 0.04 0.71 -0.34 1.96 -1.05 0.00 0.00 178.16 179.48 2vl4 h GLN 671 N 1.22 0.46 -0.27 4.88 1.08 -0.72 -1.86 115.11 119.90 2vl4 h GLN 671 Ca 0.33 -0.21 -0.16 0.00 -1.45 0.00 0.00 58.65 57.16 2vl4 h GLN 671 Cb -0.14 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.28 2vl4 h GLN 671 CO -0.07 0.75 -0.46 0.00 -0.95 0.00 0.00 178.83 178.10 2vl4 h ALA 672 N 1.24 0.42 -0.56 3.87 0.00 -0.50 0.48 119.26 124.21 2vl4 h ALA 672 Ca 0.05 -0.48 0.11 0.00 0.00 0.00 0.00 54.91 54.59 2vl4 h ALA 672 Cb 0.79 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.41 2vl4 h ALA 672 CO 0.06 0.57 0.01 -0.22 0.00 0.00 0.00 179.25 179.67 2vl4 h LYS 673 N 0.54 0.12 -0.30 0.00 3.64 -1.05 0.20 116.57 119.73 2vl4 h LYS 673 Ca 0.02 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 2vl4 h LYS 673 Cb 1.06 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 2vl4 h LYS 673 CO 0.10 0.08 0.01 0.00 -2.27 0.00 0.00 179.45 177.37 2vl4 h ARG 674 N 0.13 0.53 0.00 1.90 3.08 -1.11 -2.52 114.38 116.38 2vl4 h ARG 674 Ca 0.29 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 60.16 2vl4 h ARG 674 Cb 0.45 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.45 2vl4 h ARG 674 CO -0.47 0.67 -0.05 0.00 -1.07 0.00 0.00 179.97 179.05 2vl4 h ALA 675 N 0.84 1.02 -0.02 0.04 0.00 -0.57 -2.90 119.26 117.66 2vl4 h ALA 675 Ca 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2vl4 h ALA 675 Cb 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2vl4 h ALA 675 CO 0.01 0.07 -0.03 1.19 0.00 0.00 0.00 179.25 180.50 2vl4 n PHE 676 N -3.18 0.00 -1.65 0.00 3.72 0.03 -4.80 117.46 111.59 2vl4 n PHE 676 Ca 0.00 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 56.96 2vl4 n PHE 676 Cb 0.33 -0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.85 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 0.87 0.62 -0.31 4.37 0.00 -0.96 -4.84 120.51 120.25 2vl4 n ALA 677 Ca 0.15 0.40 0.06 0.00 0.00 0.00 0.00 53.44 54.05 2vl4 n ALA 677 Cb 0.51 -2.17 0.21 0.00 0.00 0.00 0.00 19.45 18.00 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 3.01 0.75 -5.08 0.00 0.11 -1.92 -3.35 132.00 125.51 2vl4 h PRO 678 Ca -0.44 -0.04 -0.65 0.00 0.11 0.00 0.00 66.00 64.97 2vl4 h PRO 678 Cb 1.30 -0.17 -0.27 0.00 0.11 0.00 0.00 31.00 31.98 2vl4 h PRO 678 CO 0.67 0.49 -0.72 0.08 -0.21 0.00 0.00 178.00 178.31 2vl4 s VAL 679 N -5.98 3.40 -0.09 3.15 1.01 -1.26 -0.66 120.40 119.98 2vl4 s VAL 679 Ca -0.12 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.37 2vl4 s VAL 679 Cb 0.21 -2.52 0.02 0.00 0.00 0.00 0.00 36.38 34.08 2vl4 s VAL 679 CO 0.79 0.45 -0.10 -0.22 0.00 0.00 0.00 175.10 176.01 2vl4 s LEU 680 N 1.16 1.46 -0.17 3.92 2.96 -0.21 -4.90 118.68 122.91 2vl4 s LEU 680 Ca 0.02 -0.30 -0.22 0.00 -0.22 0.00 0.00 54.13 53.41 2vl4 s LEU 680 Cb -0.14 -0.84 -0.03 0.00 0.50 0.00 0.00 46.19 45.68 2vl4 s LEU 680 CO -0.01 -0.03 0.67 -0.63 -1.32 0.00 0.00 176.35 175.03 2vl4 s ILE 681 N 1.10 5.01 -0.42 6.68 1.01 -1.26 -1.04 121.20 132.29 2vl4 s ILE 681 Ca -0.06 1.29 0.03 0.00 0.00 0.00 0.00 60.65 61.90 2vl4 s ILE 681 Cb -0.14 -3.98 0.12 0.00 0.01 0.00 0.00 42.46 38.46 2vl4 s ILE 681 CO -0.02 0.13 0.17 0.21 0.00 0.00 0.00 174.94 175.43 2vl4 s ASN 682 N 1.11 4.26 0.08 3.58 3.04 0.42 -4.79 114.94 122.64 2vl4 s ASN 682 Ca 0.31 -2.47 -0.31 0.00 0.04 0.00 0.00 52.86 50.43 2vl4 s ASN 682 Cb -0.16 -1.39 -0.07 0.00 -1.54 0.00 0.00 41.25 38.09 2vl4 s ASN 682 CO 0.12 -0.31 1.31 -2.16 -3.04 0.00 0.00 177.10 173.01 2vl4 s PRO 683 N 0.48 4.36 -0.09 0.43 0.05 -1.26 -0.77 135.00 138.21 2vl4 s PRO 683 Ca 0.14 1.93 0.01 0.00 0.05 0.00 0.00 61.00 63.13 2vl4 s PRO 683 Cb -0.22 -3.32 0.02 0.00 0.05 0.00 0.00 34.50 31.02 2vl4 s PRO 683 CO -0.06 -0.37 -0.10 -1.50 0.05 0.00 0.00 177.00 175.01 2vl4 s ILE 684 N 1.22 1.12 -0.17 0.56 1.10 0.55 -4.99 121.20 120.60 2vl4 s ILE 684 Ca 0.62 -0.41 -0.02 0.00 -0.51 0.00 0.00 60.65 60.32 2vl4 s ILE 684 Cb -0.33 -1.07 -0.02 0.00 0.15 0.00 0.00 42.46 41.19 2vl4 s ILE 684 CO 0.29 0.37 -0.08 -1.58 -2.11 0.00 0.00 174.94 171.83 2vl4 s GLN 685 N 1.14 3.47 -0.08 3.50 0.74 -1.26 -1.39 119.66 125.78 2vl4 s GLN 685 Ca -0.05 -0.62 -0.11 0.00 0.05 0.00 0.00 55.36 54.63 2vl4 s GLN 685 Cb -0.14 -2.83 0.03 0.00 1.10 0.00 0.00 33.01 31.16 2vl4 s GLN 685 CO -0.02 0.10 0.29 -0.65 -0.55 0.00 0.00 175.29 174.46 2vl4 s GLN 686 N 0.70 0.45 -1.45 1.67 -0.21 -0.25 -4.93 119.66 115.63 2vl4 s GLN 686 Ca -0.04 0.18 -0.04 0.00 0.02 0.00 0.00 55.36 55.48 2vl4 s GLN 686 Cb -0.15 0.21 0.03 0.00 1.00 0.00 0.00 33.01 34.10 2vl4 s GLN 686 CO 0.02 -0.09 0.52 0.09 -2.12 0.00 0.00 175.29 173.71 2vl4 n ASN 687 N 2.33 -1.05 -2.25 5.90 5.03 -1.26 -0.97 115.26 122.98 2vl4 n ASN 687 Ca -0.16 -0.99 -0.18 0.00 0.87 0.00 0.00 54.58 54.13 2vl4 n ASN 687 Cb 0.57 -3.10 -0.02 0.00 -1.02 0.00 0.00 39.78 36.21 2vl4 n ASN 687 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 2vl4 n ASP 688 N -2.93 -5.08 -4.09 6.41 2.03 -1.26 -4.98 116.55 106.64 2vl4 n ASP 688 Ca -0.23 0.13 -0.17 0.00 0.52 0.00 0.00 54.79 55.04 2vl4 n ASP 688 Cb 0.65 -4.31 -0.13 0.00 -0.72 0.00 0.00 41.12 36.61 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 -2.12 1.24 -0.14 1.67 0.15 -0.15 -0.82 113.70 113.53 2vl4 s SER 689 Ca 0.00 -0.43 -0.04 0.00 0.70 0.00 0.00 55.95 56.18 2vl4 s SER 689 Cb 0.00 -0.05 -0.03 0.00 -1.71 0.00 0.00 66.02 64.22 2vl4 s SER 689 CO 0.00 -0.04 0.01 -0.22 1.20 0.00 0.00 173.24 174.20 2vl4 s LEU 690 N -1.12 3.57 0.06 3.45 2.96 0.06 -1.09 118.68 126.58 2vl4 s LEU 690 Ca -0.02 0.04 0.08 0.00 -0.22 0.00 0.00 54.13 54.01 2vl4 s LEU 690 Cb -0.08 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 44.73 2vl4 s LEU 690 CO 0.01 0.25 -0.22 -0.44 -1.32 0.00 0.00 176.35 174.63 2vl4 s SER 691 N -0.08 2.59 -0.14 3.68 0.01 -0.49 -1.00 113.70 118.28 2vl4 s SER 691 Ca 0.04 -0.58 0.02 0.00 1.31 0.00 0.00 55.95 56.74 2vl4 s SER 691 Cb -0.13 -0.20 0.01 0.00 0.21 0.00 0.00 66.02 65.92 2vl4 s SER 691 CO 0.02 0.14 -0.21 -0.69 0.41 0.00 0.00 173.24 172.91 2vl4 s VAL 692 N -0.91 1.98 -0.03 3.43 1.01 0.09 -0.33 120.40 125.64 2vl4 s VAL 692 Ca 0.08 -0.93 0.03 0.00 0.00 0.00 0.00 61.98 61.15 2vl4 s VAL 692 Cb -0.09 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.50 2vl4 s VAL 692 CO 0.03 0.54 -0.10 -0.31 0.00 0.00 0.00 175.10 175.26 2vl4 s TYR 693 N 0.83 2.83 -0.20 5.22 2.02 0.05 -0.92 117.35 127.19 2vl4 s TYR 693 Ca -0.07 -0.06 -0.06 0.00 -0.37 0.00 0.00 57.07 56.51 2vl4 s TYR 693 Cb -0.15 -1.64 -0.03 0.00 -0.40 0.00 0.00 41.96 39.73 2vl4 s TYR 693 CO -0.02 0.30 0.03 -0.51 -1.57 0.00 0.00 175.55 173.78 2vl4 s LEU 694 N -1.01 3.44 -0.11 -1.29 1.43 -0.05 -0.44 118.68 120.65 2vl4 s LEU 694 Ca 0.14 -0.12 0.03 0.00 -1.03 0.00 0.00 54.13 53.14 2vl4 s LEU 694 Cb -0.11 -1.88 0.01 0.00 0.03 0.00 0.00 46.19 44.24 2vl4 s LEU 694 CO 0.03 0.08 -0.21 -0.63 0.23 0.00 0.00 176.35 175.86 2vl4 s ILE 695 N 0.91 1.86 -0.03 -0.59 1.01 -0.20 -1.27 121.20 122.89 2vl4 s ILE 695 Ca 0.02 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 59.80 2vl4 s ILE 695 Cb -0.14 -1.64 0.01 0.00 0.01 0.00 0.00 42.46 40.70 2vl4 s ILE 695 CO 0.02 0.51 -0.06 -0.55 0.00 0.00 0.00 174.94 174.87 2vl4 s SER 696 N 0.62 0.94 -0.11 3.58 0.15 0.09 -1.04 113.70 117.92 2vl4 s SER 696 Ca -0.13 -0.14 0.15 0.00 0.70 0.00 0.00 55.95 56.54 2vl4 s SER 696 Cb -0.17 -0.35 0.55 0.00 -1.71 0.00 0.00 66.02 64.34 2vl4 s SER 696 CO 0.03 -0.00 1.46 0.47 1.20 0.00 0.00 173.24 176.40 2vl4 n ASP 697 N 3.66 4.02 -4.81 5.45 8.00 0.17 -1.60 116.55 131.44 2vl4 n ASP 697 Ca -0.22 -2.57 -0.33 0.00 0.71 0.00 0.00 54.79 52.39 2vl4 n ASP 697 Cb 0.53 -0.48 0.01 0.00 -0.02 0.00 0.00 41.12 41.16 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 -2.04 3.37 0.27 -1.24 0.52 -1.26 -4.70 118.95 113.86 2vl4 s ARG 698 Ca 0.41 1.18 0.24 0.00 -0.52 0.00 0.00 55.73 57.04 2vl4 s ARG 698 Cb 0.28 -2.04 0.45 0.00 0.52 0.00 0.00 34.95 34.16 2vl4 s ARG 698 CO 0.16 -0.77 1.53 -0.07 0.02 0.00 0.00 175.30 176.17 2vl4 h LEU 699 N 0.47 0.00 -9.71 2.53 3.38 -1.95 -2.38 115.31 107.65 2vl4 h LEU 699 Ca -0.47 -0.04 -0.65 0.00 0.09 0.00 0.00 57.88 56.81 2vl4 h LEU 699 Cb 1.22 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.90 2vl4 h LEU 699 CO 0.58 0.02 -0.51 1.51 0.09 0.00 0.00 178.44 180.13 2vl4 s ASP 700 N -5.14 6.22 0.44 -0.43 -4.77 -1.26 -4.76 116.67 106.97 2vl4 s ASP 700 Ca 0.07 0.33 -0.21 0.00 -3.30 0.00 0.00 52.55 49.44 2vl4 s ASP 700 Cb 0.10 -1.93 -0.10 0.00 -1.09 0.00 0.00 42.92 39.90 2vl4 s ASP 700 CO 0.67 0.30 1.00 -0.89 0.70 0.00 0.00 175.17 176.95 2vl4 s THR 701 N -1.23 4.07 -0.08 2.11 2.01 -1.26 -3.88 115.64 117.38 2vl4 s THR 701 Ca 0.24 1.34 0.01 0.00 0.31 0.00 0.00 61.69 63.59 2vl4 s THR 701 Cb -0.12 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.79 2vl4 s THR 701 CO 0.14 -0.23 -0.10 -0.04 -0.69 0.00 0.00 174.62 173.71 2vl4 s MET 702 N -3.06 2.84 0.14 4.92 -1.94 -0.24 -4.91 119.30 117.05 2vl4 s MET 702 Ca 0.63 -0.61 0.08 0.00 -1.71 0.00 0.00 55.69 54.09 2vl4 s MET 702 Cb -0.14 -2.56 -0.04 0.00 2.01 0.00 0.00 34.83 34.10 2vl4 s MET 702 CO 0.18 0.56 -0.19 -1.21 -0.01 0.00 0.00 175.02 174.35 2vl4 s GLU 703 N -0.53 1.21 -1.35 2.03 2.02 -1.26 0.03 118.70 120.85 2vl4 s GLU 703 Ca 0.08 -1.32 -0.02 0.00 0.02 0.00 0.00 54.97 53.73 2vl4 s GLU 703 Cb -0.12 -1.34 -0.00 0.00 0.10 0.00 0.00 34.13 32.77 2vl4 s GLU 703 CO 0.02 0.28 0.55 1.04 0.02 0.00 0.00 175.26 177.17 2vl4 n GLN 704 N 0.57 -3.67 -3.38 1.61 6.02 -1.01 -4.47 117.38 113.05 2vl4 n GLN 704 Ca -0.15 0.49 -0.29 0.00 -0.01 0.00 0.00 57.00 57.03 2vl4 n GLN 704 Cb 0.56 -4.72 -0.04 0.00 1.02 0.00 0.00 30.24 27.06 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 -6.29 3.66 -0.11 -1.09 -1.94 0.55 -2.39 119.30 111.69 2vl4 s MET 705 Ca 0.04 0.05 0.03 0.00 -1.71 0.00 0.00 55.69 54.10 2vl4 s MET 705 Cb -0.02 -2.66 -0.00 0.00 2.01 0.00 0.00 34.83 34.16 2vl4 s MET 705 CO 0.86 0.25 -0.21 0.99 -0.01 0.00 0.00 175.02 176.90 2vl4 s THR 706 N -2.00 2.27 -0.22 2.05 2.01 0.12 -0.66 115.64 119.21 2vl4 s THR 706 Ca 0.44 -0.94 -0.13 0.00 0.31 0.00 0.00 61.69 61.37 2vl4 s THR 706 Cb -0.11 -1.89 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 2vl4 s THR 706 CO 0.28 0.55 0.29 -0.22 -0.69 0.00 0.00 174.62 174.82 2vl4 s LEU 707 N 0.40 4.13 -0.10 4.42 2.96 0.59 -0.77 118.68 130.31 2vl4 s LEU 707 Ca -0.16 0.32 0.03 0.00 -0.22 0.00 0.00 54.13 54.10 2vl4 s LEU 707 Cb -0.17 -2.32 0.01 0.00 0.50 0.00 0.00 46.19 44.20 2vl4 s LEU 707 CO 0.07 -0.01 -0.20 -0.70 -1.32 0.00 0.00 176.35 174.18 2vl4 s GLU 708 N 1.21 2.68 -0.02 1.98 2.12 -0.05 -0.60 118.70 126.02 2vl4 s GLU 708 Ca 0.14 -0.75 0.05 0.00 0.36 0.00 0.00 54.97 54.76 2vl4 s GLU 708 Cb -0.14 -2.08 -0.01 0.00 0.26 0.00 0.00 34.13 32.16 2vl4 s GLU 708 CO 0.06 0.11 -0.16 -1.64 -0.54 0.00 0.00 175.26 173.09 2vl4 s MET 709 N 0.51 1.37 0.01 4.30 -1.94 -0.38 -0.50 119.30 122.67 2vl4 s MET 709 Ca -0.16 -0.57 -0.00 0.00 -1.71 0.00 0.00 55.69 53.25 2vl4 s MET 709 Cb -0.17 -1.29 -0.01 0.00 2.01 0.00 0.00 34.83 35.36 2vl4 s MET 709 CO 0.06 0.32 -0.01 -1.59 -0.01 0.00 0.00 175.02 173.78 2vl4 s LYS 710 N -0.27 0.22 -0.08 2.03 -2.85 -0.35 -1.09 119.74 117.35 2vl4 s LYS 710 Ca 0.04 -0.41 -0.25 0.00 -1.00 0.00 0.00 55.97 54.35 2vl4 s LYS 710 Cb -0.07 0.08 -0.03 0.00 -2.06 0.00 0.00 37.83 35.75 2vl4 s LYS 710 CO -0.00 -0.04 0.76 0.08 0.10 0.00 0.00 175.35 176.26 2vl4 s VAL 711 N -1.00 4.99 -0.06 1.79 1.01 -1.26 -1.01 120.40 124.85 2vl4 s VAL 711 Ca -0.11 1.56 0.03 0.00 0.00 0.00 0.00 61.98 63.46 2vl4 s VAL 711 Cb -0.07 -4.10 0.01 0.00 0.00 0.00 0.00 36.38 32.22 2vl4 s VAL 711 CO -0.01 0.19 -0.16 -0.69 0.00 0.00 0.00 175.10 174.43 2vl4 s VAL 712 N 1.14 1.41 0.84 2.92 1.01 -0.21 -0.38 120.40 127.12 2vl4 s VAL 712 Ca 0.39 -0.66 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 2vl4 s VAL 712 Cb -0.18 -1.24 0.10 0.00 0.00 0.00 0.00 36.38 35.06 2vl4 s VAL 712 CO 0.18 0.41 1.14 1.51 0.00 0.00 0.00 175.10 178.34 2vl4 s ASP 713 N 0.39 4.19 0.00 3.32 1.47 0.45 -0.61 116.67 125.87 2vl4 s ASP 713 Ca -0.12 0.98 0.04 0.00 1.18 0.00 0.00 52.55 54.63 2vl4 s ASP 713 Cb -0.15 -1.57 0.23 0.00 -0.34 0.00 0.00 42.92 41.08 2vl4 s ASP 713 CO 0.04 -2.12 0.92 0.49 0.68 0.00 0.00 175.17 175.18 2vl4 n PHE 714 N -3.49 0.00 0.86 2.11 3.72 -0.98 -0.80 117.46 118.88 2vl4 n PHE 714 Ca 0.07 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.57 2vl4 n PHE 714 Cb 0.59 -0.23 0.04 0.00 -0.94 0.00 0.00 39.48 38.94 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 -1.23 2.22 0.00 4.37 8.00 -1.26 -1.42 116.55 127.23 2vl4 n ASP 715 Ca 0.02 -1.61 0.00 0.00 0.71 0.00 0.00 54.79 53.91 2vl4 n ASP 715 Cb 0.03 0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.40 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 1.23 0.68 3.72 0.44 0.00 0.02 -4.83 105.19 106.45 2vl4 n GLY 716 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.96 4.49 0.16 1.61 2.20 -1.26 -4.80 119.74 121.18 2vl4 s LYS 717 Ca 0.00 1.08 -0.30 0.00 -0.36 0.00 0.00 55.97 56.39 2vl4 s LYS 717 Cb 0.00 -3.44 -0.08 0.00 -1.51 0.00 0.00 37.83 32.81 2vl4 s LYS 717 CO 0.00 0.06 1.20 0.99 -0.36 0.00 0.00 175.35 177.24 2vl4 s THR 718 N 0.73 3.67 -0.23 3.43 2.01 -1.26 -0.41 115.64 123.57 2vl4 s THR 718 Ca 0.42 1.35 -0.09 0.00 0.31 0.00 0.00 61.69 63.69 2vl4 s THR 718 Cb -0.19 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 2vl4 s THR 718 CO 0.22 0.19 0.10 -0.76 -0.69 0.00 0.00 174.62 173.69 2vl4 s LEU 719 N 0.04 3.82 0.00 4.42 1.43 0.49 -4.92 118.68 123.95 2vl4 s LEU 719 Ca 0.54 0.00 0.00 0.00 -1.03 0.00 0.00 54.13 53.64 2vl4 s LEU 719 Cb -0.32 -2.01 0.00 0.00 0.03 0.00 0.00 46.19 43.89 2vl4 s LEU 719 CO 0.35 0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.60 2vl4 n GLY 720 N 4.27 -0.20 3.98 -3.19 0.00 -1.26 -4.32 105.19 104.47 2vl4 n GLY 720 Ca -0.16 -1.02 -0.20 0.00 0.00 0.00 0.00 46.02 44.64 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 3.02 0.67 1.61 2.20 -1.26 -4.97 119.74 121.01 2vl4 s LYS 721 Ca 0.00 -0.82 -0.17 0.00 -0.36 0.00 0.00 55.97 54.62 2vl4 s LYS 721 Cb 0.00 -2.69 -0.01 0.00 -1.51 0.00 0.00 37.83 33.62 2vl4 s LYS 721 CO 0.00 -0.15 1.13 1.63 -0.36 0.00 0.00 175.35 177.59 2vl4 n LYS 722 N -1.88 0.83 -4.60 4.03 5.02 -1.26 -4.75 118.16 115.55 2vl4 n LYS 722 Ca 0.02 0.34 -0.33 0.00 -2.02 0.00 0.00 58.31 56.31 2vl4 n LYS 722 Cb 0.58 -2.36 -0.13 0.00 -0.02 0.00 0.00 35.03 33.10 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 -1.58 3.48 -0.06 -0.18 1.01 -0.25 -5.00 121.20 118.61 2vl4 s ILE 723 Ca 0.78 -0.51 0.03 0.00 0.00 0.00 0.00 60.65 60.95 2vl4 s ILE 723 Cb -0.37 -2.49 0.01 0.00 0.01 0.00 0.00 42.46 39.62 2vl4 s ILE 723 CO 0.45 0.52 -0.15 -1.10 0.00 0.00 0.00 174.94 174.66 2vl4 s GLN 724 N 0.24 1.85 -0.23 2.79 -0.21 -1.26 -1.25 119.66 121.59 2vl4 s GLN 724 Ca -0.06 -0.53 0.02 0.00 0.02 0.00 0.00 55.36 54.81 2vl4 s GLN 724 Cb -0.15 -1.53 0.05 0.00 1.00 0.00 0.00 33.01 32.38 2vl4 s GLN 724 CO 0.04 0.12 -0.12 0.08 -2.12 0.00 0.00 175.29 173.30 2vl4 s VAL 725 N 0.39 1.96 0.44 1.09 1.01 0.23 -4.99 120.40 120.51 2vl4 s VAL 725 Ca -0.11 -1.32 0.08 0.00 0.00 0.00 0.00 61.98 60.63 2vl4 s VAL 725 Cb -0.14 -2.02 0.01 0.00 0.00 0.00 0.00 36.38 34.23 2vl4 s VAL 725 CO 0.04 0.11 0.55 -1.00 0.00 0.00 0.00 175.10 174.80 2vl4 s HIS 726 N 1.23 2.64 -1.28 5.22 3.76 -1.26 -0.30 115.29 125.30 2vl4 s HIS 726 Ca -0.04 -0.45 -0.02 0.00 -0.15 0.00 0.00 55.06 54.39 2vl4 s HIS 726 Cb -0.18 -2.32 0.00 0.00 1.11 0.00 0.00 32.58 31.19 2vl4 s HIS 726 CO -0.07 -0.44 0.28 0.43 -0.85 0.00 0.00 174.74 174.09 2vl4 n SER 727 N -1.83 -5.00 -4.83 1.40 7.64 -0.95 -4.93 113.62 105.13 2vl4 n SER 727 Ca 0.08 -0.14 -0.38 0.00 1.01 0.00 0.00 58.87 59.44 2vl4 n SER 727 Cb 0.60 -3.96 -0.06 0.00 -1.01 0.00 0.00 64.21 59.78 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 -5.03 4.47 -0.06 -3.43 1.43 0.16 -4.77 118.68 111.44 2vl4 s LEU 728 Ca 0.14 1.13 0.01 0.00 -1.03 0.00 0.00 54.13 54.38 2vl4 s LEU 728 Cb -0.06 -2.89 -0.03 0.00 0.03 0.00 0.00 46.19 43.24 2vl4 s LEU 728 CO 0.17 0.25 -0.08 -0.70 0.23 0.00 0.00 176.35 176.22 2vl4 s GLU 729 N -1.30 2.70 -0.54 1.70 2.12 -1.26 -0.33 118.70 121.79 2vl4 s GLU 729 Ca 0.29 -0.58 0.04 0.00 0.36 0.00 0.00 54.97 55.09 2vl4 s GLU 729 Cb -0.18 -2.55 0.13 0.00 0.26 0.00 0.00 34.13 31.80 2vl4 s GLU 729 CO 0.17 0.66 0.29 0.08 -0.54 0.00 0.00 175.26 175.92 2vl4 s VAL 730 N -0.79 2.65 0.54 3.70 1.01 0.10 -4.98 120.40 122.64 2vl4 s VAL 730 Ca 0.12 -3.41 -0.22 0.00 0.00 0.00 0.00 61.98 58.47 2vl4 s VAL 730 Cb -0.11 -2.83 -0.05 0.00 0.00 0.00 0.00 36.38 33.39 2vl4 s VAL 730 CO 0.01 -0.82 1.33 -2.84 0.00 0.00 0.00 175.10 172.78 2vl4 s PRO 731 N -0.41 3.19 0.25 2.72 0.02 -1.26 -1.08 135.00 138.43 2vl4 s PRO 731 Ca 0.18 2.17 -0.30 0.00 0.02 0.00 0.00 61.00 63.07 2vl4 s PRO 731 Cb -0.24 -2.26 -0.14 0.00 0.02 0.00 0.00 34.50 31.88 2vl4 s PRO 731 CO -0.02 -1.13 1.10 0.00 -0.33 0.00 0.00 177.00 176.63 2vl4 n ALA 732 N -1.00 -0.20 -3.70 -1.55 0.00 -1.25 -3.26 120.51 109.54 2vl4 n ALA 732 Ca 0.10 0.41 -0.22 0.00 0.00 0.00 0.00 53.44 53.74 2vl4 n ALA 732 Cb 0.45 -2.05 0.04 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 1.54 -1.61 -4.03 0.00 3.02 -0.80 -4.97 115.26 108.40 2vl4 n ASN 733 Ca 0.11 -0.80 -0.08 0.00 -0.03 0.00 0.00 54.58 53.78 2vl4 n ASN 733 Cb 0.30 -4.12 -0.09 0.00 -0.61 0.00 0.00 39.78 35.25 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 -3.61 0.16 -0.12 3.41 -4.23 -0.63 -4.99 115.64 105.63 2vl4 s THR 734 Ca 0.07 -1.63 0.01 0.00 -1.18 0.00 0.00 61.69 58.96 2vl4 s THR 734 Cb -0.03 -1.61 0.02 0.00 1.34 0.00 0.00 72.50 72.22 2vl4 s THR 734 CO 0.81 -0.74 -0.14 -0.55 -0.54 0.00 0.00 174.62 173.46 2vl4 s SER 735 N -2.93 2.46 -0.01 3.99 0.15 -1.26 -0.74 113.70 115.36 2vl4 s SER 735 Ca 0.11 -0.42 0.01 0.00 0.70 0.00 0.00 55.95 56.35 2vl4 s SER 735 Cb 0.07 -1.07 -0.00 0.00 -1.71 0.00 0.00 66.02 63.30 2vl4 s SER 735 CO -0.07 -0.03 -0.04 -0.54 1.20 0.00 0.00 173.24 173.76 2vl4 s LYS 736 N 1.25 0.36 -0.10 5.44 1.02 -0.39 -4.97 119.74 122.33 2vl4 s LYS 736 Ca -0.01 -0.14 -0.30 0.00 0.02 0.00 0.00 55.97 55.54 2vl4 s LYS 736 Cb -0.14 -0.36 -0.02 0.00 -0.52 0.00 0.00 37.83 36.79 2vl4 s LYS 736 CO -0.05 0.08 1.24 0.00 -0.92 0.00 0.00 175.35 175.69 2vl4 n VAL 738 N 4.97 0.00 -3.64 0.00 0.24 -0.10 -4.99 118.33 114.82 2vl4 n VAL 738 Ca 0.12 -0.41 -0.07 0.00 -2.04 0.00 0.00 64.34 61.94 2vl4 n VAL 738 Cb 0.45 1.07 -0.07 0.00 -1.47 0.00 0.00 33.84 33.82 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 -1.21 -0.58 -0.05 6.34 5.04 -1.22 -4.99 117.35 120.69 2vl4 s TYR 739 Ca 0.05 1.29 -0.02 0.00 -2.44 0.00 0.00 57.07 55.94 2vl4 s TYR 739 Cb 0.06 0.38 0.03 0.00 0.35 0.00 0.00 41.96 42.77 2vl4 s TYR 739 CO 0.20 -0.28 0.10 0.50 -1.34 0.00 0.00 175.55 174.73 2vl4 s ARG 740 N 0.72 0.07 -0.14 4.97 3.52 -1.26 -0.73 118.95 126.10 2vl4 s ARG 740 Ca -0.02 0.25 -0.09 0.00 -0.13 0.00 0.00 55.73 55.74 2vl4 s ARG 740 Cb -0.05 -0.12 0.05 0.00 -1.56 0.00 0.00 34.95 33.27 2vl4 s ARG 740 CO -0.10 -0.12 0.35 0.00 -0.81 0.00 0.00 175.30 174.62 2vl4 s ALA 741 N 0.79 -0.86 0.50 6.12 0.00 -0.17 -5.01 121.76 123.13 2vl4 s ALA 741 Ca -0.06 1.24 -0.21 0.00 0.00 0.00 0.00 51.96 52.93 2vl4 s ALA 741 Cb -0.08 -0.75 -0.07 0.00 0.00 0.00 0.00 23.12 22.22 2vl4 s ALA 741 CO -0.03 -0.22 1.12 -1.59 0.00 0.00 0.00 175.76 175.04 2vl4 s LYS 742 N 1.06 3.57 0.20 0.00 -2.85 -1.26 -0.76 119.74 119.70 2vl4 s LYS 742 Ca -0.07 1.61 0.04 0.00 -1.00 0.00 0.00 55.97 56.55 2vl4 s LYS 742 Cb -0.07 -2.15 0.12 0.00 -2.06 0.00 0.00 37.83 33.66 2vl4 s LYS 742 CO -0.08 -0.67 1.47 -0.07 0.10 0.00 0.00 175.35 176.09 2vl4 h LEU 743 N 1.54 0.25 -9.17 2.77 3.38 -1.34 -3.41 115.31 109.34 2vl4 h LEU 743 Ca -0.50 -0.18 -0.55 0.00 0.09 0.00 0.00 57.88 56.74 2vl4 h LEU 743 Cb 1.25 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 2vl4 h LEU 743 CO 0.58 0.91 1.20 -0.62 0.09 0.00 0.00 178.44 180.60 2vl4 s ASP 744 N -6.91 6.34 0.00 -0.43 2.15 -1.26 -0.51 116.67 116.05 2vl4 s ASP 744 Ca -0.03 2.10 0.00 0.00 0.43 0.00 0.00 52.55 55.05 2vl4 s ASP 744 Cb 0.11 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 2vl4 s ASP 744 CO 0.81 -1.21 0.00 0.61 -0.17 0.00 0.00 175.17 175.21 2vl4 n GLY 745 N 4.64 0.71 0.49 2.66 0.00 -1.26 -4.87 105.19 107.56 2vl4 n GLY 745 Ca 0.20 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.16 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 -4.95 1.61 -0.00 -0.36 -5.04 117.44 106.70 2vl4 n TRP 746 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 57.50 57.22 2vl4 n TRP 746 Cb 0.00 -0.32 -0.16 0.00 -0.00 0.00 0.00 31.31 30.83 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 -7.47 1.94 0.62 5.87 1.43 0.33 -5.12 118.68 116.27 2vl4 s LEU 747 Ca -0.17 -0.41 -0.14 0.00 -1.03 0.00 0.00 54.13 52.37 2vl4 s LEU 747 Cb 0.03 -1.11 -0.02 0.00 0.03 0.00 0.00 46.19 45.11 2vl4 s LEU 747 CO 0.25 0.15 1.05 0.42 0.23 0.00 0.00 176.35 178.46 2vl4 s THR 748 N 0.15 4.01 0.51 5.49 -4.23 -1.26 -4.53 115.64 115.78 2vl4 s THR 748 Ca -0.08 0.83 0.23 0.00 -1.18 0.00 0.00 61.69 61.49 2vl4 s THR 748 Cb -0.14 -3.45 0.39 0.00 1.34 0.00 0.00 72.50 70.65 2vl4 s THR 748 CO 0.04 -0.69 1.97 -0.65 -0.54 0.00 0.00 174.62 174.75 2vl4 h PRO 749 N 0.03 0.10 -0.12 3.99 0.11 -1.99 -1.41 132.00 132.69 2vl4 h PRO 749 Ca -0.46 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 2vl4 h PRO 749 Cb 1.21 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2vl4 h PRO 749 CO 0.58 0.06 0.01 0.93 -0.21 0.00 0.00 178.00 179.37 2vl4 h GLU 750 N 0.10 0.20 -0.88 1.05 3.07 -2.00 -3.07 114.58 113.05 2vl4 h GLU 750 Ca 0.29 -0.06 0.14 0.00 -0.50 0.00 0.00 59.36 59.22 2vl4 h GLU 750 Cb 1.01 -0.02 -0.09 0.00 -0.84 0.00 0.00 28.75 28.81 2vl4 h GLU 750 CO -0.03 0.43 0.49 -0.44 -1.40 0.00 0.00 179.01 178.06 2vl4 h ASP 751 N -0.05 0.65 0.16 1.42 3.32 -1.66 -2.00 116.42 118.26 2vl4 h ASP 751 Ca 0.03 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 2vl4 h ASP 751 Cb 0.33 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 2vl4 h ASP 751 CO 0.00 0.30 -0.05 0.00 -1.72 0.00 0.00 179.24 177.78 2vl4 n ARG 753 N -3.71 0.63 -0.08 0.00 1.74 -0.76 -3.99 116.66 110.49 2vl4 n ARG 753 Ca -0.02 -0.38 0.01 0.00 -0.77 0.00 0.00 57.85 56.68 2vl4 n ARG 753 Cb 0.15 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.11 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 -0.85 0.76 -4.03 5.56 1.74 -0.72 -0.85 116.66 118.27 2vl4 n ARG 754 Ca 0.10 -0.93 -0.11 0.00 -0.77 0.00 0.00 57.85 56.15 2vl4 n ARG 754 Cb 0.35 -0.67 -0.05 0.00 -1.02 0.00 0.00 32.46 31.06 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 -0.55 0.17 0.11 0.55 1.04 -0.89 -2.33 113.70 111.80 2vl4 s SER 755 Ca 0.02 -1.12 -0.01 0.00 0.48 0.00 0.00 55.95 55.33 2vl4 s SER 755 Cb 0.02 0.60 -0.04 0.00 0.10 0.00 0.00 66.02 66.69 2vl4 s SER 755 CO 0.00 -1.17 0.03 0.72 0.98 0.00 0.00 173.24 173.79 2vl4 s PHE 756 N -3.73 0.78 -0.19 5.02 -0.12 0.22 -4.52 117.98 115.44 2vl4 s PHE 756 Ca 0.26 -1.17 -0.07 0.00 -0.05 0.00 0.00 56.93 55.89 2vl4 s PHE 756 Cb -0.00 -0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 41.88 2vl4 s PHE 756 CO 0.12 -0.46 0.06 -1.17 -0.05 0.00 0.00 175.22 173.73 2vl4 s LEU 757 N -3.02 3.75 -0.17 -1.99 2.96 0.00 -1.04 118.68 119.18 2vl4 s LEU 757 Ca 0.19 0.03 -0.08 0.00 -0.22 0.00 0.00 54.13 54.05 2vl4 s LEU 757 Cb 0.08 -1.96 -0.05 0.00 0.50 0.00 0.00 46.19 44.76 2vl4 s LEU 757 CO -0.02 0.14 0.12 -0.75 -1.32 0.00 0.00 176.35 174.52 2vl4 s LYS 758 N 0.60 3.88 -0.06 1.98 2.47 -0.18 -0.94 119.74 127.49 2vl4 s LYS 758 Ca 0.03 -0.21 0.02 0.00 -1.56 0.00 0.00 55.97 54.25 2vl4 s LYS 758 Cb -0.13 -3.30 0.02 0.00 -1.46 0.00 0.00 37.83 32.96 2vl4 s LYS 758 CO 0.01 0.47 -0.10 -0.51 0.16 0.00 0.00 175.35 175.38 2vl4 s LEU 759 N -0.14 1.55 0.03 5.43 1.02 -0.50 -1.21 118.68 124.86 2vl4 s LEU 759 Ca 0.10 -0.25 0.04 0.00 0.02 0.00 0.00 54.13 54.04 2vl4 s LEU 759 Cb -0.11 -0.73 -0.02 0.00 0.02 0.00 0.00 46.19 45.35 2vl4 s LEU 759 CO 0.00 0.01 -0.13 0.27 0.02 0.00 0.00 176.35 176.52 2vl4 s ILE 760 N 0.75 0.99 -0.18 -0.59 -4.36 0.34 -0.56 121.20 117.59 2vl4 s ILE 760 Ca -0.13 -0.87 -0.04 0.00 -0.26 0.00 0.00 60.65 59.35 2vl4 s ILE 760 Cb -0.15 -0.89 -0.02 0.00 1.25 0.00 0.00 42.46 42.64 2vl4 s ILE 760 CO 0.02 0.03 -0.04 -0.22 0.24 0.00 0.00 174.94 174.97 2vl4 s LEU 761 N -0.96 3.08 0.04 0.37 2.96 -0.01 -0.87 118.68 123.30 2vl4 s LEU 761 Ca 0.01 -0.25 0.09 0.00 -0.22 0.00 0.00 54.13 53.76 2vl4 s LEU 761 Cb -0.07 -1.76 -0.03 0.00 0.50 0.00 0.00 46.19 44.83 2vl4 s LEU 761 CO 0.01 0.09 -0.25 -0.54 -1.32 0.00 0.00 176.35 174.34 2vl4 s LYS 762 N 0.85 1.68 0.93 1.98 1.02 0.05 0.05 119.74 126.30 2vl4 s LYS 762 Ca -0.01 -1.06 -0.12 0.00 0.02 0.00 0.00 55.97 54.80 2vl4 s LYS 762 Cb -0.15 -1.83 0.15 0.00 -0.52 0.00 0.00 37.83 35.48 2vl4 s LYS 762 CO 0.01 0.47 1.13 0.16 -0.92 0.00 0.00 175.35 176.21 2vl4 s ASP 763 N -1.21 3.31 0.45 2.83 1.47 0.10 -0.70 116.67 122.91 2vl4 s ASP 763 Ca 0.10 1.00 0.25 0.00 1.18 0.00 0.00 52.55 55.08 2vl4 s ASP 763 Cb -0.10 -1.59 1.26 0.00 -0.34 0.00 0.00 42.92 42.15 2vl4 s ASP 763 CO 0.02 -2.68 1.78 0.07 0.68 0.00 0.00 175.17 175.04 2vl4 h LYS 764 N -1.58 0.24 0.00 2.11 5.09 -1.69 0.37 116.57 121.11 2vl4 h LYS 764 Ca -0.51 -0.01 0.00 0.00 0.09 0.00 0.00 60.65 60.21 2vl4 h LYS 764 Cb 1.33 -0.05 0.00 0.00 0.10 0.00 0.00 32.23 33.61 2vl4 h LYS 764 CO 0.61 0.16 -0.03 -1.13 -2.09 0.00 0.00 179.45 176.97 2vl4 n SER 765 N -4.49 0.16 0.00 7.07 3.41 -1.26 -4.91 113.62 113.60 2vl4 n SER 765 Ca 0.26 0.48 0.00 0.00 -0.26 0.00 0.00 58.87 59.34 2vl4 n SER 765 Cb 1.01 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 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 1.47 0.84 3.73 5.00 0.00 0.13 -5.07 105.19 111.28 2vl4 n GLY 766 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.05 3.70 -0.04 1.61 5.65 -1.26 -4.78 115.29 118.11 2vl4 s HIS 767 Ca 0.00 1.68 -0.30 0.00 0.25 0.00 0.00 55.06 56.69 2vl4 s HIS 767 Cb 0.00 -3.16 -0.04 0.00 -1.18 0.00 0.00 32.58 28.20 2vl4 s HIS 767 CO 0.00 -0.19 1.22 -1.14 -0.65 0.00 0.00 174.74 173.98 2vl4 s GLN 768 N 0.14 4.35 -0.09 2.88 0.74 -1.26 -0.73 119.66 125.69 2vl4 s GLN 768 Ca 0.49 1.71 0.15 0.00 0.05 0.00 0.00 55.36 57.76 2vl4 s GLN 768 Cb -0.25 -3.54 -0.22 0.00 1.10 0.00 0.00 33.01 30.10 2vl4 s GLN 768 CO 0.31 -0.44 0.20 0.28 -0.55 0.00 0.00 175.29 175.08 2vl4 n VAL 769 N 4.56 0.56 -3.47 1.34 0.31 0.11 -4.96 118.33 116.78 2vl4 n VAL 769 Ca 0.11 -0.52 -0.14 0.00 -0.01 0.00 0.00 64.34 63.77 2vl4 n VAL 769 Cb 0.46 -0.26 -0.04 0.00 -0.91 0.00 0.00 33.84 33.09 2vl4 n VAL 769 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2vl4 s ALA 770 N -2.73 -1.69 0.05 3.52 0.00 -1.16 -4.94 121.76 114.81 2vl4 s ALA 770 Ca -0.07 0.90 -0.02 0.00 0.00 0.00 0.00 51.96 52.77 2vl4 s ALA 770 Cb 0.07 0.44 -0.03 0.00 0.00 0.00 0.00 23.12 23.60 2vl4 s ALA 770 CO 0.65 -0.58 0.01 -1.83 0.00 0.00 0.00 175.76 174.01 2vl4 s GLU 771 N -2.55 0.63 0.22 0.00 -1.05 -1.26 -0.83 118.70 113.86 2vl4 s GLU 771 Ca -0.04 -1.12 -0.11 0.00 -0.15 0.00 0.00 54.97 53.55 2vl4 s GLU 771 Cb -0.01 0.23 -0.01 0.00 -0.44 0.00 0.00 34.13 33.90 2vl4 s GLU 771 CO -0.03 -0.13 0.40 -1.12 0.95 0.00 0.00 175.26 175.33 2vl4 s SER 772 N -2.78 -0.05 -0.02 0.83 0.01 0.27 -4.77 113.70 107.20 2vl4 s SER 772 Ca 0.05 -0.93 0.03 0.00 1.31 0.00 0.00 55.95 56.40 2vl4 s SER 772 Cb 0.06 0.53 -0.00 0.00 0.21 0.00 0.00 66.02 66.82 2vl4 s SER 772 CO -0.09 -1.05 -0.09 -0.69 0.41 0.00 0.00 173.24 171.73 2vl4 s VAL 773 N -4.01 0.76 -0.05 3.43 1.01 -1.26 -1.42 120.40 118.86 2vl4 s VAL 773 Ca 0.22 -0.38 0.04 0.00 0.00 0.00 0.00 61.98 61.86 2vl4 s VAL 773 Cb 0.01 -0.66 0.00 0.00 0.00 0.00 0.00 36.38 35.73 2vl4 s VAL 773 CO 0.06 0.23 -0.16 -2.28 0.00 0.00 0.00 175.10 172.96 2vl4 s HIS 774 N 0.00 1.63 -0.05 5.22 2.46 -0.11 -4.97 115.29 119.47 2vl4 s HIS 774 Ca 0.00 -0.52 -0.03 0.00 0.47 0.00 0.00 55.06 54.98 2vl4 s HIS 774 Cb -0.06 -1.12 -0.04 0.00 -0.13 0.00 0.00 32.58 31.23 2vl4 s HIS 774 CO 0.00 -0.21 0.12 -0.06 -2.47 0.00 0.00 174.74 172.12 2vl4 s PHE 775 N 0.24 3.44 -1.53 3.88 0.08 -1.26 -0.82 117.98 122.01 2vl4 s PHE 775 Ca -0.08 0.34 0.25 0.00 0.12 0.00 0.00 56.93 57.57 2vl4 s PHE 775 Cb -0.13 -1.83 0.51 0.00 -0.57 0.00 0.00 43.02 41.01 2vl4 s PHE 775 CO 0.03 0.62 1.41 1.19 -0.10 0.00 0.00 175.22 178.38 2vl4 n PHE 776 N 1.48 0.00 -4.12 0.36 3.72 -1.26 -4.92 117.46 112.71 2vl4 n PHE 776 Ca -0.15 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.16 2vl4 n PHE 776 Cb 0.53 -0.13 -0.10 0.00 -0.94 0.00 0.00 39.48 38.84 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 -2.67 0.75 0.58 -1.08 1.81 -1.26 -4.98 118.95 112.11 2vl4 s ARG 777 Ca 0.19 -1.31 -0.20 0.00 -1.72 0.00 0.00 55.73 52.68 2vl4 s ARG 777 Cb 0.18 0.15 -0.04 0.00 -0.45 0.00 0.00 34.95 34.80 2vl4 s ARG 777 CO 0.60 -0.15 1.33 1.63 -0.68 0.00 0.00 175.30 178.04 2vl4 n LYS 778 N 0.02 1.48 -0.34 3.54 5.02 -1.26 -4.85 118.16 121.77 2vl4 n LYS 778 Ca -0.11 0.55 0.04 0.00 -2.02 0.00 0.00 58.31 56.77 2vl4 n LYS 778 Cb 0.62 -2.55 0.18 0.00 -0.02 0.00 0.00 35.03 33.26 2vl4 n LYS 778 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2vl4 h THR 779 N 1.10 0.99 0.00 -0.18 2.02 -1.93 0.26 112.91 115.17 2vl4 h THR 779 Ca -0.51 -0.34 -0.00 0.00 0.77 0.00 0.00 66.41 66.33 2vl4 h THR 779 Cb 1.32 -0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 2vl4 h THR 779 CO 0.55 0.18 -0.00 0.07 0.37 0.00 0.00 175.52 176.69 2vl4 h LYS 780 N 0.99 0.00 -0.00 6.66 2.10 -1.16 -2.13 116.57 123.02 2vl4 h LYS 780 Ca 0.43 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.08 2vl4 h LYS 780 Cb 0.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.64 2vl4 h LYS 780 CO -0.22 0.00 -0.67 -0.25 -2.00 0.00 0.00 179.45 176.32 2vl4 n ASP 781 N -3.26 0.89 -4.77 7.07 8.00 0.05 -4.85 116.55 119.67 2vl4 n ASP 781 Ca -0.03 -0.73 -0.37 0.00 0.71 0.00 0.00 54.79 54.37 2vl4 n ASP 781 Cb 0.08 0.55 -0.03 0.00 -0.02 0.00 0.00 41.12 41.70 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 -2.90 4.17 -1.16 0.64 1.43 -0.80 -4.78 118.68 115.28 2vl4 s LEU 782 Ca 0.12 2.19 -0.11 0.00 -1.03 0.00 0.00 54.13 55.29 2vl4 s LEU 782 Cb 0.17 -4.11 0.23 0.00 0.03 0.00 0.00 46.19 42.52 2vl4 s LEU 782 CO 0.74 -0.59 1.26 -1.10 0.23 0.00 0.00 176.35 176.89 2vl4 s GLN 783 N -2.39 4.15 0.19 1.70 -0.21 -0.03 -5.02 119.66 118.06 2vl4 s GLN 783 Ca 0.57 -2.93 -0.30 0.00 0.02 0.00 0.00 55.36 52.72 2vl4 s GLN 783 Cb -0.26 -4.79 -0.08 0.00 1.00 0.00 0.00 33.01 28.88 2vl4 s GLN 783 CO 0.33 -1.48 1.18 -0.51 -2.12 0.00 0.00 175.29 172.69 2vl4 s LEU 784 N 0.02 4.46 0.56 2.90 1.43 -1.26 -4.87 118.68 121.91 2vl4 s LEU 784 Ca 0.36 2.21 -0.09 0.00 -1.03 0.00 0.00 54.13 55.58 2vl4 s LEU 784 Cb -0.07 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.50 2vl4 s LEU 784 CO -0.04 -0.34 0.93 -2.16 0.23 0.00 0.00 176.35 174.97 2vl4 s PRO 785 N -0.30 3.61 -1.34 1.29 0.04 -1.26 -4.93 135.00 132.11 2vl4 s PRO 785 Ca 0.52 0.57 -0.13 0.00 0.04 0.00 0.00 61.00 61.99 2vl4 s PRO 785 Cb -0.32 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 31.98 2vl4 s PRO 785 CO 0.37 -0.40 2.38 -0.35 0.04 0.00 0.00 177.00 179.04 2vl4 n PRO 786 N -2.43 2.80 -2.17 0.56 -0.04 -1.26 -4.91 135.00 127.55 2vl4 n PRO 786 Ca 0.04 -2.24 -0.34 0.00 -0.04 0.00 0.00 63.50 60.92 2vl4 n PRO 786 Cb 0.54 -3.00 0.01 0.00 -0.04 0.00 0.00 33.50 31.02 2vl4 n PRO 786 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2vl4 s THR 787 N 3.21 3.34 -0.25 0.52 -1.32 -1.26 -5.02 115.64 114.86 2vl4 s THR 787 Ca 0.54 0.77 -0.07 0.00 -1.21 0.00 0.00 61.69 61.72 2vl4 s THR 787 Cb 0.15 -3.28 -0.03 0.00 -1.51 0.00 0.00 72.50 67.83 2vl4 s THR 787 CO -0.04 -0.25 0.07 -0.55 -2.21 0.00 0.00 174.62 171.64 2vl4 s SER 788 N -2.08 5.15 -0.27 8.08 0.15 -1.26 -5.08 113.70 118.39 2vl4 s SER 788 Ca 0.70 -0.23 -0.06 0.00 0.70 0.00 0.00 55.95 57.05 2vl4 s SER 788 Cb -0.21 -1.93 -0.00 0.00 -1.71 0.00 0.00 66.02 62.17 2vl4 s SER 788 CO 0.30 -0.05 0.05 -0.69 1.20 0.00 0.00 173.24 174.06 2vl4 s VAL 789 N 1.61 3.91 0.28 4.45 1.01 -1.26 -4.34 120.40 126.06 2vl4 s VAL 789 Ca 0.06 -0.53 0.10 0.00 0.00 0.00 0.00 61.98 61.61 2vl4 s VAL 789 Cb -0.15 -2.93 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 2vl4 s VAL 789 CO 0.04 0.21 -0.00 -0.94 0.00 0.00 0.00 175.10 174.41 2vl4 s SER 790 N 1.52 4.46 0.00 3.32 1.04 -0.28 -4.97 113.70 118.79 2vl4 s SER 790 Ca 0.04 -0.71 -0.16 0.00 0.48 0.00 0.00 55.95 55.60 2vl4 s SER 790 Cb -0.16 -0.77 0.03 0.00 0.10 0.00 0.00 66.02 65.22 2vl4 s SER 790 CO 0.01 -0.04 0.35 -0.72 0.98 0.00 0.00 173.24 173.82 2vl4 s TYR 791 N -2.36 -0.21 -0.01 5.02 -0.85 -1.26 -0.57 117.35 117.10 2vl4 s TYR 791 Ca 0.32 0.27 0.00 0.00 -0.52 0.00 0.00 57.07 57.14 2vl4 s TYR 791 Cb -0.05 0.13 -0.04 0.00 0.38 0.00 0.00 41.96 42.38 2vl4 s TYR 791 CO 0.20 -0.45 0.03 -0.65 -1.52 0.00 0.00 175.55 173.16 2vl4 s GLN 792 N -1.69 2.92 -0.10 -3.49 -0.21 -0.75 -4.94 119.66 111.41 2vl4 s GLN 792 Ca -0.11 -0.53 0.03 0.00 0.02 0.00 0.00 55.36 54.77 2vl4 s GLN 792 Cb -0.03 -2.76 -0.01 0.00 1.00 0.00 0.00 33.01 31.21 2vl4 s GLN 792 CO 0.02 0.64 -0.20 -1.64 -2.12 0.00 0.00 175.29 172.00 2vl4 s MET 793 N -1.53 3.02 -0.34 2.91 -1.94 -1.26 -1.07 119.30 119.09 2vl4 s MET 793 Ca 0.20 -0.82 0.03 0.00 -1.71 0.00 0.00 55.69 53.39 2vl4 s MET 793 Cb -0.12 -2.38 0.09 0.00 2.01 0.00 0.00 34.83 34.44 2vl4 s MET 793 CO 0.10 0.26 0.05 0.21 -0.01 0.00 0.00 175.02 175.63 2vl4 s LYS 794 N 0.18 1.70 -0.20 2.03 2.20 0.65 -4.97 119.74 121.32 2vl4 s LYS 794 Ca -0.12 -1.78 -0.07 0.00 -0.36 0.00 0.00 55.97 53.65 2vl4 s LYS 794 Cb -0.16 -3.22 -0.03 0.00 -1.51 0.00 0.00 37.83 32.90 2vl4 s LYS 794 CO 0.06 -0.90 0.05 -1.14 -0.36 0.00 0.00 175.35 173.06 2vl4 s GLN 795 N 0.98 3.78 0.12 4.03 0.74 -1.26 -0.24 119.66 127.81 2vl4 s GLN 795 Ca 0.07 -0.43 0.05 0.00 0.05 0.00 0.00 55.36 55.10 2vl4 s GLN 795 Cb -0.20 -3.20 -0.04 0.00 1.10 0.00 0.00 33.01 30.68 2vl4 s GLN 795 CO -0.07 0.08 -0.13 0.95 -0.55 0.00 0.00 175.29 175.57 2vl4 s THR 796 N 0.88 1.24 0.37 -0.34 -4.23 0.00 -4.76 115.64 108.81 2vl4 s THR 796 Ca 0.03 -1.73 -0.28 0.00 -1.18 0.00 0.00 61.69 58.53 2vl4 s THR 796 Cb -0.14 -1.52 -0.11 0.00 1.34 0.00 0.00 72.50 72.07 2vl4 s THR 796 CO 0.02 -0.48 1.40 -0.90 -0.54 0.00 0.00 174.62 174.13 2vl4 n ASP 797 N 0.47 3.30 0.00 3.99 5.68 -1.26 -0.72 116.55 128.01 2vl4 n ASP 797 Ca -0.15 1.21 0.00 0.00 -0.50 0.00 0.00 54.79 55.34 2vl4 n ASP 797 Cb 0.57 -1.56 0.00 0.00 -1.14 0.00 0.00 41.12 38.99 2vl4 n ASP 797 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2vl4 n GLY 798 N 0.60 2.92 3.37 6.12 0.00 0.86 -4.81 105.19 114.25 2vl4 n GLY 798 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.15 0.61 -0.10 1.61 2.20 0.11 -2.32 119.74 121.70 2vl4 s LYS 799 Ca 0.00 0.51 0.00 0.00 -0.36 0.00 0.00 55.97 56.12 2vl4 s LYS 799 Cb 0.00 0.29 0.02 0.00 -1.51 0.00 0.00 37.83 36.64 2vl4 s LYS 799 CO 0.00 -0.10 -0.08 0.00 -0.36 0.00 0.00 175.35 174.80 2vl4 s GLU 801 N 1.47 3.62 -0.08 0.00 2.02 0.66 -0.10 118.70 126.29 2vl4 s GLU 801 Ca 0.00 -0.50 -0.02 0.00 0.02 0.00 0.00 54.97 54.47 2vl4 s GLU 801 Cb -0.13 -3.34 -0.03 0.00 0.10 0.00 0.00 34.13 30.73 2vl4 s GLU 801 CO -0.05 -0.21 0.01 -0.51 0.02 0.00 0.00 175.26 174.52 2vl4 s LEU 802 N 1.61 3.61 -0.22 1.80 1.02 0.43 -0.25 118.68 126.67 2vl4 s LEU 802 Ca 0.06 0.15 -0.01 0.00 0.02 0.00 0.00 54.13 54.35 2vl4 s LEU 802 Cb -0.15 -1.84 0.02 0.00 0.02 0.00 0.00 46.19 44.23 2vl4 s LEU 802 CO 0.04 0.38 -0.10 -0.89 0.02 0.00 0.00 176.35 175.79 2vl4 s THR 803 N -0.90 2.74 0.04 5.49 2.01 -0.23 -0.80 115.64 123.99 2vl4 s THR 803 Ca 0.14 -0.88 0.01 0.00 0.31 0.00 0.00 61.69 61.27 2vl4 s THR 803 Cb -0.11 -2.30 -0.04 0.00 0.01 0.00 0.00 72.50 70.06 2vl4 s THR 803 CO 0.03 0.35 0.11 -0.76 -0.69 0.00 0.00 174.62 173.66 2vl4 s LEU 804 N 1.35 3.96 -0.06 4.42 1.02 0.18 -1.80 118.68 127.75 2vl4 s LEU 804 Ca 0.03 0.11 -0.09 0.00 0.02 0.00 0.00 54.13 54.20 2vl4 s LEU 804 Cb -0.15 -2.50 0.02 0.00 0.02 0.00 0.00 46.19 43.57 2vl4 s LEU 804 CO -0.07 0.21 0.22 0.12 0.02 0.00 0.00 176.35 176.86 2vl4 s PHE 805 N -1.34 -0.17 -0.15 0.29 5.36 0.26 -1.03 117.98 121.19 2vl4 s PHE 805 Ca 0.28 0.39 -0.08 0.00 -0.96 0.00 0.00 56.93 56.56 2vl4 s PHE 805 Cb -0.12 0.06 0.06 0.00 -0.34 0.00 0.00 43.02 42.67 2vl4 s PHE 805 CO 0.20 -0.20 0.36 0.45 -1.46 0.00 0.00 175.22 174.57 2vl4 s SER 806 N -0.44 -0.43 0.28 6.13 0.15 -1.26 -1.13 113.70 117.00 2vl4 s SER 806 Ca -0.05 0.78 0.25 0.00 0.70 0.00 0.00 55.95 57.63 2vl4 s SER 806 Cb -0.04 0.67 0.96 0.00 -1.71 0.00 0.00 66.02 65.90 2vl4 s SER 806 CO 0.01 -0.19 1.75 0.77 1.20 0.00 0.00 173.24 176.79 2vl4 h SER 807 N 7.17 0.00 -3.60 5.45 4.64 -1.90 0.54 113.55 125.85 2vl4 h SER 807 Ca -0.38 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.46 2vl4 h SER 807 Cb 1.17 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.09 2vl4 h SER 807 CO 0.32 0.00 -0.77 -0.04 -0.87 0.00 0.00 176.83 175.47 2vl4 s MET 808 N -3.29 1.23 -0.05 4.77 -1.94 -1.26 -3.98 119.30 114.78 2vl4 s MET 808 Ca 0.06 -1.40 -0.37 0.00 -1.71 0.00 0.00 55.69 52.26 2vl4 s MET 808 Cb 0.10 -1.21 -0.15 0.00 2.01 0.00 0.00 34.83 35.57 2vl4 s MET 808 CO 0.47 0.24 1.57 -0.11 -0.01 0.00 0.00 175.02 177.18 2vl4 n LEU 809 N 0.23 2.27 -4.37 -0.03 7.94 -0.51 -4.35 117.00 118.19 2vl4 n LEU 809 Ca -0.13 1.08 -0.34 0.00 -1.11 0.00 0.00 56.01 55.51 2vl4 n LEU 809 Cb 0.58 -1.22 -0.14 0.00 0.53 0.00 0.00 43.42 43.17 2vl4 n LEU 809 CO 0.30 -0.63 -0.39 0.00 -1.11 0.00 0.00 177.39 175.55 2vl4 s ALA 810 N 2.00 2.81 -0.13 1.96 0.00 -0.49 -4.57 121.76 123.35 2vl4 s ALA 810 Ca 0.90 -1.02 -0.21 0.00 0.00 0.00 0.00 51.96 51.63 2vl4 s ALA 810 Cb -0.93 -1.55 -0.03 0.00 0.00 0.00 0.00 23.12 20.60 2vl4 s ALA 810 CO 0.53 -0.11 0.63 0.21 0.00 0.00 0.00 175.76 177.02 2vl4 s LYS 811 N 0.94 4.33 -1.25 0.00 2.47 -1.26 -0.91 119.74 124.06 2vl4 s LYS 811 Ca -0.01 0.70 -0.09 0.00 -1.56 0.00 0.00 55.97 55.02 2vl4 s LYS 811 Cb -0.15 -3.50 -0.01 0.00 -1.46 0.00 0.00 37.83 32.72 2vl4 s LYS 811 CO 0.01 -0.04 0.68 -0.25 0.16 0.00 0.00 175.35 175.91 2vl4 n ASP 812 N 4.28 -2.95 -4.72 1.43 8.00 -1.24 -1.91 116.55 119.44 2vl4 n ASP 812 Ca -0.02 -0.93 -0.42 0.00 0.71 0.00 0.00 54.79 54.12 2vl4 n ASP 812 Cb 0.51 -3.64 -0.03 0.00 -0.02 0.00 0.00 41.12 37.94 2vl4 n ASP 812 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2vl4 n ILE 813 N -4.19 0.35 -4.01 0.53 2.08 0.68 -4.64 119.36 110.15 2vl4 n ILE 813 Ca -0.21 -0.09 -0.31 0.00 0.56 0.00 0.00 62.75 62.71 2vl4 n ILE 813 Cb 0.64 -1.93 -0.16 0.00 -0.75 0.00 0.00 39.64 37.45 2vl4 n ILE 813 CO 0.00 0.00 0.00 0.12 0.56 0.00 0.00 176.55 177.23 2vl4 s PHE 814 N 0.74 2.42 -0.46 1.39 5.36 -0.22 -0.97 117.98 126.24 2vl4 s PHE 814 Ca 0.72 -1.54 -0.20 0.00 -0.96 0.00 0.00 56.93 54.95 2vl4 s PHE 814 Cb -0.52 -1.66 0.04 0.00 -0.34 0.00 0.00 43.02 40.54 2vl4 s PHE 814 CO 0.38 -0.74 0.63 0.42 -1.46 0.00 0.00 175.22 174.46 2vl4 s ILE 815 N 1.40 4.85 -0.18 3.12 1.01 -1.26 -0.29 121.20 129.84 2vl4 s ILE 815 Ca 0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 60.65 60.48 2vl4 s ILE 815 Cb -0.15 -4.23 -0.03 0.00 0.01 0.00 0.00 42.46 38.05 2vl4 s ILE 815 CO -0.09 -0.67 -0.00 -0.70 0.00 0.00 0.00 174.94 173.48 2vl4 s GLU 816 N 2.74 3.70 0.18 2.79 2.12 -0.27 -4.96 118.70 125.01 2vl4 s GLU 816 Ca 0.19 -0.49 0.07 0.00 0.36 0.00 0.00 54.97 55.10 2vl4 s GLU 816 Cb -0.16 -3.04 -0.05 0.00 0.26 0.00 0.00 34.13 31.15 2vl4 s GLU 816 CO 0.16 0.14 -0.13 0.95 -0.54 0.00 0.00 175.26 175.84 2vl4 s THR 817 N 0.65 1.58 -1.75 -1.70 -4.23 -1.26 -0.78 115.64 108.14 2vl4 s THR 817 Ca -0.01 -2.14 0.27 0.00 -1.18 0.00 0.00 61.69 58.63 2vl4 s THR 817 Cb -0.14 -1.96 0.33 0.00 1.34 0.00 0.00 72.50 72.07 2vl4 s THR 817 CO 0.02 -0.62 1.66 -0.81 -0.54 0.00 0.00 174.62 174.33 2vl4 n PRO 818 N -0.27 0.83 -2.55 3.99 -0.04 -1.26 -4.85 135.00 130.84 2vl4 n PRO 818 Ca -0.09 -0.44 -0.43 0.00 -0.04 0.00 0.00 63.50 62.50 2vl4 n PRO 818 Cb 0.60 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.55 2vl4 n PRO 818 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2vl4 s LEU 819 N -2.47 4.10 0.25 1.53 1.43 -1.26 -4.99 118.68 117.26 2vl4 s LEU 819 Ca 0.26 1.45 -0.31 0.00 -1.03 0.00 0.00 54.13 54.50 2vl4 s LEU 819 Cb 0.20 -3.54 -0.12 0.00 0.03 0.00 0.00 46.19 42.76 2vl4 s LEU 819 CO 0.50 -0.76 1.66 -1.10 0.23 0.00 0.00 176.35 176.88 2vl4 s GLN 820 N 3.44 4.12 0.00 1.70 -1.52 -1.26 -2.84 119.66 123.30 2vl4 s GLN 820 Ca 0.49 2.59 0.00 0.00 -1.95 0.00 0.00 55.36 56.50 2vl4 s GLN 820 Cb -0.17 -3.05 0.00 0.00 -0.22 0.00 0.00 33.01 29.57 2vl4 s GLN 820 CO 0.12 -0.69 0.00 0.41 -0.25 0.00 0.00 175.29 174.87 2vl4 n GLY 821 N 3.07 0.55 3.74 3.09 0.00 -1.24 -5.00 105.19 109.39 2vl4 n GLY 821 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 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 2.12 -2.83 4.61 0.00 -1.13 -4.88 120.51 119.39 2vl4 n ALA 822 Ca 0.00 0.36 -0.35 0.00 0.00 0.00 0.00 53.44 53.46 2vl4 n ALA 822 Cb 0.07 -2.39 -0.06 0.00 0.00 0.00 0.00 19.45 17.06 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 -1.24 3.28 0.01 0.00 0.52 -0.64 -4.81 118.95 116.07 2vl4 s ARG 823 Ca 0.60 -0.31 0.07 0.00 -0.52 0.00 0.00 55.73 55.57 2vl4 s ARG 823 Cb -0.52 -3.03 -0.02 0.00 0.52 0.00 0.00 34.95 31.90 2vl4 s ARG 823 CO 0.56 0.71 -0.21 0.71 0.02 0.00 0.00 175.30 177.09 2vl4 s TYR 824 N -1.13 1.86 0.42 -0.53 2.02 -1.26 -0.83 117.35 117.90 2vl4 s TYR 824 Ca 0.20 -0.36 0.08 0.00 -0.37 0.00 0.00 57.07 56.62 2vl4 s TYR 824 Cb -0.12 -1.16 0.89 0.00 -0.40 0.00 0.00 41.96 41.16 2vl4 s TYR 824 CO 0.10 0.02 2.03 0.66 -1.57 0.00 0.00 175.55 176.79 2vl4 h SER 825 N 5.33 0.37 -5.01 2.29 4.64 -1.18 -3.45 113.55 116.54 2vl4 h SER 825 Ca -0.41 -0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 60.86 2vl4 h SER 825 Cb 1.15 -0.09 -0.13 0.00 -0.31 0.00 0.00 62.40 63.01 2vl4 h SER 825 CO 0.46 0.32 0.18 -0.62 -0.87 0.00 0.00 176.83 176.30 2vl4 s ASP 826 N -6.78 -0.55 0.12 4.97 -1.08 -1.26 -4.99 116.67 107.10 2vl4 s ASP 826 Ca -0.07 0.07 -0.26 0.00 -0.52 0.00 0.00 52.55 51.77 2vl4 s ASP 826 Cb 0.17 0.58 0.07 0.00 -1.46 0.00 0.00 42.92 42.28 2vl4 s ASP 826 CO 0.73 -0.91 0.90 0.21 0.52 0.00 0.00 175.17 176.61 2vl4 s ASN 827 N -2.54 -0.26 -1.23 -0.34 3.84 -1.26 -4.91 114.94 108.24 2vl4 s ASN 827 Ca -0.01 -0.27 -0.06 0.00 0.21 0.00 0.00 52.86 52.73 2vl4 s ASN 827 Cb -0.01 0.48 -0.01 0.00 -0.55 0.00 0.00 41.25 41.16 2vl4 s ASN 827 CO -0.10 -0.86 0.74 0.49 -2.79 0.00 0.00 177.10 174.59 2vl4 n PHE 828 N -0.40 -1.98 -4.28 0.43 3.72 -0.14 -4.92 117.46 109.88 2vl4 n PHE 828 Ca -0.07 0.74 -0.20 0.00 -0.05 0.00 0.00 57.45 57.87 2vl4 n PHE 828 Cb 0.61 -4.09 -0.11 0.00 -0.94 0.00 0.00 39.48 34.95 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 -3.59 1.59 0.09 1.38 -0.12 -1.12 -4.79 117.98 111.42 2vl4 s PHE 829 Ca 0.19 -0.52 -0.30 0.00 -0.05 0.00 0.00 56.93 56.25 2vl4 s PHE 829 Cb -0.05 -0.81 -0.06 0.00 -0.63 0.00 0.00 43.02 41.47 2vl4 s PHE 829 CO 0.82 0.23 1.15 -0.51 -0.05 0.00 0.00 175.22 176.85 2vl4 s ASP 830 N -2.55 7.16 -0.41 1.98 1.01 -1.26 -0.23 116.67 122.36 2vl4 s ASP 830 Ca 0.12 2.01 -0.19 0.00 0.71 0.00 0.00 52.55 55.20 2vl4 s ASP 830 Cb -0.05 -2.59 0.02 0.00 1.01 0.00 0.00 42.92 41.31 2vl4 s ASP 830 CO 0.05 -0.38 0.55 -0.22 0.21 0.00 0.00 175.17 175.38 2vl4 s LEU 831 N 0.61 4.58 0.39 1.23 2.96 -0.09 -4.96 118.68 123.40 2vl4 s LEU 831 Ca 0.55 -0.37 -0.20 0.00 -0.22 0.00 0.00 54.13 53.89 2vl4 s LEU 831 Cb -0.29 -2.59 -0.10 0.00 0.50 0.00 0.00 46.19 43.71 2vl4 s LEU 831 CO 0.31 -0.65 0.88 -0.76 -1.32 0.00 0.00 176.35 174.81 2vl4 s LEU 832 N 2.51 4.01 0.07 -0.68 1.43 -1.26 -1.40 118.68 123.36 2vl4 s LEU 832 Ca 0.18 1.58 -0.32 0.00 -1.03 0.00 0.00 54.13 54.54 2vl4 s LEU 832 Cb -0.15 -4.36 -0.11 0.00 0.03 0.00 0.00 46.19 41.60 2vl4 s LEU 832 CO 0.16 -0.29 1.85 -0.81 0.23 0.00 0.00 176.35 177.49 2vl4 n PRO 833 N -0.46 2.65 -0.92 1.29 -0.04 -1.26 -2.24 135.00 134.02 2vl4 n PRO 833 Ca 0.06 0.97 0.00 0.00 -0.04 0.00 0.00 63.50 64.48 2vl4 n PRO 833 Cb 0.53 -2.86 0.00 0.00 -0.04 0.00 0.00 33.50 31.14 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 4.26 0.52 3.24 0.55 0.00 0.19 -4.70 105.19 109.24 2vl4 n GLY 834 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.46 2.51 0.44 1.61 2.02 -0.95 -5.00 118.70 118.87 2vl4 s GLU 835 Ca 0.00 -1.61 -0.25 0.00 0.02 0.00 0.00 54.97 53.13 2vl4 s GLU 835 Cb 0.00 -3.82 -0.09 0.00 0.10 0.00 0.00 34.13 30.32 2vl4 s GLU 835 CO 0.00 -1.06 1.43 -2.13 0.02 0.00 0.00 175.26 173.52 2vl4 n ARG 836 N 4.89 2.26 -3.90 1.61 0.63 -1.26 -4.44 116.66 116.45 2vl4 n ARG 836 Ca -0.09 0.80 -0.24 0.00 -0.92 0.00 0.00 57.85 57.41 2vl4 n ARG 836 Cb 0.42 -2.62 -0.17 0.00 0.45 0.00 0.00 32.46 30.54 2vl4 n ARG 836 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 2vl4 s LYS 837 N -2.41 0.98 -0.13 -0.14 2.47 -0.20 -4.95 119.74 115.37 2vl4 s LYS 837 Ca 0.61 -0.06 -0.15 0.00 -1.56 0.00 0.00 55.97 54.81 2vl4 s LYS 837 Cb -0.46 -1.17 -0.05 0.00 -1.46 0.00 0.00 37.83 34.70 2vl4 s LYS 837 CO 0.58 -0.25 0.36 0.21 0.16 0.00 0.00 175.35 176.41 2vl4 s LYS 838 N 1.68 4.22 -0.08 4.03 2.20 -1.26 0.47 119.74 131.00 2vl4 s LYS 838 Ca 0.02 0.24 0.03 0.00 -0.36 0.00 0.00 55.97 55.90 2vl4 s LYS 838 Cb -0.13 -3.40 0.01 0.00 -1.51 0.00 0.00 37.83 32.80 2vl4 s LYS 838 CO -0.05 0.28 -0.17 0.08 -0.36 0.00 0.00 175.35 175.13 2vl4 s VAL 839 N 0.30 1.53 -0.16 4.02 1.01 0.02 -4.89 120.40 122.23 2vl4 s VAL 839 Ca 0.20 -0.71 -0.06 0.00 0.00 0.00 0.00 61.98 61.42 2vl4 s VAL 839 Cb -0.14 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 2vl4 s VAL 839 CO 0.07 0.44 0.05 -0.63 0.00 0.00 0.00 175.10 175.03 2vl4 s ILE 840 N 0.54 4.65 -0.18 2.22 1.01 -1.26 -0.43 121.20 127.75 2vl4 s ILE 840 Ca -0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 60.65 60.39 2vl4 s ILE 840 Cb -0.17 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.24 2vl4 s ILE 840 CO 0.06 0.50 -0.13 -0.63 0.00 0.00 0.00 174.94 174.73 2vl4 s ILE 841 N 0.04 2.69 -0.01 2.92 1.01 0.86 -0.54 121.20 128.17 2vl4 s ILE 841 Ca 0.05 -0.74 0.05 0.00 0.00 0.00 0.00 60.65 60.00 2vl4 s ILE 841 Cb -0.12 -2.16 -0.03 0.00 0.01 0.00 0.00 42.46 40.15 2vl4 s ILE 841 CO 0.01 0.50 -0.13 0.42 0.00 0.00 0.00 174.94 175.73 2vl4 s THR 842 N 1.15 3.13 -0.28 2.92 -4.23 -0.01 -0.83 115.64 117.50 2vl4 s THR 842 Ca 0.01 -0.87 -0.22 0.00 -1.18 0.00 0.00 61.69 59.43 2vl4 s THR 842 Cb -0.14 -2.29 0.12 0.00 1.34 0.00 0.00 72.50 71.52 2vl4 s THR 842 CO -0.05 0.47 0.95 -0.55 -0.54 0.00 0.00 174.62 174.90 2vl4 s SER 843 N -1.12 -0.54 0.41 3.99 0.15 -0.98 -1.63 113.70 113.99 2vl4 s SER 843 Ca 0.14 0.98 0.28 0.00 0.70 0.00 0.00 55.95 58.04 2vl4 s SER 843 Cb -0.11 1.07 1.51 0.00 -1.71 0.00 0.00 66.02 66.78 2vl4 s SER 843 CO 0.04 -0.16 1.85 -0.65 1.20 0.00 0.00 173.24 175.51 2vl4 h PRO 844 N 4.97 0.00 -0.01 5.44 0.11 -1.98 -0.98 132.00 139.55 2vl4 h PRO 844 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2vl4 h PRO 844 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2vl4 h PRO 844 CO 0.13 0.00 -0.00 0.54 -0.21 0.00 0.00 178.00 178.45 2vl4 n ARG 845 N -2.47 1.48 -3.06 1.05 1.74 -1.26 -4.73 116.66 109.42 2vl4 n ARG 845 Ca -0.02 -0.71 -0.40 0.00 -0.77 0.00 0.00 57.85 55.96 2vl4 n ARG 845 Cb 0.04 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 29.95 2vl4 n ARG 845 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2vl4 s ILE 846 N -2.01 4.96 0.00 0.55 1.01 -0.37 -4.98 121.20 120.36 2vl4 s ILE 846 Ca 0.40 1.45 0.00 0.00 0.00 0.00 0.00 60.65 62.50 2vl4 s ILE 846 Cb 0.21 -4.04 0.00 0.00 0.01 0.00 0.00 42.46 38.64 2vl4 s ILE 846 CO 0.35 0.30 0.00 0.29 0.00 0.00 0.00 174.94 175.88 2vl4 n LYS 847 N 3.40 0.00 -1.36 2.79 5.02 -1.26 0.30 118.16 127.05 2vl4 n LYS 847 Ca -0.02 0.00 -0.53 0.00 -2.02 0.00 0.00 58.31 55.74 2vl4 n LYS 847 Cb 0.51 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.45 2vl4 n LYS 847 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2vl4 n LYS 848 N 0.00 0.00 -0.59 1.97 5.02 -1.26 -1.88 118.16 121.42 2vl4 n LYS 848 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2vl4 n LYS 848 Cb 0.00 -1.26 0.00 0.00 -0.02 0.00 0.00 35.03 33.75 2vl4 n LYS 848 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2vl4 n GLY 849 N 2.25 0.00 3.58 0.72 0.00 -1.26 -4.78 105.19 105.69 2vl4 n GLY 849 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 2vl4 n GLY 849 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2vl4 s GLU 850 N -0.31 3.21 0.18 1.61 2.12 -0.79 -5.16 118.70 119.56 2vl4 s GLU 850 Ca 0.00 0.64 -0.32 0.00 0.36 0.00 0.00 54.97 55.65 2vl4 s GLU 850 Cb 0.00 -4.17 -0.11 0.00 0.26 0.00 0.00 34.13 30.11 2vl4 s GLU 850 CO 0.00 -2.04 1.65 -1.83 -0.54 0.00 0.00 175.26 172.50 2vl4 s GLU 851 N 5.75 4.17 -0.16 4.30 4.04 -1.26 -4.75 118.70 130.78 2vl4 s GLU 851 Ca 0.59 2.48 -0.29 0.00 0.04 0.00 0.00 54.97 57.79 2vl4 s GLU 851 Cb -0.13 -3.14 -0.03 0.00 0.02 0.00 0.00 34.13 30.85 2vl4 s GLU 851 CO 0.26 -0.68 1.49 -1.17 -1.84 0.00 0.00 175.26 173.32 2vl4 s LEU 852 N 1.25 4.11 0.20 1.83 2.96 -1.26 -4.99 118.68 122.78 2vl4 s LEU 852 Ca 0.73 1.79 -0.33 0.00 -0.22 0.00 0.00 54.13 56.10 2vl4 s LEU 852 Cb -0.46 -3.53 -0.14 0.00 0.50 0.00 0.00 46.19 42.56 2vl4 s LEU 852 CO 0.32 -0.99 1.50 -2.65 -1.32 0.00 0.00 176.35 173.21 2vl4 n PRO 853 N 7.15 2.10 -4.05 0.98 -0.02 -1.26 -4.99 135.00 134.92 2vl4 n PRO 853 Ca 0.16 0.75 -0.24 0.00 -2.02 0.00 0.00 63.50 62.16 2vl4 n PRO 853 Cb 0.44 -2.47 -0.17 0.00 -0.02 0.00 0.00 33.50 31.28 2vl4 n PRO 853 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2vl4 s VAL 854 N 0.45 0.76 -0.25 -1.45 1.01 -1.26 -4.30 120.40 115.36 2vl4 s VAL 854 Ca 0.74 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.56 2vl4 s VAL 854 Cb -0.66 -0.80 0.06 0.00 0.00 0.00 0.00 36.38 34.98 2vl4 s VAL 854 CO 0.43 0.30 -0.09 0.21 0.00 0.00 0.00 175.10 175.96 2vl4 s ASN 855 N 1.40 4.21 -0.34 3.32 2.47 0.04 -4.97 114.94 121.07 2vl4 s ASN 855 Ca -0.02 -1.31 -0.18 0.00 0.42 0.00 0.00 52.86 51.77 2vl4 s ASN 855 Cb -0.13 -1.41 -0.01 0.00 -1.45 0.00 0.00 41.25 38.25 2vl4 s ASN 855 CO -0.03 -0.21 0.52 -0.63 -3.72 0.00 0.00 177.10 173.03 2vl4 s ILE 856 N 1.22 5.02 0.11 -5.21 1.01 -1.26 -1.11 121.20 120.97 2vl4 s ILE 856 Ca -0.08 0.40 0.03 0.00 0.00 0.00 0.00 60.65 61.00 2vl4 s ILE 856 Cb -0.20 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.28 2vl4 s ILE 856 CO -0.05 -0.19 0.14 -0.54 0.00 0.00 0.00 174.94 174.30 2vl4 s LYS 857 N 2.40 3.06 0.21 2.79 1.02 0.60 -4.94 119.74 124.87 2vl4 s LYS 857 Ca 0.19 -0.68 -0.14 0.00 0.02 0.00 0.00 55.97 55.36 2vl4 s LYS 857 Cb -0.15 -2.79 0.01 0.00 -0.52 0.00 0.00 37.83 34.37 2vl4 s LYS 857 CO 0.13 0.55 0.46 -3.38 -0.92 0.00 0.00 175.35 172.18 2vl4 s HIS 858 N -1.55 0.15 0.25 3.18 -3.43 -1.26 -1.06 115.29 111.57 2vl4 s HIS 858 Ca 0.31 -0.51 -0.02 0.00 -0.80 0.00 0.00 55.06 54.04 2vl4 s HIS 858 Cb -0.12 0.23 0.31 0.00 -1.43 0.00 0.00 32.58 31.58 2vl4 s HIS 858 CO 0.24 -0.90 1.73 0.82 -2.00 0.00 0.00 174.74 174.63 2vl4 h ILE 859 N 2.29 1.25 -0.69 -5.38 1.08 -1.65 -2.21 117.51 112.20 2vl4 h ILE 859 Ca -0.28 -1.08 0.07 0.00 -0.39 0.00 0.00 64.86 63.18 2vl4 h ILE 859 Cb 1.25 0.96 -0.04 0.00 -3.07 0.00 0.00 36.82 35.92 2vl4 h ILE 859 CO 0.39 0.37 0.45 -0.09 -0.69 0.00 0.00 178.15 178.59 2vl4 h ARG 860 N 0.71 0.64 0.00 2.37 9.65 -1.91 -2.14 114.38 123.71 2vl4 h ARG 860 Ca 0.13 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 2vl4 h ARG 860 Cb 0.51 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.95 2vl4 h ARG 860 CO 0.03 0.42 0.00 0.39 2.80 0.00 0.00 179.97 183.61 2vl4 n GLU 861 N -4.48 0.04 0.00 0.20 1.02 -0.83 -3.51 120.64 113.08 2vl4 n GLU 861 Ca 0.10 0.36 0.13 0.00 -0.02 0.00 0.00 57.16 57.73 2vl4 n GLU 861 Cb 0.27 -1.60 0.25 0.00 -0.02 0.00 0.00 31.44 30.34 2vl4 n GLU 861 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2vl4 n THR 862 N -1.68 0.00 -4.02 2.62 -2.24 -0.80 -4.92 114.28 103.23 2vl4 n THR 862 Ca 0.02 -0.33 -0.08 0.00 -2.27 0.00 0.00 64.05 61.40 2vl4 n THR 862 Cb 0.13 0.99 -0.09 0.00 -2.10 0.00 0.00 70.33 69.26 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 -2.15 0.41 -0.20 4.78 1.13 -1.23 -4.33 117.35 115.76 2vl4 s TYR 863 Ca 0.29 -0.93 -0.02 0.00 -1.41 0.00 0.00 57.07 55.00 2vl4 s TYR 863 Cb 0.20 -0.29 -0.00 0.00 -1.10 0.00 0.00 41.96 40.76 2vl4 s TYR 863 CO 0.39 -0.42 -0.09 0.21 -2.51 0.00 0.00 175.55 173.12 2vl4 s LYS 864 N -3.88 3.28 0.25 -3.49 2.20 -1.26 -5.05 119.74 111.79 2vl4 s LYS 864 Ca 0.06 -0.68 -0.29 0.00 -0.36 0.00 0.00 55.97 54.70 2vl4 s LYS 864 Cb 0.07 -2.86 -0.09 0.00 -1.51 0.00 0.00 37.83 33.43 2vl4 s LYS 864 CO -0.10 -0.17 0.93 -1.21 -0.36 0.00 0.00 175.35 174.44 2vl4 s GLU 865 N 1.33 4.78 0.36 4.03 0.41 -1.26 -5.09 118.70 123.26 2vl4 s GLU 865 Ca 0.04 1.43 0.08 0.00 -0.41 0.00 0.00 54.97 56.11 2vl4 s GLU 865 Cb -0.14 -3.18 -0.03 0.00 -1.78 0.00 0.00 34.13 28.99 2vl4 s GLU 865 CO -0.05 0.48 0.23 -1.01 -0.49 0.00 0.00 175.26 174.42 2vl4 s HIS 866 N -1.26 2.77 -2.00 1.61 3.76 -1.26 -5.33 115.29 113.58 2vl4 s HIS 866 Ca 0.42 -0.39 0.00 0.00 -0.15 0.00 0.00 55.06 54.95 2vl4 s HIS 866 Cb -0.24 -1.80 0.01 0.00 1.11 0.00 0.00 32.58 31.66 2vl4 s HIS 866 CO 0.30 0.21 0.51 0.72 -0.85 0.00 0.00 174.74 175.62