#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vlj n HIS -1 N 0.00 2.23 -2.27 4.41 -0.00 -1.26 -4.33 115.22 114.00 1vlj n HIS -1 Ca 0.00 -3.11 -0.41 0.00 -0.00 0.00 0.00 57.72 54.20 1vlj n HIS -1 Cb 0.00 -0.27 -0.03 0.00 -0.00 0.00 0.00 29.99 29.69 1vlj n HIS -1 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 1vlj s HIS 0 N -3.26 3.28 -0.37 4.41 2.46 -1.26 -4.52 115.29 116.01 1vlj s HIS 0 Ca 0.38 1.52 -0.13 0.00 0.47 0.00 0.00 55.06 57.31 1vlj s HIS 0 Cb 0.41 -3.51 0.01 0.00 -0.13 0.00 0.00 32.58 29.36 1vlj s HIS 0 CO -0.08 -1.32 0.25 1.41 -2.47 0.00 0.00 174.74 172.53 1vlj s MET 1 N -1.57 3.11 0.49 2.88 0.00 -1.26 -4.04 119.30 118.90 1vlj s MET 1 Ca 0.47 -0.91 -0.22 0.00 0.00 0.00 0.00 55.69 55.04 1vlj s MET 1 Cb -0.36 -3.84 -0.07 0.00 0.00 0.00 0.00 34.83 30.56 1vlj s MET 1 CO 0.47 -0.63 1.13 -1.21 0.00 0.00 0.00 175.02 174.79 1vlj s GLU 2 N 1.66 3.66 0.81 4.11 0.41 -0.37 -4.97 118.70 124.00 1vlj s GLU 2 Ca 0.05 1.66 -0.14 0.00 -0.41 0.00 0.00 54.97 56.13 1vlj s GLU 2 Cb -0.18 -2.25 0.03 0.00 -1.78 0.00 0.00 34.13 29.95 1vlj s GLU 2 CO 0.09 -0.61 0.84 0.09 -0.49 0.00 0.00 175.26 175.17 1vlj n ASN 3 N -0.77 -0.27 -3.43 -0.19 4.13 -1.26 -3.95 115.26 109.52 1vlj n ASN 3 Ca 0.09 0.54 -0.12 0.00 1.68 0.00 0.00 54.58 56.77 1vlj n ASN 3 Cb 0.50 -1.36 -0.02 0.00 -1.54 0.00 0.00 39.78 37.36 1vlj n ASN 3 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1vlj s PHE 4 N -2.10 -0.53 -0.09 3.10 -0.12 -1.26 -4.70 117.98 112.29 1vlj s PHE 4 Ca 0.68 0.36 0.04 0.00 -0.05 0.00 0.00 56.93 57.96 1vlj s PHE 4 Cb -0.30 0.55 -0.01 0.00 -0.63 0.00 0.00 43.02 42.64 1vlj s PHE 4 CO 0.56 -0.81 -0.23 0.08 -0.05 0.00 0.00 175.22 174.77 1vlj s VAL 5 N -3.57 2.19 -0.13 -2.49 1.01 -1.26 -5.07 120.40 111.08 1vlj s VAL 5 Ca 0.01 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 61.03 1vlj s VAL 5 Cb -0.01 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.55 1vlj s VAL 5 CO -0.12 0.56 -0.21 0.12 0.00 0.00 0.00 175.10 175.45 1vlj s PHE 6 N 0.18 2.52 -0.22 5.22 2.19 -1.26 -5.04 117.98 121.56 1vlj s PHE 6 Ca -0.13 -1.21 -0.07 0.00 0.33 0.00 0.00 56.93 55.85 1vlj s PHE 6 Cb -0.16 -1.72 0.10 0.00 -1.31 0.00 0.00 43.02 39.93 1vlj s PHE 6 CO 0.07 -0.55 0.45 -1.58 1.83 0.00 0.00 175.22 175.44 1vlj s HIS 7 N 0.74 -0.88 -0.31 10.12 2.46 -1.26 -5.11 115.29 121.05 1vlj s HIS 7 Ca -0.10 1.57 -0.01 0.00 0.47 0.00 0.00 55.06 56.99 1vlj s HIS 7 Cb -0.16 0.35 0.12 0.00 -0.13 0.00 0.00 32.58 32.76 1vlj s HIS 7 CO 0.00 -0.53 0.22 1.21 -2.47 0.00 0.00 174.74 173.18 1vlj s ASN 8 N 2.65 2.58 0.00 9.88 3.84 -1.26 -5.02 114.94 127.61 1vlj s ASN 8 Ca -0.01 -1.26 0.30 0.00 0.21 0.00 0.00 52.86 52.10 1vlj s ASN 8 Cb -0.12 0.03 1.42 0.00 -0.55 0.00 0.00 41.25 42.03 1vlj s ASN 8 CO -0.14 -0.39 1.96 -0.81 -2.79 0.00 0.00 177.10 174.93 1vlj n PRO 9 N 5.00 1.24 -2.21 0.43 -0.04 -1.26 -4.93 135.00 133.23 1vlj n PRO 9 Ca -0.00 -0.46 -0.41 0.00 -0.04 0.00 0.00 63.50 62.59 1vlj n PRO 9 Cb 0.43 -1.49 -0.03 0.00 -0.04 0.00 0.00 33.50 32.37 1vlj n PRO 9 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1vlj s THR 10 N -2.07 3.08 -0.12 0.52 2.01 -1.26 -4.97 115.64 112.82 1vlj s THR 10 Ca 0.41 0.96 -0.19 0.00 0.31 0.00 0.00 61.69 63.18 1vlj s THR 10 Cb 0.21 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 69.07 1vlj s THR 10 CO 0.37 0.18 0.53 -0.75 -0.69 0.00 0.00 174.62 174.26 1vlj s LYS 11 N -0.81 4.34 -0.16 4.92 2.20 -0.64 -5.01 119.74 124.58 1vlj s LYS 11 Ca 0.53 0.53 -0.06 0.00 -0.36 0.00 0.00 55.97 56.61 1vlj s LYS 11 Cb -0.37 -3.46 -0.04 0.00 -1.51 0.00 0.00 37.83 32.46 1vlj s LYS 11 CO 0.43 0.09 0.04 0.42 -0.36 0.00 0.00 175.35 175.97 1vlj s ILE 12 N 0.81 4.60 -0.29 5.43 -1.09 -1.26 -1.21 121.20 128.19 1vlj s ILE 12 Ca 0.28 -0.11 -0.02 0.00 -2.23 0.00 0.00 60.65 58.57 1vlj s ILE 12 Cb -0.16 -3.04 0.04 0.00 -1.58 0.00 0.00 42.46 37.73 1vlj s ILE 12 CO 0.12 0.50 -0.01 -0.69 -1.23 0.00 0.00 174.94 173.63 1vlj s VAL 13 N 0.10 3.02 -0.06 2.92 1.01 -0.39 -4.98 120.40 122.02 1vlj s VAL 13 Ca 0.04 -1.28 0.06 0.00 0.00 0.00 0.00 61.98 60.79 1vlj s VAL 13 Cb -0.12 -2.69 -0.01 0.00 0.00 0.00 0.00 36.38 33.56 1vlj s VAL 13 CO 0.01 -0.04 -0.24 0.12 0.00 0.00 0.00 175.10 174.96 1vlj s PHE 14 N 1.28 2.34 -2.99 5.22 2.19 -1.26 -0.94 117.98 123.81 1vlj s PHE 14 Ca -0.04 -0.73 0.00 0.00 0.33 0.00 0.00 56.93 56.49 1vlj s PHE 14 Cb -0.19 -1.54 0.00 0.00 -1.31 0.00 0.00 43.02 39.98 1vlj s PHE 14 CO -0.02 -0.24 0.00 0.41 1.83 0.00 0.00 175.22 177.21 1vlj n GLY 15 N 3.06 0.96 3.73 13.12 0.00 0.29 -4.98 105.19 121.37 1vlj n GLY 15 Ca -0.18 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.32 1vlj n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vlj s ARG 16 N -1.01 4.25 0.00 1.61 0.52 -1.26 -3.12 118.95 119.94 1vlj s ARG 16 Ca 0.00 2.29 0.00 0.00 -0.52 0.00 0.00 55.73 57.50 1vlj s ARG 16 Cb 0.00 -3.15 0.00 0.00 0.52 0.00 0.00 34.95 32.32 1vlj s ARG 16 CO 0.00 -0.50 0.00 0.41 0.02 0.00 0.00 175.30 175.23 1vlj n GLY 17 N 3.01 0.51 0.08 -3.53 0.00 -1.26 -4.94 105.19 99.05 1vlj n GLY 17 Ca 0.10 -0.50 0.12 0.00 0.00 0.00 0.00 46.02 45.74 1vlj n GLY 17 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1vlj h THR 18 N 0.00 0.00 -0.50 2.61 1.35 -1.92 -3.39 112.91 111.06 1vlj h THR 18 Ca 0.00 -0.66 -0.02 0.00 -0.55 0.00 0.00 66.41 65.19 1vlj h THR 18 Cb 0.00 1.16 -0.02 0.00 -1.73 0.00 0.00 68.15 67.56 1vlj h THR 18 CO 0.00 0.00 0.25 0.40 -0.25 0.00 0.00 175.52 175.92 1vlj h ILE 19 N 0.00 1.17 0.00 6.82 2.04 -1.92 -0.37 117.51 125.25 1vlj h ILE 19 Ca 0.00 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.40 1vlj h ILE 19 Cb 0.83 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 1vlj h ILE 19 CO 0.00 0.19 0.19 -0.65 0.00 0.00 0.00 178.15 177.88 1vlj h PRO 20 N 0.70 0.00 0.00 2.37 0.11 -1.82 -0.77 132.00 132.59 1vlj h PRO 20 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1vlj h PRO 20 Cb 0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.18 1vlj h PRO 20 CO -0.02 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.40 1vlj n LYS 21 N -2.65 0.11 -0.19 1.05 5.02 -0.15 -4.13 118.16 117.23 1vlj n LYS 21 Ca -0.02 0.33 -0.05 0.00 -2.02 0.00 0.00 58.31 56.55 1vlj n LYS 21 Cb 0.23 -1.71 0.04 0.00 -0.02 0.00 0.00 35.03 33.58 1vlj n LYS 21 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 1vlj h ILE 22 N 0.00 1.08 -0.13 -0.18 6.09 -1.30 -1.02 117.51 122.04 1vlj h ILE 22 Ca 0.00 -0.24 -0.07 0.00 -1.37 0.00 0.00 64.86 63.19 1vlj h ILE 22 Cb 0.34 0.33 -0.01 0.00 0.47 0.00 0.00 36.82 37.95 1vlj h ILE 22 CO 0.00 0.13 -0.22 1.23 -3.07 0.00 0.00 178.15 176.21 1vlj h GLY 23 N 0.69 0.25 0.94 8.18 0.00 -1.76 -1.73 103.07 109.63 1vlj h GLY 23 Ca 0.22 -0.18 -0.14 0.00 0.00 0.00 0.00 47.33 47.24 1vlj h GLY 23 CO -0.09 0.16 -0.43 -2.09 0.00 0.00 0.00 176.54 174.10 1vlj h GLU 24 N 0.21 0.61 -0.70 4.80 4.81 -1.51 -0.27 114.58 122.53 1vlj h GLU 24 Ca 0.04 -0.41 -0.04 0.00 -0.13 0.00 0.00 59.36 58.81 1vlj h GLU 24 Cb 0.52 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.93 1vlj h GLU 24 CO 0.04 1.03 0.28 0.93 -0.73 0.00 0.00 179.01 180.56 1vlj h GLU 25 N 0.28 1.04 -0.30 1.92 4.39 -1.01 0.23 114.58 121.13 1vlj h GLU 25 Ca -0.00 -0.19 -0.05 0.00 0.34 0.00 0.00 59.36 59.46 1vlj h GLU 25 Cb 1.03 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 1vlj h GLU 25 CO 0.09 0.86 -0.00 0.82 -1.16 0.00 0.00 179.01 179.62 1vlj h ILE 26 N 0.99 1.26 -0.31 3.13 2.04 -1.24 -2.27 117.51 121.11 1vlj h ILE 26 Ca 0.23 -0.95 0.01 0.00 1.00 0.00 0.00 64.86 65.15 1vlj h ILE 26 Cb 0.20 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 1vlj h ILE 26 CO -0.02 0.31 0.20 0.50 0.00 0.00 0.00 178.15 179.14 1vlj h LYS 27 N 0.33 0.39 0.00 2.37 3.64 -0.81 -2.19 116.57 120.31 1vlj h LYS 27 Ca 0.09 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1vlj h LYS 27 Cb 0.44 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1vlj h LYS 27 CO 0.02 0.26 0.00 -0.91 -2.27 0.00 0.00 179.45 176.55 1vlj h ASN 28 N 0.40 0.00 0.09 4.20 2.35 -0.85 -0.19 115.58 121.58 1vlj h ASN 28 Ca 0.12 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1vlj h ASN 28 Cb -0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.34 1vlj h ASN 28 CO -0.04 0.00 -0.03 0.00 -1.65 0.00 0.00 177.43 175.71 1vlj n ALA 29 N -2.03 2.67 -0.80 -0.83 0.00 -0.85 -4.92 120.51 113.74 1vlj n ALA 29 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1vlj n ALA 29 Cb 0.26 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.35 1vlj n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vlj n GLY 30 N 1.13 0.52 3.61 0.00 0.00 -0.08 -5.06 105.19 105.31 1vlj n GLY 30 Ca 0.20 -0.71 -0.34 0.00 0.00 0.00 0.00 46.02 45.17 1vlj n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vlj s ILE 31 N -2.00 4.09 -0.06 -0.61 1.01 -1.06 -5.00 121.20 117.57 1vlj s ILE 31 Ca 0.00 -0.32 0.04 0.00 0.00 0.00 0.00 60.65 60.37 1vlj s ILE 31 Cb 0.00 -2.73 -0.07 0.00 0.01 0.00 0.00 42.46 39.67 1vlj s ILE 31 CO 0.00 0.57 0.00 -1.14 0.00 0.00 0.00 174.94 174.37 1vlj n ARG 32 N 2.61 2.39 -4.51 2.79 0.63 -1.26 -4.08 116.66 115.24 1vlj n ARG 32 Ca -0.18 0.01 -0.29 0.00 -0.92 0.00 0.00 57.85 56.47 1vlj n ARG 32 Cb 0.53 -1.15 -0.17 0.00 0.45 0.00 0.00 32.46 32.12 1vlj n ARG 32 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 1vlj s LYS 33 N -2.14 2.25 0.21 -0.14 2.20 -1.26 -0.34 119.74 120.52 1vlj s LYS 33 Ca -0.05 -0.58 0.06 0.00 -0.36 0.00 0.00 55.97 55.05 1vlj s LYS 33 Cb 0.02 -1.89 -0.05 0.00 -1.51 0.00 0.00 37.83 34.40 1vlj s LYS 33 CO 0.23 -0.04 -0.10 0.14 -0.36 0.00 0.00 175.35 175.21 1vlj s VAL 34 N 0.93 1.53 -0.25 4.02 -7.23 -0.33 -0.26 120.40 118.80 1vlj s VAL 34 Ca -0.08 -2.15 -0.16 0.00 -1.81 0.00 0.00 61.98 57.79 1vlj s VAL 34 Cb -0.15 -2.12 -0.03 0.00 0.56 0.00 0.00 36.38 34.64 1vlj s VAL 34 CO -0.01 -0.54 0.42 -0.22 -0.31 0.00 0.00 175.10 174.45 1vlj s LEU 35 N -3.31 4.06 -0.47 1.32 2.96 -0.58 -1.68 118.68 120.99 1vlj s LEU 35 Ca 0.23 0.40 -0.18 0.00 -0.22 0.00 0.00 54.13 54.36 1vlj s LEU 35 Cb 0.01 -2.52 0.04 0.00 0.50 0.00 0.00 46.19 44.23 1vlj s LEU 35 CO 0.07 -0.19 0.55 0.12 -1.32 0.00 0.00 176.35 175.57 1vlj s PHE 36 N 2.00 3.10 -0.12 5.38 2.19 0.12 0.31 117.98 130.96 1vlj s PHE 36 Ca 0.18 -0.46 -0.03 0.00 0.33 0.00 0.00 56.93 56.95 1vlj s PHE 36 Cb -0.16 -3.29 -0.03 0.00 -1.31 0.00 0.00 43.02 38.24 1vlj s PHE 36 CO 0.09 -0.89 -0.01 -1.17 1.83 0.00 0.00 175.22 175.07 1vlj s LEU 37 N 2.42 3.46 0.00 6.12 2.96 0.87 -1.49 118.68 133.02 1vlj s LEU 37 Ca 0.14 0.02 -0.02 0.00 -0.22 0.00 0.00 54.13 54.05 1vlj s LEU 37 Cb -0.18 -1.81 0.01 0.00 0.50 0.00 0.00 46.19 44.70 1vlj s LEU 37 CO 0.13 0.27 0.43 0.00 -1.32 0.00 0.00 176.35 175.86 1vlj n TYR 38 N 2.84 -1.34 0.00 5.38 4.11 -0.55 -1.60 117.16 126.00 1vlj n TYR 38 Ca -0.18 -1.97 0.00 0.00 -0.00 0.00 0.00 57.90 55.75 1vlj n TYR 38 Cb 0.53 0.48 0.00 0.00 -0.00 0.00 0.00 39.34 40.35 1vlj n TYR 38 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1vlj n GLY 39 N -0.49 0.99 0.64 -7.48 0.00 -1.26 -2.18 105.19 95.41 1vlj n GLY 39 Ca 0.00 -0.59 0.10 0.00 0.00 0.00 0.00 46.02 45.53 1vlj n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vlj n GLY 40 N 5.00 0.51 0.00 -0.02 0.00 -1.24 -1.13 105.19 108.32 1vlj n GLY 40 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1vlj n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vlj n GLY 41 N 1.16 0.81 0.40 -0.02 0.00 -1.26 -4.98 105.19 101.29 1vlj n GLY 41 Ca 0.16 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.36 1vlj n GLY 41 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1vlj h SER 42 N 0.00 0.41 0.91 1.61 4.64 -2.00 -1.97 113.55 117.15 1vlj h SER 42 Ca 0.00 0.04 -0.02 0.00 -0.47 0.00 0.00 61.79 61.33 1vlj h SER 42 Cb 0.00 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1vlj h SER 42 CO 0.00 0.18 -0.11 0.16 -0.87 0.00 0.00 176.83 176.18 1vlj h ILE 43 N 0.41 0.30 0.00 0.95 3.07 -1.94 -2.13 117.51 118.17 1vlj h ILE 43 Ca 0.45 -0.78 -0.03 0.00 1.55 0.00 0.00 64.86 66.05 1vlj h ILE 43 Cb 1.09 1.60 -0.00 0.00 -0.27 0.00 0.00 36.82 39.24 1vlj h ILE 43 CO -0.16 0.11 -0.24 0.11 -1.05 0.00 0.00 178.15 176.91 1vlj h LYS 44 N 0.00 0.00 0.00 0.16 1.57 -1.75 -0.12 116.57 116.43 1vlj h LYS 44 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1vlj h LYS 44 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1vlj h LYS 44 CO 0.01 0.12 -1.04 1.17 -0.57 0.00 0.00 179.45 179.14 1vlj n LYS 45 N -3.08 0.41 -0.14 3.15 4.81 -0.85 -4.36 118.16 118.09 1vlj n LYS 45 Ca 0.03 0.03 0.06 0.00 -0.87 0.00 0.00 58.31 57.55 1vlj n LYS 45 Cb 0.58 -1.66 0.12 0.00 0.02 0.00 0.00 35.03 34.09 1vlj n LYS 45 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 1vlj n ASN 46 N -2.21 2.66 0.00 3.14 0.23 -0.90 -5.00 115.26 113.18 1vlj n ASN 46 Ca 0.01 -2.49 0.00 0.00 -0.53 0.00 0.00 54.58 51.57 1vlj n ASN 46 Cb 0.48 -0.27 0.00 0.00 -2.08 0.00 0.00 39.78 37.91 1vlj n ASN 46 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1vlj n GLY 47 N -0.53 2.80 0.11 4.83 0.00 -1.23 -4.91 105.19 106.25 1vlj n GLY 47 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 1vlj n GLY 47 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1vlj h VAL 48 N 0.00 1.08 -0.45 1.61 2.07 -1.81 -1.92 116.25 116.82 1vlj h VAL 48 Ca 0.00 -0.19 0.09 0.00 0.82 0.00 0.00 66.70 67.42 1vlj h VAL 48 Cb 0.00 0.86 -0.08 0.00 -1.52 0.00 0.00 31.29 30.55 1vlj h VAL 48 CO 0.00 0.07 -0.07 0.22 0.02 0.00 0.00 177.57 177.81 1vlj h TYR 49 N 0.23 -0.17 -0.47 1.57 3.20 -1.37 -1.12 116.97 118.85 1vlj h TYR 49 Ca 0.07 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.92 1vlj h TYR 49 Cb 0.02 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 1vlj h TYR 49 CO -0.05 -0.16 0.07 -0.44 -1.64 0.00 0.00 178.16 175.94 1vlj h ASP 50 N 0.04 0.68 -0.47 -2.11 3.32 -1.70 -1.61 116.42 114.56 1vlj h ASP 50 Ca 0.22 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 1vlj h ASP 50 Cb 0.33 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1vlj h ASP 50 CO -0.43 0.70 0.24 1.56 -1.72 0.00 0.00 179.24 179.59 1vlj h GLN 51 N 0.70 0.68 0.02 3.56 4.20 -0.55 -1.54 115.11 122.17 1vlj h GLN 51 Ca 0.15 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.77 1vlj h GLN 51 Cb 0.32 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1vlj h GLN 51 CO 0.00 0.56 -0.01 0.28 -0.67 0.00 0.00 178.83 179.00 1vlj h VAL 52 N 0.62 1.21 -0.80 -0.54 2.07 -0.95 -2.11 116.25 115.75 1vlj h VAL 52 Ca 0.16 -0.69 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1vlj h VAL 52 Cb 0.10 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 1vlj h VAL 52 CO -0.02 0.18 0.47 0.58 0.02 0.00 0.00 177.57 178.80 1vlj h VAL 53 N -0.32 1.23 -0.72 2.57 2.07 -1.29 0.31 116.25 120.10 1vlj h VAL 53 Ca -0.00 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 66.96 1vlj h VAL 53 Cb 0.31 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 1vlj h VAL 53 CO 0.00 0.24 0.32 0.44 0.02 0.00 0.00 177.57 178.60 1vlj h ASP 54 N 1.10 0.95 -0.27 0.57 3.32 -1.28 -0.71 116.42 120.11 1vlj h ASP 54 Ca 0.29 -0.12 -0.18 0.00 0.02 0.00 0.00 57.03 57.04 1vlj h ASP 54 Cb -0.02 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.29 1vlj h ASP 54 CO -0.05 0.82 -0.52 -1.28 -1.72 0.00 0.00 179.24 176.49 1vlj h SER 55 N 1.03 0.92 -0.10 6.45 0.87 -0.63 -1.28 113.55 120.82 1vlj h SER 55 Ca 0.25 -0.54 -0.00 0.00 -1.23 0.00 0.00 61.79 60.26 1vlj h SER 55 Cb 0.14 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 61.83 1vlj h SER 55 CO -0.03 1.29 0.05 -0.07 -0.53 0.00 0.00 176.83 177.54 1vlj h LEU 56 N 0.59 0.14 -0.36 2.23 3.38 -0.75 -2.20 115.31 118.33 1vlj h LEU 56 Ca 0.01 -0.13 0.05 0.00 0.09 0.00 0.00 57.88 57.90 1vlj h LEU 56 Cb 1.13 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.80 1vlj h LEU 56 CO 0.12 0.23 0.09 0.11 0.09 0.00 0.00 178.44 179.07 1vlj h LYS 57 N 0.04 0.21 -0.85 1.13 1.57 -1.12 -0.93 116.57 116.63 1vlj h LYS 57 Ca 0.04 -0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.86 1vlj h LYS 57 Cb 0.13 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.34 1vlj h LYS 57 CO -0.00 0.14 0.55 -0.22 -0.57 0.00 0.00 179.45 179.35 1vlj h LYS 58 N 0.22 0.94 -0.71 3.15 3.64 -1.09 -2.37 116.57 120.33 1vlj h LYS 58 Ca 0.17 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1vlj h LYS 58 Cb 0.18 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1vlj h LYS 58 CO -0.21 0.62 0.00 0.72 -2.27 0.00 0.00 179.45 178.31 1vlj n HIS 59 N -4.48 1.10 -1.39 1.91 8.25 -0.84 -4.95 115.22 114.81 1vlj n HIS 59 Ca 0.12 -0.53 -0.05 0.00 -0.26 0.00 0.00 57.72 57.01 1vlj n HIS 59 Cb 0.19 -0.06 -0.02 0.00 1.12 0.00 0.00 29.99 31.22 1vlj n HIS 59 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1vlj n GLY 60 N 1.52 0.61 3.68 -1.41 0.00 -0.84 -4.88 105.19 103.87 1vlj n GLY 60 Ca 0.25 -0.80 -0.39 0.00 0.00 0.00 0.00 46.02 45.08 1vlj n GLY 60 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vlj s ILE 61 N -2.20 5.12 0.03 -0.61 -1.09 -0.41 -4.95 121.20 117.09 1vlj s ILE 61 Ca 0.00 0.99 -0.14 0.00 -2.23 0.00 0.00 60.65 59.27 1vlj s ILE 61 Cb 0.00 -3.85 -0.06 0.00 -1.58 0.00 0.00 42.46 36.97 1vlj s ILE 61 CO 0.00 0.22 0.42 -0.70 -1.23 0.00 0.00 174.94 173.65 1vlj s GLU 62 N 1.30 3.89 0.03 2.79 2.12 0.54 -4.37 118.70 125.01 1vlj s GLU 62 Ca 0.26 0.37 -0.03 0.00 0.36 0.00 0.00 54.97 55.93 1vlj s GLU 62 Cb -0.15 -3.15 -0.02 0.00 0.26 0.00 0.00 34.13 31.06 1vlj s GLU 62 CO 0.10 0.65 0.03 1.67 -0.54 0.00 0.00 175.26 177.17 1vlj s TRP 63 N -1.17 0.29 0.17 5.30 -2.14 -1.26 -1.19 118.94 118.94 1vlj s TRP 63 Ca 0.27 -0.64 0.10 0.00 2.66 0.00 0.00 56.10 58.49 1vlj s TRP 63 Cb -0.16 -0.22 -0.04 0.00 -3.10 0.00 0.00 33.47 29.95 1vlj s TRP 63 CO 0.15 -0.31 -0.19 0.14 -2.66 0.00 0.00 176.95 174.07 1vlj s VAL 64 N -2.56 2.65 0.05 -0.66 -7.23 -0.68 -4.97 120.40 107.01 1vlj s VAL 64 Ca -0.06 -1.82 0.08 0.00 -1.81 0.00 0.00 61.98 58.37 1vlj s VAL 64 Cb -0.02 -2.27 -0.03 0.00 0.56 0.00 0.00 36.38 34.62 1vlj s VAL 64 CO -0.05 -0.06 -0.20 -1.61 -0.31 0.00 0.00 175.10 172.87 1vlj s GLU 65 N -2.58 1.98 -0.05 4.82 2.02 -1.26 0.15 118.70 123.77 1vlj s GLU 65 Ca 0.21 -1.03 -0.01 0.00 0.02 0.00 0.00 54.97 54.16 1vlj s GLU 65 Cb -0.09 -2.13 0.03 0.00 0.10 0.00 0.00 34.13 32.04 1vlj s GLU 65 CO 0.11 0.53 -0.00 0.08 0.02 0.00 0.00 175.26 176.00 1vlj s VAL 66 N -0.91 0.32 0.53 2.63 1.01 -0.55 -4.96 120.40 118.46 1vlj s VAL 66 Ca 0.14 0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.24 1vlj s VAL 66 Cb -0.10 -0.45 0.01 0.00 0.00 0.00 0.00 36.38 35.83 1vlj s VAL 66 CO 0.05 0.22 0.11 -0.94 0.00 0.00 0.00 175.10 174.54 1vlj s SER 67 N 1.60 4.27 0.00 3.32 1.04 -1.26 -1.48 113.70 121.18 1vlj s SER 67 Ca -0.01 -1.57 0.00 0.00 0.48 0.00 0.00 55.95 54.85 1vlj s SER 67 Cb -0.13 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1vlj s SER 67 CO -0.03 -0.95 0.00 0.61 0.98 0.00 0.00 173.24 173.85 1vlj n GLY 68 N -1.42 0.76 3.69 7.32 0.00 -0.28 -4.89 105.19 110.37 1vlj n GLY 68 Ca -0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.42 1vlj n GLY 68 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1vlj n VAL 69 N -2.09 1.00 -3.88 1.61 0.31 -0.93 -4.81 118.33 109.55 1vlj n VAL 69 Ca 0.00 -0.25 -0.31 0.00 -0.01 0.00 0.00 64.34 63.77 1vlj n VAL 69 Cb 0.00 -1.60 -0.04 0.00 -0.91 0.00 0.00 33.84 31.29 1vlj n VAL 69 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1vlj s LYS 70 N -0.48 3.47 0.49 5.55 1.02 -1.26 -3.60 119.74 124.93 1vlj s LYS 70 Ca 0.67 -0.37 0.30 0.00 0.02 0.00 0.00 55.97 56.59 1vlj s LYS 70 Cb -0.61 -3.02 1.40 0.00 -0.52 0.00 0.00 37.83 35.08 1vlj s LYS 70 CO 0.50 0.60 1.78 -1.35 -0.92 0.00 0.00 175.35 175.95 1vlj h PRO 71 N 3.13 0.13 -4.48 -1.68 0.11 -1.97 -2.57 132.00 124.68 1vlj h PRO 71 Ca -0.46 -0.01 -0.70 0.00 0.11 0.00 0.00 66.00 64.94 1vlj h PRO 71 Cb 1.16 -0.03 -0.32 0.00 0.11 0.00 0.00 31.00 31.92 1vlj h PRO 71 CO 0.75 0.09 -0.52 -0.80 -0.21 0.00 0.00 178.00 177.30 1vlj s ASN 72 N -5.12 5.37 0.43 -2.05 0.01 -1.26 -4.65 114.94 107.67 1vlj s ASN 72 Ca -0.06 -1.80 -0.24 0.00 -0.71 0.00 0.00 52.86 50.05 1vlj s ASN 72 Cb 0.24 -1.88 -0.08 0.00 0.41 0.00 0.00 41.25 39.94 1vlj s ASN 72 CO 0.81 -0.53 1.15 -2.16 -1.51 0.00 0.00 177.10 174.86 1vlj s PRO 73 N 1.25 3.94 0.13 -0.60 0.04 -0.97 -4.82 135.00 133.97 1vlj s PRO 73 Ca 0.05 1.78 0.07 0.00 0.04 0.00 0.00 61.00 62.93 1vlj s PRO 73 Cb -0.23 -2.54 -0.04 0.00 0.04 0.00 0.00 34.50 31.73 1vlj s PRO 73 CO -0.02 -0.40 -0.04 0.14 0.04 0.00 0.00 177.00 176.72 1vlj s VAL 74 N -1.50 3.67 0.33 -0.36 -7.23 -1.26 -0.87 120.40 113.19 1vlj s VAL 74 Ca 0.60 -1.27 0.04 0.00 -1.81 0.00 0.00 61.98 59.54 1vlj s VAL 74 Cb -0.29 -2.78 0.17 0.00 0.56 0.00 0.00 36.38 34.04 1vlj s VAL 74 CO 0.36 0.02 1.88 0.25 -0.31 0.00 0.00 175.10 177.30 1vlj h LEU 75 N 3.19 0.53 -0.85 1.32 5.85 -1.34 -2.86 115.31 121.15 1vlj h LEU 75 Ca -0.48 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.16 1vlj h LEU 75 Cb 1.18 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.03 1vlj h LEU 75 CO 0.56 0.58 0.56 0.77 -0.34 0.00 0.00 178.44 180.57 1vlj h SER 76 N 0.55 0.98 -0.49 1.25 4.64 -1.97 0.64 113.55 119.16 1vlj h SER 76 Ca 0.12 -0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.28 1vlj h SER 76 Cb 0.30 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 1vlj h SER 76 CO 0.01 0.71 -0.20 0.50 -0.87 0.00 0.00 176.83 176.98 1vlj h LYS 77 N 1.15 1.01 -0.51 4.77 1.63 -1.94 -1.32 116.57 121.36 1vlj h LYS 77 Ca 0.31 -0.42 0.04 0.00 -0.85 0.00 0.00 60.65 59.73 1vlj h LYS 77 Cb -0.13 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.42 1vlj h LYS 77 CO -0.07 1.10 0.27 0.28 -3.45 0.00 0.00 179.45 177.58 1vlj h VAL 78 N 0.87 0.98 -0.45 2.00 2.07 -1.25 -1.00 116.25 119.47 1vlj h VAL 78 Ca 0.12 -0.18 0.06 0.00 0.82 0.00 0.00 66.70 67.52 1vlj h VAL 78 Cb 0.78 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 1vlj h VAL 78 CO 0.06 0.10 0.16 0.45 0.02 0.00 0.00 177.57 178.36 1vlj h HIS 79 N 0.53 0.28 -0.23 1.57 3.86 -0.55 0.12 115.15 120.73 1vlj h HIS 79 Ca 0.22 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.50 1vlj h HIS 79 Cb 0.11 -0.06 -0.04 0.00 1.06 0.00 0.00 27.41 28.48 1vlj h HIS 79 CO -0.09 0.10 -0.04 1.49 0.86 0.00 0.00 177.93 180.24 1vlj h GLU 80 N 0.33 0.02 -0.09 2.45 4.81 -0.91 -1.94 114.58 119.24 1vlj h GLU 80 Ca 0.21 -0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.33 1vlj h GLU 80 Cb 0.22 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1vlj h GLU 80 CO -0.22 0.01 -0.46 0.00 -0.73 0.00 0.00 179.01 177.61 1vlj h ALA 81 N 1.22 1.06 -0.51 2.92 0.00 -0.70 -1.92 119.26 121.33 1vlj h ALA 81 Ca 0.11 -0.44 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 1vlj h ALA 81 Cb 0.16 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1vlj h ALA 81 CO -0.22 0.62 0.16 0.28 0.00 0.00 0.00 179.25 180.10 1vlj h VAL 82 N 0.18 1.23 -0.75 0.00 2.07 -0.53 0.18 116.25 118.64 1vlj h VAL 82 Ca 0.01 -0.76 -0.04 0.00 0.82 0.00 0.00 66.70 66.73 1vlj h VAL 82 Cb 0.88 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 1vlj h VAL 82 CO 0.07 0.28 0.32 -0.33 0.02 0.00 0.00 177.57 177.93 1vlj h GLU 83 N 0.69 1.10 -0.17 1.57 3.07 -0.91 -1.09 114.58 118.83 1vlj h GLU 83 Ca 0.16 -0.19 -0.02 0.00 -0.50 0.00 0.00 59.36 58.82 1vlj h GLU 83 Cb 0.27 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 1vlj h GLU 83 CO -0.01 0.89 0.04 0.28 -1.40 0.00 0.00 179.01 178.82 1vlj h VAL 84 N 1.06 1.20 -0.57 3.13 2.07 -1.19 -0.80 116.25 121.16 1vlj h VAL 84 Ca 0.25 -0.64 0.12 0.00 0.82 0.00 0.00 66.70 67.25 1vlj h VAL 84 Cb 0.18 1.29 -0.10 0.00 -1.52 0.00 0.00 31.29 31.15 1vlj h VAL 84 CO -0.02 0.20 -0.05 0.00 0.02 0.00 0.00 177.57 177.71 1vlj h ALA 85 N 0.85 0.49 -0.17 1.67 0.00 -0.79 0.38 119.26 121.68 1vlj h ALA 85 Ca 0.06 0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1vlj h ALA 85 Cb 0.26 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1vlj h ALA 85 CO 0.00 -0.41 -0.14 0.87 0.00 0.00 0.00 179.25 179.57 1vlj h LYS 86 N 0.07 0.40 -0.76 0.00 1.57 -1.11 -2.17 116.57 114.56 1vlj h LYS 86 Ca 0.29 -0.20 -0.06 0.00 -1.87 0.00 0.00 60.65 58.81 1vlj h LYS 86 Cb 0.45 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 1vlj h LYS 86 CO -0.52 0.74 0.25 -0.22 -0.57 0.00 0.00 179.45 179.13 1vlj h LYS 87 N 0.05 1.17 -0.17 3.15 3.64 -0.84 -2.64 116.57 120.94 1vlj h LYS 87 Ca 0.03 -0.24 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1vlj h LYS 87 Cb 0.65 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 1vlj h LYS 87 CO 0.04 0.98 0.00 0.39 -2.27 0.00 0.00 179.45 178.59 1vlj n GLU 88 N -4.25 1.89 -3.89 1.90 -0.58 0.10 -4.95 120.64 110.86 1vlj n GLU 88 Ca 0.06 -1.33 -0.28 0.00 -0.42 0.00 0.00 57.16 55.19 1vlj n GLU 88 Cb 0.22 -1.43 0.02 0.00 -0.57 0.00 0.00 31.44 29.68 1vlj n GLU 88 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1vlj n LYS 89 N 0.57 -4.98 -1.84 3.49 5.02 -0.87 -4.93 118.16 114.61 1vlj n LYS 89 Ca 0.17 0.57 -0.35 0.00 -2.02 0.00 0.00 58.31 56.67 1vlj n LYS 89 Cb 0.40 -5.29 0.05 0.00 -0.02 0.00 0.00 35.03 30.17 1vlj n LYS 89 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1vlj s VAL 90 N -3.46 2.55 -0.89 -0.18 -7.23 -0.87 -4.94 120.40 105.38 1vlj s VAL 90 Ca 0.44 0.32 0.16 0.00 -1.81 0.00 0.00 61.98 61.09 1vlj s VAL 90 Cb -0.22 -3.04 -0.15 0.00 0.56 0.00 0.00 36.38 33.52 1vlj s VAL 90 CO 0.84 -0.10 0.72 -0.62 -0.31 0.00 0.00 175.10 175.63 1vlj n GLU 91 N -1.93 1.62 -3.71 4.82 1.02 0.64 -4.98 120.64 118.12 1vlj n GLU 91 Ca 0.14 -0.13 -0.06 0.00 -0.02 0.00 0.00 57.16 57.09 1vlj n GLU 91 Cb 0.50 -1.28 -0.02 0.00 -0.02 0.00 0.00 31.44 30.63 1vlj n GLU 91 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1vlj s ALA 92 N -2.46 -1.58 -0.11 0.62 0.00 -1.23 -4.17 121.76 112.83 1vlj s ALA 92 Ca 0.07 0.20 0.03 0.00 0.00 0.00 0.00 51.96 52.27 1vlj s ALA 92 Cb 0.13 0.67 0.00 0.00 0.00 0.00 0.00 23.12 23.92 1vlj s ALA 92 CO 0.63 -0.96 -0.22 0.08 0.00 0.00 0.00 175.76 175.29 1vlj s VAL 93 N -3.43 2.15 -0.34 0.00 1.01 -0.28 -1.52 120.40 117.99 1vlj s VAL 93 Ca 0.10 -0.98 -0.05 0.00 0.00 0.00 0.00 61.98 61.05 1vlj s VAL 93 Cb -0.02 -1.84 0.05 0.00 0.00 0.00 0.00 36.38 34.57 1vlj s VAL 93 CO 0.00 0.55 0.10 -0.22 0.00 0.00 0.00 175.10 175.54 1vlj s LEU 94 N 0.49 4.35 -0.16 3.92 2.96 0.15 -1.10 118.68 129.28 1vlj s LEU 94 Ca -0.15 -1.24 -0.14 0.00 -0.22 0.00 0.00 54.13 52.38 1vlj s LEU 94 Cb -0.17 -1.84 -0.05 0.00 0.50 0.00 0.00 46.19 44.63 1vlj s LEU 94 CO 0.06 -0.34 0.31 -0.83 -1.32 0.00 0.00 176.35 174.23 1vlj s GLY 95 N 1.45 2.21 -0.29 7.98 0.00 -0.41 -0.09 107.32 118.17 1vlj s GLY 95 Ca -0.01 -0.44 0.00 0.00 0.00 0.00 0.00 44.72 44.27 1vlj s GLY 95 CO 0.02 0.48 0.06 0.14 0.00 0.00 0.00 173.10 173.79 1vlj s VAL 96 N 0.54 1.27 -4.87 1.40 1.01 -0.62 -1.14 120.40 117.99 1vlj s VAL 96 Ca 0.17 -1.52 0.00 0.00 0.00 0.00 0.00 61.98 60.64 1vlj s VAL 96 Cb -0.13 -1.87 0.00 0.00 0.00 0.00 0.00 36.38 34.38 1vlj s VAL 96 CO 0.05 -0.52 0.00 0.61 0.00 0.00 0.00 175.10 175.23 1vlj n GLY 97 N 4.70 -0.50 0.00 4.51 0.00 -0.65 -4.31 105.19 108.93 1vlj n GLY 97 Ca -0.03 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1vlj n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vlj n GLY 98 N 0.00 0.68 0.35 -0.02 0.00 -1.26 -0.71 105.19 104.22 1vlj n GLY 98 Ca 0.00 -1.92 0.05 0.00 0.00 0.00 0.00 46.02 44.15 1vlj n GLY 98 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1vlj h GLY 99 N 0.00 0.92 0.85 -0.02 0.00 -1.97 0.40 103.07 103.25 1vlj h GLY 99 Ca 0.00 -0.31 0.04 0.00 0.00 0.00 0.00 47.33 47.06 1vlj h GLY 99 CO 0.00 0.25 0.54 1.76 0.00 0.00 0.00 176.54 179.09 1vlj h SER 100 N 0.78 0.88 -0.19 0.19 0.02 -1.88 0.23 113.55 113.58 1vlj h SER 100 Ca 0.28 -0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.14 1vlj h SER 100 Cb 0.14 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.48 1vlj h SER 100 CO -0.08 0.60 -0.22 0.58 -1.14 0.00 0.00 176.83 176.56 1vlj h VAL 101 N 1.03 1.34 -0.51 2.27 2.07 -1.54 -1.88 116.25 119.03 1vlj h VAL 101 Ca 0.34 -1.41 -0.12 0.00 0.82 0.00 0.00 66.70 66.33 1vlj h VAL 101 Cb 0.04 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1vlj h VAL 101 CO -0.13 0.43 -0.13 0.58 0.02 0.00 0.00 177.57 178.34 1vlj h VAL 102 N 0.14 1.27 -0.80 2.57 2.07 -0.72 0.20 116.25 120.98 1vlj h VAL 102 Ca 0.02 -1.29 -0.02 0.00 0.82 0.00 0.00 66.70 66.24 1vlj h VAL 102 Cb 0.78 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 1vlj h VAL 102 CO 0.05 0.45 0.43 0.44 0.02 0.00 0.00 177.57 178.96 1vlj h ASP 103 N 0.85 1.00 -0.52 0.57 5.19 -0.62 -0.12 116.42 122.77 1vlj h ASP 103 Ca 0.13 -0.10 -0.03 0.00 -0.62 0.00 0.00 57.03 56.40 1vlj h ASP 103 Cb 0.70 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 39.93 1vlj h ASP 103 CO 0.05 0.82 0.21 0.28 -3.12 0.00 0.00 179.24 177.48 1vlj h SER 104 N 1.11 0.73 -0.83 6.45 0.02 -1.05 -0.77 113.55 119.21 1vlj h SER 104 Ca 0.28 -0.17 0.04 0.00 -0.84 0.00 0.00 61.79 61.10 1vlj h SER 104 Cb 0.04 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 62.34 1vlj h SER 104 CO -0.04 0.70 0.52 0.00 -1.14 0.00 0.00 176.83 176.87 1vlj h ALA 105 N 1.05 1.10 -0.48 3.77 0.00 0.05 -0.89 119.26 123.86 1vlj h ALA 105 Ca 0.17 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.08 1vlj h ALA 105 Cb 0.20 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1vlj h ALA 105 CO -0.01 0.33 0.30 0.87 0.00 0.00 0.00 179.25 180.73 1vlj h LYS 106 N 1.00 0.58 -0.42 0.00 1.57 -0.70 0.18 116.57 118.79 1vlj h LYS 106 Ca 0.34 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.99 1vlj h LYS 106 Cb 0.05 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 1vlj h LYS 106 CO -0.13 0.38 -0.13 0.00 -0.57 0.00 0.00 179.45 179.01 1vlj h ALA 107 N 1.21 1.00 -0.30 3.86 0.00 -0.51 -2.05 119.26 122.46 1vlj h ALA 107 Ca 0.19 -0.32 -0.15 0.00 0.00 0.00 0.00 54.91 54.63 1vlj h ALA 107 Cb -0.01 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1vlj h ALA 107 CO -0.08 0.60 -0.41 0.28 0.00 0.00 0.00 179.25 179.65 1vlj h VAL 108 N 0.68 1.29 -0.87 0.00 2.07 -0.99 0.89 116.25 119.32 1vlj h VAL 108 Ca 0.11 -1.59 0.04 0.00 0.82 0.00 0.00 66.70 66.08 1vlj h VAL 108 Cb 0.60 1.60 -0.05 0.00 -1.52 0.00 0.00 31.29 31.92 1vlj h VAL 108 CO 0.04 0.52 0.57 0.00 0.02 0.00 0.00 177.57 178.72 1vlj h ALA 109 N 0.69 1.46 -0.06 1.67 0.00 -0.69 0.82 119.26 123.15 1vlj h ALA 109 Ca 0.03 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1vlj h ALA 109 Cb 1.00 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1vlj h ALA 109 CO 0.10 0.45 -0.19 0.00 0.00 0.00 0.00 179.25 179.60 1vlj h ALA 110 N 1.49 0.11 0.00 0.00 0.00 -1.23 -1.51 119.26 118.13 1vlj h ALA 110 Ca 0.35 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1vlj h ALA 110 Cb 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1vlj h ALA 110 CO -0.11 0.06 -0.24 0.78 0.00 0.00 0.00 179.25 179.75 1vlj h GLY 111 N -0.26 0.00 1.64 0.00 0.00 -0.50 -1.89 103.07 102.06 1vlj h GLY 111 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.37 1vlj h GLY 111 CO 0.04 0.00 0.14 0.00 0.00 0.00 0.00 176.54 176.72 1vlj h ALA 112 N 1.76 1.84 -0.46 3.60 0.00 -0.92 -1.62 119.26 123.47 1vlj h ALA 112 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1vlj h ALA 112 Cb 0.46 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1vlj h ALA 112 CO 0.03 -0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.35 1vlj n LEU 113 N -3.99 3.57 -4.15 0.00 4.77 -0.72 -4.86 117.00 111.63 1vlj n LEU 113 Ca 0.01 -2.22 -0.29 0.00 -0.03 0.00 0.00 56.01 53.47 1vlj n LEU 113 Cb 0.26 -0.38 -0.17 0.00 -2.33 0.00 0.00 43.42 40.80 1vlj n LEU 113 CO 0.29 0.79 -0.53 -0.47 -1.33 0.00 0.00 177.39 176.14 1vlj s TYR 114 N -1.40 2.13 0.29 -1.77 5.04 -0.61 -5.01 117.35 116.02 1vlj s TYR 114 Ca 0.35 -0.84 0.23 0.00 -2.44 0.00 0.00 57.07 54.38 1vlj s TYR 114 Cb 0.21 -1.46 1.07 0.00 0.35 0.00 0.00 41.96 42.13 1vlj s TYR 114 CO 0.20 -0.35 1.91 1.49 -1.34 0.00 0.00 175.55 177.45 1vlj h GLU 115 N 6.76 0.00 0.00 4.97 4.22 -1.92 -3.45 114.58 125.15 1vlj h GLU 115 Ca -0.24 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.20 1vlj h GLU 115 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1vlj h GLU 115 CO 0.47 0.23 0.00 0.41 -2.18 0.00 0.00 179.01 177.94 1vlj n GLY 116 N -0.28 1.20 3.61 1.92 0.00 -1.26 -5.04 105.19 105.34 1vlj n GLY 116 Ca -0.01 -1.88 -0.41 0.00 0.00 0.00 0.00 46.02 43.72 1vlj n GLY 116 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vlj s ASP 117 N -1.00 6.56 0.50 1.61 -1.08 -1.26 -4.93 116.67 117.07 1vlj s ASP 117 Ca 0.00 0.56 0.29 0.00 -0.52 0.00 0.00 52.55 52.88 1vlj s ASP 117 Cb 0.00 -2.35 1.57 0.00 -1.46 0.00 0.00 42.92 40.69 1vlj s ASP 117 CO 0.00 -0.47 1.87 -0.29 0.52 0.00 0.00 175.17 176.80 1vlj h ILE 118 N 5.51 0.00 -0.25 4.11 6.09 -1.91 -0.39 117.51 130.67 1vlj h ILE 118 Ca -0.26 0.00 0.07 0.00 -1.37 0.00 0.00 64.86 63.30 1vlj h ILE 118 Cb 1.11 0.64 -0.01 0.00 0.47 0.00 0.00 36.82 39.04 1vlj h ILE 118 CO 0.81 0.00 0.25 -0.25 -3.07 0.00 0.00 178.15 175.89 1vlj h TRP 119 N 0.00 0.00 -1.03 2.19 2.91 -1.98 -1.56 115.95 116.48 1vlj h TRP 119 Ca 0.00 0.00 0.26 0.00 1.13 0.00 0.00 58.89 60.28 1vlj h TRP 119 Cb 0.24 0.00 -0.11 0.00 -0.51 0.00 0.00 29.16 28.78 1vlj h TRP 119 CO 0.00 0.00 0.63 -0.44 -1.03 0.00 0.00 178.44 177.60 1vlj h ASP 120 N 0.00 0.57 0.37 2.65 3.32 -1.45 0.15 116.42 122.01 1vlj h ASP 120 Ca 0.12 0.12 -0.05 0.00 0.02 0.00 0.00 57.03 57.24 1vlj h ASP 120 Cb 0.61 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 1vlj h ASP 120 CO -0.00 0.08 -0.22 0.00 -1.72 0.00 0.00 179.24 177.38 1vlj h ALA 121 N 1.68 1.39 -0.00 3.45 0.00 -1.43 0.20 119.26 124.55 1vlj h ALA 121 Ca 0.63 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1vlj h ALA 121 Cb 1.39 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1vlj h ALA 121 CO -0.40 0.27 -0.24 1.19 0.00 0.00 0.00 179.25 180.07 1vlj n PHE 122 N -3.92 0.00 -1.45 0.00 3.01 0.50 -3.79 117.46 111.82 1vlj n PHE 122 Ca -0.02 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.51 1vlj n PHE 122 Cb 0.31 -0.34 0.10 0.00 -0.01 0.00 0.00 39.48 39.54 1vlj n PHE 122 CO 0.00 0.00 0.00 0.44 1.01 0.00 0.00 176.76 178.21 1vlj n ILE 123 N -1.42 1.31 -1.02 4.37 -5.35 -1.03 -4.53 119.36 111.70 1vlj n ILE 123 Ca 0.07 -1.68 -0.01 0.00 -0.27 0.00 0.00 62.75 60.86 1vlj n ILE 123 Cb 0.33 0.02 -0.00 0.00 -1.74 0.00 0.00 39.64 38.25 1vlj n ILE 123 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1vlj n GLY 124 N -0.92 0.48 0.48 3.28 0.00 -0.94 -4.89 105.19 102.68 1vlj n GLY 124 Ca 0.11 -0.46 0.11 0.00 0.00 0.00 0.00 46.02 45.79 1vlj n GLY 124 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1vlj n LYS 125 N -2.80 1.21 -3.70 1.61 5.02 0.02 -4.91 118.16 114.61 1vlj n LYS 125 Ca -0.01 -0.96 -0.11 0.00 -2.02 0.00 0.00 58.31 55.22 1vlj n LYS 125 Cb 0.05 -1.48 -0.10 0.00 -0.02 0.00 0.00 35.03 33.47 1vlj n LYS 125 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1vlj s TYR 126 N -2.45 -0.60 -0.38 2.13 5.04 -1.16 -4.88 117.35 115.04 1vlj s TYR 126 Ca 0.20 1.31 -0.14 0.00 -2.44 0.00 0.00 57.07 56.00 1vlj s TYR 126 Cb 0.18 0.27 0.00 0.00 0.35 0.00 0.00 41.96 42.76 1vlj s TYR 126 CO 0.55 -0.33 0.30 -1.14 -1.34 0.00 0.00 175.55 173.58 1vlj s GLN 127 N 1.20 3.24 -0.42 4.97 2.00 -1.26 -4.09 119.66 125.29 1vlj s GLN 127 Ca -0.08 -0.79 -0.28 0.00 -2.00 0.00 0.00 55.36 52.21 1vlj s GLN 127 Cb -0.07 -3.90 -0.01 0.00 0.80 0.00 0.00 33.01 29.83 1vlj s GLN 127 CO -0.11 -0.62 1.73 0.42 -0.50 0.00 0.00 175.29 176.21 1vlj s ILE 128 N 1.78 3.53 -0.09 -2.34 1.01 -1.26 -4.78 121.20 119.05 1vlj s ILE 128 Ca 0.07 0.50 0.17 0.00 0.00 0.00 0.00 60.65 61.39 1vlj s ILE 128 Cb -0.18 -3.85 -0.26 0.00 0.01 0.00 0.00 42.46 38.18 1vlj s ILE 128 CO 0.11 -0.63 0.40 -0.62 0.00 0.00 0.00 174.94 174.21 1vlj n GLU 129 N 8.56 0.60 -3.87 2.79 -0.58 -1.26 -4.67 120.64 122.22 1vlj n GLU 129 Ca 0.21 -0.14 -0.11 0.00 -0.42 0.00 0.00 57.16 56.69 1vlj n GLU 129 Cb 0.48 -1.40 -0.10 0.00 -0.57 0.00 0.00 31.44 29.85 1vlj n GLU 129 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 1vlj s LYS 130 N -3.14 0.41 0.08 3.49 0.00 -1.26 -4.70 119.74 114.61 1vlj s LYS 130 Ca -0.05 -0.29 -0.22 0.00 0.00 0.00 0.00 55.97 55.41 1vlj s LYS 130 Cb 0.11 0.17 0.05 0.00 0.00 0.00 0.00 37.83 38.17 1vlj s LYS 130 CO 0.71 -0.09 0.52 0.00 0.00 0.00 0.00 175.35 176.49 1vlj s ALA 131 N -1.09 -1.31 0.78 0.59 0.00 -1.26 -4.71 121.76 114.75 1vlj s ALA 131 Ca -0.12 0.49 -0.14 0.00 0.00 0.00 0.00 51.96 52.19 1vlj s ALA 131 Cb -0.06 0.51 0.07 0.00 0.00 0.00 0.00 23.12 23.63 1vlj s ALA 131 CO 0.01 -0.57 1.21 -0.51 0.00 0.00 0.00 175.76 175.90 1vlj s LEU 132 N -2.22 3.20 0.35 0.00 1.43 -0.57 -4.93 118.68 115.94 1vlj s LEU 132 Ca -0.03 2.38 -0.28 0.00 -1.03 0.00 0.00 54.13 55.17 1vlj s LEU 132 Cb -0.00 -4.59 -0.12 0.00 0.03 0.00 0.00 46.19 41.51 1vlj s LEU 132 CO -0.05 -2.54 1.30 -2.65 0.23 0.00 0.00 176.35 172.64 1vlj n PRO 133 N -3.09 2.14 -5.09 1.29 -0.02 -1.26 -4.81 135.00 124.16 1vlj n PRO 133 Ca 0.14 0.75 -0.32 0.00 -2.02 0.00 0.00 63.50 62.05 1vlj n PRO 133 Cb 0.50 -2.35 -0.16 0.00 -0.02 0.00 0.00 33.50 31.48 1vlj n PRO 133 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1vlj s ILE 134 N -1.11 2.42 0.16 4.25 1.01 -1.26 -1.12 121.20 125.55 1vlj s ILE 134 Ca 0.56 -0.92 0.08 0.00 0.00 0.00 0.00 60.65 60.37 1vlj s ILE 134 Cb -0.56 -1.94 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 1vlj s ILE 134 CO 0.62 0.56 -0.18 -0.36 0.00 0.00 0.00 174.94 175.58 1vlj s PHE 135 N 0.04 1.76 -0.06 3.97 0.40 -0.26 -0.20 117.98 123.63 1vlj s PHE 135 Ca -0.08 -0.48 -0.17 0.00 -0.60 0.00 0.00 56.93 55.60 1vlj s PHE 135 Cb -0.15 -0.88 0.03 0.00 0.51 0.00 0.00 43.02 42.53 1vlj s PHE 135 CO 0.05 0.30 0.39 0.16 0.70 0.00 0.00 175.22 176.82 1vlj s ASP 136 N -2.62 -0.32 -0.28 1.36 -4.77 -0.86 -1.28 116.67 107.90 1vlj s ASP 136 Ca 0.15 0.37 -0.01 0.00 -3.30 0.00 0.00 52.55 49.75 1vlj s ASP 136 Cb -0.06 0.48 0.04 0.00 -1.09 0.00 0.00 42.92 42.30 1vlj s ASP 136 CO 0.06 -0.39 -0.03 -0.69 0.70 0.00 0.00 175.17 174.82 1vlj s VAL 137 N -0.90 2.89 -0.10 2.11 1.01 -0.29 -1.13 120.40 123.98 1vlj s VAL 137 Ca -0.10 -1.29 -0.17 0.00 0.00 0.00 0.00 61.98 60.42 1vlj s VAL 137 Cb -0.04 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.69 1vlj s VAL 137 CO 0.04 -0.01 0.44 -0.22 0.00 0.00 0.00 175.10 175.35 1vlj s LEU 138 N 1.26 4.31 0.00 3.92 2.96 -0.55 -1.64 118.68 128.94 1vlj s LEU 138 Ca -0.04 0.80 0.04 0.00 -0.22 0.00 0.00 54.13 54.71 1vlj s LEU 138 Cb -0.19 -2.63 0.00 0.00 0.50 0.00 0.00 46.19 43.88 1vlj s LEU 138 CO -0.02 0.08 0.44 0.35 -1.32 0.00 0.00 176.35 175.88 1vlj n THR 139 N 3.27 0.00 -3.75 3.68 -2.24 0.11 -4.34 114.28 111.01 1vlj n THR 139 Ca -0.09 -0.47 -0.13 0.00 -2.27 0.00 0.00 64.05 61.09 1vlj n THR 139 Cb 0.52 1.05 -0.13 0.00 -2.10 0.00 0.00 70.33 69.67 1vlj n THR 139 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1vlj s ILE 140 N -0.73 -0.03 -0.22 2.28 2.07 -1.26 -4.38 121.20 118.93 1vlj s ILE 140 Ca 0.03 0.12 -0.16 0.00 -1.41 0.00 0.00 60.65 59.24 1vlj s ILE 140 Cb 0.03 -0.32 -0.04 0.00 0.13 0.00 0.00 42.46 42.26 1vlj s ILE 140 CO 0.09 0.05 0.40 -0.44 -1.91 0.00 0.00 174.94 173.12 1vlj s SER 141 N 0.95 6.39 0.38 4.50 0.01 -1.26 -4.56 113.70 120.11 1vlj s SER 141 Ca -0.07 0.46 0.00 0.00 1.31 0.00 0.00 55.95 57.65 1vlj s SER 141 Cb -0.08 -2.23 0.00 0.00 0.21 0.00 0.00 66.02 63.92 1vlj s SER 141 CO -0.06 -0.11 0.00 0.00 0.41 0.00 0.00 173.24 173.48 1vlj n ALA 142 N 4.71 0.00 0.12 1.44 0.00 -1.26 -4.49 120.51 121.03 1vlj n ALA 142 Ca -0.08 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.47 1vlj n ALA 142 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 1vlj n ALA 142 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1vlj n THR 143 N -3.35 0.60 -1.04 0.00 -2.24 -1.26 -3.11 114.28 103.88 1vlj n THR 143 Ca 0.00 -0.54 -0.02 0.00 -2.27 0.00 0.00 64.05 61.23 1vlj n THR 143 Cb 0.00 -0.32 -0.01 0.00 -2.10 0.00 0.00 70.33 67.90 1vlj n THR 143 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vlj n GLY 144 N 1.19 0.41 0.27 3.38 0.00 -1.24 -4.78 105.19 104.42 1vlj n GLY 144 Ca 0.00 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.03 1vlj n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vlj h THR 145 N 0.00 0.81 0.00 2.61 1.03 -1.92 -1.34 112.91 114.10 1vlj h THR 145 Ca -0.03 -0.12 0.00 0.00 -0.01 0.00 0.00 66.41 66.25 1vlj h THR 145 Cb 0.46 1.07 0.00 0.00 -1.07 0.00 0.00 68.15 68.61 1vlj h THR 145 CO 0.05 0.03 0.24 1.05 -0.01 0.00 0.00 175.52 176.87 1vlj h GLU 146 N 0.00 0.00 -0.40 0.00 9.09 -1.96 -3.13 114.58 118.18 1vlj h GLU 146 Ca -0.00 0.00 -0.24 0.00 0.05 0.00 0.00 59.36 59.17 1vlj h GLU 146 Cb 0.07 0.00 -0.36 0.00 -1.65 0.00 0.00 28.75 26.80 1vlj h GLU 146 CO 0.00 0.00 -1.01 -0.12 0.05 0.00 0.00 179.01 177.94 1vlj n MET 147 N -2.52 1.65 -4.04 1.06 0.00 -0.51 -4.67 117.12 108.10 1vlj n MET 147 Ca -0.02 -3.18 -0.13 0.00 0.00 0.00 0.00 57.70 54.38 1vlj n MET 147 Cb 0.28 -1.31 -0.04 0.00 0.00 0.00 0.00 33.22 32.15 1vlj n MET 147 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1vlj s ASN 148 N -3.40 0.57 -0.20 6.12 2.20 -1.18 -4.40 114.94 114.65 1vlj s ASN 148 Ca 0.25 -1.32 0.15 0.00 -0.94 0.00 0.00 52.86 51.00 1vlj s ASN 148 Cb 0.35 0.66 0.72 0.00 -2.00 0.00 0.00 41.25 40.97 1vlj s ASN 148 CO -0.05 -1.30 1.63 0.61 -2.94 0.00 0.00 177.10 175.06 1vlj n GLY 149 N -0.51 3.28 3.91 0.45 0.00 -1.26 -3.97 105.19 107.08 1vlj n GLY 149 Ca -0.01 -0.94 -0.30 0.00 0.00 0.00 0.00 46.02 44.77 1vlj n GLY 149 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vlj s ASN 150 N -1.15 6.44 -0.17 1.61 0.01 -1.26 -1.45 114.94 118.97 1vlj s ASN 150 Ca 0.50 0.50 -0.15 0.00 -0.71 0.00 0.00 52.86 53.00 1vlj s ASN 150 Cb 0.38 -2.05 0.05 0.00 0.41 0.00 0.00 41.25 40.03 1vlj s ASN 150 CO 0.15 0.01 0.46 0.00 -1.51 0.00 0.00 177.10 176.20 1vlj s ALA 151 N -1.76 -1.14 -0.09 0.60 0.00 -0.57 -4.84 121.76 113.97 1vlj s ALA 151 Ca 0.40 1.36 0.02 0.00 0.00 0.00 0.00 51.96 53.74 1vlj s ALA 151 Cb -0.12 -0.80 0.01 0.00 0.00 0.00 0.00 23.12 22.22 1vlj s ALA 151 CO 0.27 -0.23 -0.14 0.08 0.00 0.00 0.00 175.76 175.74 1vlj s VAL 152 N 0.45 1.34 0.02 0.00 1.01 -1.26 -0.77 120.40 121.20 1vlj s VAL 152 Ca -0.02 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.41 1vlj s VAL 152 Cb -0.04 -1.23 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 1vlj s VAL 152 CO -0.02 0.41 -0.07 -0.63 0.00 0.00 0.00 175.10 174.79 1vlj s ILE 153 N 0.84 0.50 -0.23 2.22 -1.09 -0.55 -4.69 121.20 118.19 1vlj s ILE 153 Ca -0.10 -0.71 -0.08 0.00 -2.23 0.00 0.00 60.65 57.52 1vlj s ILE 153 Cb -0.15 -0.51 -0.04 0.00 -1.58 0.00 0.00 42.46 40.18 1vlj s ILE 153 CO 0.01 -0.16 0.10 -0.89 -1.23 0.00 0.00 174.94 172.77 1vlj s THR 154 N -0.83 4.74 -0.51 2.92 2.01 -0.05 -1.53 115.64 122.39 1vlj s THR 154 Ca -0.05 -0.03 -0.23 0.00 0.31 0.00 0.00 61.69 61.69 1vlj s THR 154 Cb -0.07 -3.20 0.04 0.00 0.01 0.00 0.00 72.50 69.28 1vlj s THR 154 CO 0.00 0.36 0.87 0.21 -0.69 0.00 0.00 174.62 175.37 1vlj s ASN 155 N 1.20 6.36 0.37 3.53 3.84 0.32 -0.81 114.94 129.74 1vlj s ASN 155 Ca 0.05 -0.31 0.10 0.00 0.21 0.00 0.00 52.86 52.91 1vlj s ASN 155 Cb -0.14 -2.41 0.71 0.00 -0.55 0.00 0.00 41.25 38.85 1vlj s ASN 155 CO 0.04 -1.10 1.85 -0.33 -2.79 0.00 0.00 177.10 174.78 1vlj h GLU 156 N 9.18 0.19 0.00 0.43 3.07 -1.97 -0.37 114.58 125.10 1vlj h GLU 156 Ca -0.26 -0.06 -0.08 0.00 -0.50 0.00 0.00 59.36 58.47 1vlj h GLU 156 Cb 1.08 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.96 1vlj h GLU 156 CO 1.04 0.42 -0.38 0.87 -1.40 0.00 0.00 179.01 179.56 1vlj h LYS 157 N 0.17 0.00 -0.01 2.33 1.57 -1.97 -3.16 116.57 115.50 1vlj h LYS 157 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1vlj h LYS 157 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1vlj h LYS 157 CO 0.04 0.38 -0.14 0.25 -0.57 0.00 0.00 179.45 179.41 1vlj n THR 158 N -4.05 0.00 -3.74 -0.16 -2.24 -0.99 -5.00 114.28 98.10 1vlj n THR 158 Ca -0.02 -0.43 -0.26 0.00 -2.27 0.00 0.00 64.05 61.07 1vlj n THR 158 Cb 0.42 1.16 0.05 0.00 -2.10 0.00 0.00 70.33 69.86 1vlj n THR 158 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1vlj n LYS 159 N 0.05 -6.45 -3.82 -0.78 5.02 -0.18 -4.99 118.16 107.01 1vlj n LYS 159 Ca 0.05 0.71 -0.36 0.00 -2.02 0.00 0.00 58.31 56.68 1vlj n LYS 159 Cb 0.23 -5.63 -0.13 0.00 -0.02 0.00 0.00 35.03 29.48 1vlj n LYS 159 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1vlj s GLU 160 N -6.33 3.24 -0.44 1.97 2.02 -1.09 -4.75 118.70 113.32 1vlj s GLU 160 Ca 0.50 -0.74 -0.07 0.00 0.02 0.00 0.00 54.97 54.68 1vlj s GLU 160 Cb -0.24 -3.23 0.11 0.00 0.10 0.00 0.00 34.13 30.87 1vlj s GLU 160 CO 0.78 -0.33 0.29 0.21 0.02 0.00 0.00 175.26 176.23 1vlj s LYS 161 N 1.50 2.37 0.17 1.61 2.20 -1.26 -0.52 119.74 125.81 1vlj s LYS 161 Ca 0.04 -1.72 0.11 0.00 -0.36 0.00 0.00 55.97 54.04 1vlj s LYS 161 Cb -0.16 -3.80 -0.04 0.00 -1.51 0.00 0.00 37.83 32.32 1vlj s LYS 161 CO 0.00 -1.11 -0.25 0.71 -0.36 0.00 0.00 175.35 174.35 1vlj s TYR 162 N 1.31 2.31 0.16 4.03 2.02 -0.59 -4.81 117.35 121.79 1vlj s TYR 162 Ca 0.06 -0.36 0.04 0.00 -0.37 0.00 0.00 57.07 56.44 1vlj s TYR 162 Cb -0.25 -1.17 -0.04 0.00 -0.40 0.00 0.00 41.96 40.10 1vlj s TYR 162 CO -0.01 0.45 0.19 0.20 -1.57 0.00 0.00 175.55 174.82 1vlj s GLY 163 N -2.50 1.69 0.06 0.71 0.00 -1.26 -1.48 107.32 104.53 1vlj s GLY 163 Ca 0.19 -1.16 0.03 0.00 0.00 0.00 0.00 44.72 43.78 1vlj s GLY 163 CO 0.09 -1.17 -0.09 0.54 0.00 0.00 0.00 173.10 172.47 1vlj s VAL 164 N -1.77 0.69 -0.02 1.40 0.11 0.05 -4.81 120.40 116.05 1vlj s VAL 164 Ca 0.32 -1.27 0.02 0.00 -2.93 0.00 0.00 61.98 58.12 1vlj s VAL 164 Cb -0.10 -0.88 0.01 0.00 -1.53 0.00 0.00 36.38 33.87 1vlj s VAL 164 CO 0.25 -0.44 -0.07 -0.44 -3.33 0.00 0.00 175.10 171.08 1vlj s SER 165 N -1.87 0.94 -0.16 3.54 0.01 -1.26 -1.51 113.70 113.38 1vlj s SER 165 Ca -0.05 -0.14 -0.23 0.00 1.31 0.00 0.00 55.95 56.85 1vlj s SER 165 Cb -0.07 -0.25 0.06 0.00 0.21 0.00 0.00 66.02 65.96 1vlj s SER 165 CO 0.00 0.04 0.59 -0.55 0.41 0.00 0.00 173.24 173.73 1vlj s SER 166 N 0.25 -0.59 0.52 2.44 0.15 -0.53 -4.97 113.70 110.97 1vlj s SER 166 Ca -0.03 0.98 0.18 0.00 0.70 0.00 0.00 55.95 57.78 1vlj s SER 166 Cb -0.08 0.97 1.28 0.00 -1.71 0.00 0.00 66.02 66.49 1vlj s SER 166 CO 0.00 -0.33 2.11 0.11 1.20 0.00 0.00 173.24 176.33 1vlj h LYS 167 N 4.54 0.02 0.00 5.44 6.56 -1.85 -0.92 116.57 130.36 1vlj h LYS 167 Ca -0.28 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.31 1vlj h LYS 167 Cb 1.16 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.82 1vlj h LYS 167 CO 0.22 0.02 0.00 0.00 -2.06 0.00 0.00 179.45 177.62 1vlj n ALA 168 N -2.56 1.62 1.09 3.86 0.00 -1.26 -2.96 120.51 120.29 1vlj n ALA 168 Ca 0.01 0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.57 1vlj n ALA 168 Cb 0.22 -1.28 0.14 0.00 0.00 0.00 0.00 19.45 18.53 1vlj n ALA 168 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1vlj n LEU 169 N -1.78 2.11 -4.71 0.00 4.77 -0.35 -4.58 117.00 112.46 1vlj n LEU 169 Ca 0.03 -0.73 -0.42 0.00 -0.03 0.00 0.00 56.01 54.86 1vlj n LEU 169 Cb 0.18 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 1vlj n LEU 169 CO 0.15 0.37 1.38 -0.31 -1.33 0.00 0.00 177.39 177.66 1vlj s TYR 170 N -2.29 2.65 0.62 -1.77 1.51 -1.16 -4.58 117.35 112.33 1vlj s TYR 170 Ca 0.24 0.26 -0.19 0.00 -1.01 0.00 0.00 57.07 56.37 1vlj s TYR 170 Cb 0.19 -4.11 -0.02 0.00 -0.11 0.00 0.00 41.96 37.91 1vlj s TYR 170 CO 0.46 -4.34 1.31 -2.14 -1.11 0.00 0.00 175.55 169.73 1vlj s PRO 171 N 1.79 2.69 -0.01 -1.71 0.02 -1.26 -4.73 135.00 131.79 1vlj s PRO 171 Ca 0.76 2.11 -0.25 0.00 0.02 0.00 0.00 61.00 63.64 1vlj s PRO 171 Cb -0.47 -1.95 -0.19 0.00 0.02 0.00 0.00 34.50 31.92 1vlj s PRO 171 CO 0.33 -1.50 1.26 0.87 -0.33 0.00 0.00 177.00 177.63 1vlj h LYS 172 N 0.77 -0.12 -3.60 5.54 1.79 -0.95 -3.38 116.57 116.62 1vlj h LYS 172 Ca -0.51 0.01 -0.24 0.00 -2.18 0.00 0.00 60.65 57.72 1vlj h LYS 172 Cb 1.33 0.03 -0.30 0.00 -1.58 0.00 0.00 32.23 31.71 1vlj h LYS 172 CO 0.54 0.29 -0.69 0.08 -1.08 0.00 0.00 179.45 178.59 1vlj s VAL 173 N -4.42 -0.02 -0.09 0.50 1.01 -1.25 -1.62 120.40 114.53 1vlj s VAL 173 Ca -0.15 0.07 0.02 0.00 0.00 0.00 0.00 61.98 61.92 1vlj s VAL 173 Cb 0.02 -0.07 0.01 0.00 0.00 0.00 0.00 36.38 36.34 1vlj s VAL 173 CO 0.62 0.03 -0.15 -0.44 0.00 0.00 0.00 175.10 175.16 1vlj s SER 174 N 0.36 2.25 -0.21 3.32 0.01 -0.35 -2.03 113.70 117.04 1vlj s SER 174 Ca -0.03 -0.39 -0.06 0.00 1.31 0.00 0.00 55.95 56.78 1vlj s SER 174 Cb -0.04 -1.02 -0.03 0.00 0.21 0.00 0.00 66.02 65.14 1vlj s SER 174 CO -0.01 0.05 0.04 -0.63 0.41 0.00 0.00 173.24 173.09 1vlj s ILE 175 N 0.72 4.22 -0.30 1.44 1.01 -0.29 -1.26 121.20 126.75 1vlj s ILE 175 Ca -0.13 -0.22 0.03 0.00 0.00 0.00 0.00 60.65 60.34 1vlj s ILE 175 Cb -0.16 -2.93 0.08 0.00 0.01 0.00 0.00 42.46 39.46 1vlj s ILE 175 CO 0.03 0.40 -0.00 -0.63 0.00 0.00 0.00 174.94 174.74 1vlj s ILE 176 N 1.11 2.05 -0.53 2.92 1.01 -0.11 -1.49 121.20 126.16 1vlj s ILE 176 Ca 0.03 -1.95 -0.13 0.00 0.00 0.00 0.00 60.65 58.61 1vlj s ILE 176 Cb -0.14 -2.39 0.13 0.00 0.01 0.00 0.00 42.46 40.07 1vlj s ILE 176 CO 0.02 -0.39 0.45 -0.62 0.00 0.00 0.00 174.94 174.40 1vlj s ASP 177 N 1.07 6.00 0.64 3.58 -1.08 -1.26 -0.55 116.67 125.07 1vlj s ASP 177 Ca 0.04 -1.94 0.41 0.00 -0.52 0.00 0.00 52.55 50.53 1vlj s ASP 177 Cb -0.19 -2.11 2.22 0.00 -1.46 0.00 0.00 42.92 41.38 1vlj s ASP 177 CO -0.08 -0.75 2.32 -0.65 0.52 0.00 0.00 175.17 176.52 1vlj h PRO 178 N 8.57 0.00 0.00 4.34 0.11 -1.91 -2.60 132.00 140.51 1vlj h PRO 178 Ca -0.22 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.86 1vlj h PRO 178 Cb 1.08 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1vlj h PRO 178 CO 0.93 0.01 -0.10 0.66 -0.21 0.00 0.00 178.00 179.29 1vlj h SER 179 N 0.00 0.00 0.62 -2.05 4.64 -1.92 -2.42 113.55 112.42 1vlj h SER 179 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1vlj h SER 179 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1vlj h SER 179 CO 0.00 0.10 0.00 1.33 -0.87 0.00 0.00 176.83 177.39 1vlj n VAL 180 N -3.41 0.57 1.77 0.95 0.24 -0.98 -2.83 118.33 114.64 1vlj n VAL 180 Ca -0.01 0.14 0.15 0.00 -2.04 0.00 0.00 64.34 62.58 1vlj n VAL 180 Cb 0.27 -0.80 0.77 0.00 -1.47 0.00 0.00 33.84 32.61 1vlj n VAL 180 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vlj n GLN 181 N -1.45 1.21 0.24 7.34 6.02 -0.91 -4.14 117.38 125.68 1vlj n GLN 181 Ca 0.06 -0.36 0.10 0.00 -0.01 0.00 0.00 57.00 56.79 1vlj n GLN 181 Cb 0.22 -1.49 0.62 0.00 1.02 0.00 0.00 30.24 30.60 1vlj n GLN 181 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 1vlj h PHE 182 N 0.89 0.00 -0.13 1.08 0.04 -1.71 -1.72 116.94 115.39 1vlj h PHE 182 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1vlj h PHE 182 Cb 0.21 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.36 1vlj h PHE 182 CO 0.00 0.18 0.00 0.25 -0.60 0.00 0.00 178.31 178.14 1vlj n THR 183 N -3.77 0.16 -2.33 -1.55 -2.24 -1.26 -4.63 114.28 98.66 1vlj n THR 183 Ca -0.02 -0.23 -0.41 0.00 -2.27 0.00 0.00 64.05 61.13 1vlj n THR 183 Cb 0.28 0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.61 1vlj n THR 183 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1vlj s LEU 184 N -1.46 4.50 0.56 3.22 1.43 -0.65 -5.00 118.68 121.27 1vlj s LEU 184 Ca 0.28 2.42 -0.21 0.00 -1.03 0.00 0.00 54.13 55.59 1vlj s LEU 184 Cb 0.14 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.69 1vlj s LEU 184 CO 0.22 -0.31 1.28 -2.84 0.23 0.00 0.00 176.35 174.93 1vlj s PRO 185 N -1.42 3.10 0.17 1.29 0.02 -1.26 -4.82 135.00 132.08 1vlj s PRO 185 Ca 0.47 2.03 -0.18 0.00 0.02 0.00 0.00 61.00 63.35 1vlj s PRO 185 Cb -0.35 -2.13 0.11 0.00 0.02 0.00 0.00 34.50 32.15 1vlj s PRO 185 CO 0.45 -1.16 1.65 -0.22 -0.33 0.00 0.00 177.00 177.39 1vlj h LYS 186 N 1.26 -0.05 -0.82 5.54 3.64 -1.96 -1.57 116.57 122.60 1vlj h LYS 186 Ca -0.51 0.00 0.19 0.00 -1.27 0.00 0.00 60.65 59.07 1vlj h LYS 186 Cb 1.30 0.01 -0.12 0.00 -0.41 0.00 0.00 32.23 33.01 1vlj h LYS 186 CO 0.56 -0.03 0.30 0.93 -2.27 0.00 0.00 179.45 178.94 1vlj h GLU 187 N -0.05 0.35 -0.18 1.90 3.07 -1.94 -1.06 114.58 116.67 1vlj h GLU 187 Ca 0.20 -0.02 -0.17 0.00 -0.50 0.00 0.00 59.36 58.87 1vlj h GLU 187 Cb 0.36 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.19 1vlj h GLU 187 CO -0.45 0.23 -0.58 1.96 -1.40 0.00 0.00 179.01 178.76 1vlj h GLN 188 N 0.36 0.59 -0.39 2.33 1.08 -1.67 0.64 115.11 118.04 1vlj h GLN 188 Ca 0.49 -0.39 0.04 0.00 -1.45 0.00 0.00 58.65 57.34 1vlj h GLN 188 Cb 0.87 0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 28.31 1vlj h GLN 188 CO -0.51 1.00 0.15 1.15 -0.95 0.00 0.00 178.83 179.68 1vlj h THR 189 N 0.44 0.91 -0.27 -0.54 2.02 -0.66 -1.39 112.91 113.43 1vlj h THR 189 Ca 0.00 -0.11 -0.07 0.00 0.77 0.00 0.00 66.41 67.00 1vlj h THR 189 Cb 1.14 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 1vlj h THR 189 CO 0.11 0.06 -0.11 0.58 0.37 0.00 0.00 175.52 176.53 1vlj h VAL 190 N 0.32 1.29 -0.91 3.16 2.07 -1.06 -0.92 116.25 120.21 1vlj h VAL 190 Ca 0.18 -1.18 0.01 0.00 0.82 0.00 0.00 66.70 66.52 1vlj h VAL 190 Cb 0.14 1.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 1vlj h VAL 190 CO -0.16 0.37 0.60 1.88 0.02 0.00 0.00 177.57 180.28 1vlj h TYR 191 N 0.28 1.14 -0.53 1.57 0.05 -0.77 -0.73 116.97 117.99 1vlj h TYR 191 Ca 0.06 0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.90 1vlj h TYR 191 Cb 0.61 -0.39 -0.04 0.00 1.01 0.00 0.00 36.73 37.92 1vlj h TYR 191 CO 0.06 0.72 0.29 0.78 -1.05 0.00 0.00 178.16 178.96 1vlj h GLY 192 N 1.23 0.75 1.06 3.88 0.00 -1.01 -0.94 103.07 108.04 1vlj h GLY 192 Ca 0.33 -0.21 -0.09 0.00 0.00 0.00 0.00 47.33 47.37 1vlj h GLY 192 CO -0.07 0.15 0.03 0.00 0.00 0.00 0.00 176.54 176.65 1vlj h ALA 193 N 1.26 0.81 -0.43 3.60 0.00 -0.16 -1.79 119.26 122.56 1vlj h ALA 193 Ca 0.22 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1vlj h ALA 193 Cb 0.09 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1vlj h ALA 193 CO -0.13 0.62 0.27 0.28 0.00 0.00 0.00 179.25 180.29 1vlj h VAL 194 N 0.94 1.08 -0.56 0.00 2.07 -0.99 -0.60 116.25 118.19 1vlj h VAL 194 Ca 0.17 -0.19 0.03 0.00 0.82 0.00 0.00 66.70 67.53 1vlj h VAL 194 Cb 0.52 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.74 1vlj h VAL 194 CO 0.02 0.10 0.34 -0.78 0.02 0.00 0.00 177.57 177.27 1vlj h ASP 195 N 0.54 0.55 -0.17 0.57 3.58 -0.94 0.14 116.42 120.69 1vlj h ASP 195 Ca 0.16 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.61 1vlj h ASP 195 Cb -0.03 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 40.90 1vlj h ASP 195 CO -0.06 0.39 0.10 0.00 -2.88 0.00 0.00 179.24 176.79 1vlj h ALA 196 N 1.25 0.22 -0.56 -0.78 0.00 -1.03 -0.76 119.26 117.60 1vlj h ALA 196 Ca 0.23 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1vlj h ALA 196 Cb 0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1vlj h ALA 196 CO -0.10 -0.25 0.36 0.82 0.00 0.00 0.00 179.25 180.08 1vlj h ILE 197 N 0.18 1.15 -0.93 0.00 2.04 -0.92 -2.54 117.51 116.49 1vlj h ILE 197 Ca 0.06 -0.29 0.01 0.00 1.00 0.00 0.00 64.86 65.64 1vlj h ILE 197 Cb 0.06 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.43 1vlj h ILE 197 CO -0.01 0.15 0.61 0.28 0.00 0.00 0.00 178.15 179.18 1vlj h SER 198 N 0.76 1.08 -0.63 1.72 0.02 -0.39 -0.73 113.55 115.38 1vlj h SER 198 Ca 0.20 -0.03 0.09 0.00 -0.84 0.00 0.00 61.79 61.21 1vlj h SER 198 Cb -0.07 -0.27 -0.07 0.00 0.14 0.00 0.00 62.40 62.13 1vlj h SER 198 CO -0.04 0.78 0.26 0.45 -1.14 0.00 0.00 176.83 177.14 1vlj h HIS 199 N 1.27 0.46 -0.16 3.45 3.86 -0.81 0.13 115.15 123.35 1vlj h HIS 199 Ca 0.34 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.58 1vlj h HIS 199 Cb -0.14 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.21 1vlj h HIS 199 CO -0.01 0.14 0.08 0.82 0.86 0.00 0.00 177.93 179.83 1vlj h ILE 200 N 0.46 1.11 0.00 2.45 2.04 -0.96 -2.93 117.51 119.67 1vlj h ILE 200 Ca 0.31 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 1vlj h ILE 200 Cb 0.36 1.01 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 1vlj h ILE 200 CO -0.29 0.10 -0.13 -0.07 0.00 0.00 0.00 178.15 177.76 1vlj h LEU 201 N 0.15 0.00 -0.93 1.44 3.38 -0.64 0.84 115.31 119.55 1vlj h LEU 201 Ca 0.06 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1vlj h LEU 201 Cb 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1vlj h LEU 201 CO -0.01 0.13 -0.28 -0.33 0.09 0.00 0.00 178.44 178.04 1vlj h GLU 202 N 0.00 0.44 0.10 1.13 4.39 -0.79 -2.16 114.58 117.69 1vlj h GLU 202 Ca -0.00 -0.18 -0.14 0.00 0.34 0.00 0.00 59.36 59.38 1vlj h GLU 202 Cb 0.53 -0.02 0.02 0.00 -0.10 0.00 0.00 28.75 29.17 1vlj h GLU 202 CO 0.02 0.69 -0.63 1.88 -1.16 0.00 0.00 179.01 179.81 1vlj h TYR 203 N 0.39 0.44 -0.89 4.33 0.05 -1.41 0.10 116.97 119.99 1vlj h TYR 203 Ca 0.05 -0.31 0.11 0.00 0.05 0.00 0.00 58.73 58.64 1vlj h TYR 203 Cb 0.70 -0.02 -0.07 0.00 1.01 0.00 0.00 36.73 38.35 1vlj h TYR 203 CO 0.02 1.22 0.57 -0.92 -1.05 0.00 0.00 178.16 178.00 1vlj h TYR 204 N -0.46 0.90 -0.63 4.88 3.20 -0.68 -1.82 116.97 122.36 1vlj h TYR 204 Ca -0.11 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.79 1vlj h TYR 204 Cb 1.47 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 39.45 1vlj h TYR 204 CO 0.21 0.38 0.00 1.19 -1.64 0.00 0.00 178.16 178.30 1vlj n PHE 205 N -4.54 1.77 1.91 -3.82 3.72 -0.83 -4.62 117.46 111.05 1vlj n PHE 205 Ca 0.16 -0.66 0.05 0.00 -0.05 0.00 0.00 57.45 56.95 1vlj n PHE 205 Cb 0.37 -0.37 0.28 0.00 -0.94 0.00 0.00 39.48 38.82 1vlj n PHE 205 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1vlj n ASP 206 N 0.93 0.17 0.00 4.37 5.68 -0.68 -4.79 116.55 122.23 1vlj n ASP 206 Ca 0.27 -1.72 0.00 0.00 -0.50 0.00 0.00 54.79 52.84 1vlj n ASP 206 Cb 1.04 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 41.00 1vlj n ASP 206 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1vlj n GLY 207 N 0.69 2.41 3.89 6.12 0.00 -1.26 -4.54 105.19 112.49 1vlj n GLY 207 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1vlj n GLY 207 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1vlj s SER 208 N -0.30 6.19 -0.41 1.61 1.04 -1.26 -4.96 113.70 115.62 1vlj s SER 208 Ca 0.00 1.12 0.10 0.00 0.48 0.00 0.00 55.95 57.65 1vlj s SER 208 Cb 0.00 -2.30 0.37 0.00 0.10 0.00 0.00 66.02 64.18 1vlj s SER 208 CO 0.00 -0.74 1.09 -0.24 0.98 0.00 0.00 173.24 174.33 1vlj n SER 209 N -2.49 -1.07 -4.76 7.02 2.88 -1.26 -4.82 113.62 109.11 1vlj n SER 209 Ca 0.03 -3.07 -0.40 0.00 -1.33 0.00 0.00 58.87 54.10 1vlj n SER 209 Cb 0.55 0.83 -0.03 0.00 -0.75 0.00 0.00 64.21 64.81 1vlj n SER 209 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1vlj s PRO 210 N -0.76 4.44 0.08 -1.46 0.05 -1.26 -4.51 135.00 131.59 1vlj s PRO 210 Ca 0.26 1.95 -0.30 0.00 0.05 0.00 0.00 61.00 62.97 1vlj s PRO 210 Cb 0.36 -3.06 -0.17 0.00 0.05 0.00 0.00 34.50 31.68 1vlj s PRO 210 CO -0.05 -0.02 1.65 1.49 0.05 0.00 0.00 177.00 180.12 1vlj h GLU 211 N 3.46 -0.61 -1.00 4.56 4.57 -1.93 0.63 114.58 124.26 1vlj h GLU 211 Ca -0.48 0.04 0.07 0.00 -1.18 0.00 0.00 59.36 57.82 1vlj h GLU 211 Cb 1.22 0.14 -0.07 0.00 -0.16 0.00 0.00 28.75 29.88 1vlj h GLU 211 CO 0.66 -0.41 0.64 0.97 -1.18 0.00 0.00 179.01 179.69 1vlj h ILE 212 N -0.64 1.06 -0.40 2.32 6.09 -1.99 -0.90 117.51 123.06 1vlj h ILE 212 Ca -0.05 -0.39 -0.16 0.00 -1.37 0.00 0.00 64.86 62.89 1vlj h ILE 212 Cb 0.51 -0.18 -0.01 0.00 0.47 0.00 0.00 36.82 37.61 1vlj h ILE 212 CO 0.07 0.21 -0.37 0.28 -3.07 0.00 0.00 178.15 175.27 1vlj h SER 213 N 1.15 1.01 -0.40 2.19 0.02 -1.77 -2.16 113.55 113.58 1vlj h SER 213 Ca 0.44 -0.46 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1vlj h SER 213 Cb 0.21 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 1vlj h SER 213 CO -0.19 1.26 0.22 0.78 -1.14 0.00 0.00 176.83 177.76 1vlj h ASN 214 N 0.77 0.51 -0.11 3.07 2.35 -0.10 -1.60 115.58 120.47 1vlj h ASN 214 Ca 0.07 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1vlj h ASN 214 Cb 0.96 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 39.20 1vlj h ASN 214 CO 0.09 0.46 0.07 -0.33 -1.65 0.00 0.00 177.43 176.07 1vlj h GLU 215 N 0.52 0.15 -0.47 0.81 4.39 -1.06 -0.14 114.58 118.78 1vlj h GLU 215 Ca 0.14 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.81 1vlj h GLU 215 Cb 0.06 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1vlj h GLU 215 CO -0.02 0.13 0.23 0.82 -1.16 0.00 0.00 179.01 179.00 1vlj h ILE 216 N 0.12 1.19 -0.60 3.13 2.04 -1.35 -1.50 117.51 120.55 1vlj h ILE 216 Ca 0.04 -0.52 0.03 0.00 1.00 0.00 0.00 64.86 65.41 1vlj h ILE 216 Cb 0.02 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 1vlj h ILE 216 CO -0.01 0.20 0.35 0.00 0.00 0.00 0.00 178.15 178.70 1vlj h ALA 217 N 1.07 0.78 -0.21 1.87 0.00 -1.09 -1.53 119.26 120.15 1vlj h ALA 217 Ca 0.16 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.86 1vlj h ALA 217 Cb 0.11 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.75 1vlj h ALA 217 CO -0.02 0.07 -0.68 0.93 0.00 0.00 0.00 179.25 179.55 1vlj h GLU 218 N 0.68 0.82 -0.42 0.00 5.08 -0.76 -1.12 114.58 118.87 1vlj h GLU 218 Ca 0.25 -0.61 -0.07 0.00 -1.00 0.00 0.00 59.36 57.93 1vlj h GLU 218 Cb 0.06 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 1vlj h GLU 218 CO -0.12 1.23 -0.04 0.78 -1.00 0.00 0.00 179.01 179.85 1vlj h GLY 219 N 0.58 0.75 0.78 -3.84 0.00 -1.23 -0.92 103.07 99.19 1vlj h GLY 219 Ca -0.03 -0.51 -0.09 0.00 0.00 0.00 0.00 47.33 46.71 1vlj h GLY 219 CO 0.14 0.47 -0.25 -0.84 0.00 0.00 0.00 176.54 176.07 1vlj h THR 220 N 0.65 1.36 -0.45 4.70 2.02 -0.99 -2.22 112.91 117.99 1vlj h THR 220 Ca 0.12 -1.48 0.01 0.00 0.77 0.00 0.00 66.41 65.83 1vlj h THR 220 Cb 0.47 1.96 -0.02 0.00 -1.74 0.00 0.00 68.15 68.82 1vlj h THR 220 CO 0.02 0.44 0.29 0.40 0.37 0.00 0.00 175.52 177.05 1vlj h ILE 221 N 0.04 1.11 -0.80 3.11 2.04 -1.09 -0.39 117.51 121.53 1vlj h ILE 221 Ca 0.01 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 1vlj h ILE 221 Cb 0.82 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 1vlj h ILE 221 CO 0.06 0.11 0.40 0.03 0.00 0.00 0.00 178.15 178.74 1vlj h ARG 222 N 0.60 1.15 -0.04 2.37 3.08 -1.15 -1.66 114.38 118.72 1vlj h ARG 222 Ca 0.17 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1vlj h ARG 222 Cb -0.06 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 29.78 1vlj h ARG 222 CO -0.04 0.88 0.02 1.15 -1.07 0.00 0.00 179.97 180.91 1vlj h THR 223 N 1.13 1.10 -0.45 2.04 2.02 -0.93 -2.03 112.91 115.79 1vlj h THR 223 Ca 0.28 -0.30 0.09 0.00 0.77 0.00 0.00 66.41 67.25 1vlj h THR 223 Cb 0.10 1.23 -0.07 0.00 -1.74 0.00 0.00 68.15 67.66 1vlj h THR 223 CO -0.04 0.08 -0.00 0.40 0.37 0.00 0.00 175.52 176.33 1vlj h ILE 224 N -0.05 0.65 -0.32 3.11 2.04 -0.78 -0.12 117.51 122.04 1vlj h ILE 224 Ca 0.01 -0.04 0.01 0.00 1.00 0.00 0.00 64.86 65.85 1vlj h ILE 224 Cb 0.12 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1vlj h ILE 224 CO -0.00 0.02 0.19 0.24 0.00 0.00 0.00 178.15 178.60 1vlj h MET 225 N 0.11 0.38 -0.26 2.37 2.86 -1.14 0.16 114.93 119.40 1vlj h MET 225 Ca 0.22 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.84 1vlj h MET 225 Cb 0.33 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1vlj h MET 225 CO -0.38 0.25 0.16 0.87 1.06 0.00 0.00 176.91 178.88 1vlj h LYS 226 N 0.39 0.36 -0.30 1.72 1.57 -1.11 -2.54 116.57 116.66 1vlj h LYS 226 Ca 0.12 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.75 1vlj h LYS 226 Cb -0.01 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1vlj h LYS 226 CO -0.05 0.28 -0.32 0.52 -0.57 0.00 0.00 179.45 179.31 1vlj h MET 227 N 0.33 0.65 -0.13 3.15 2.86 -0.75 -2.47 114.93 118.57 1vlj h MET 227 Ca 0.09 -0.30 0.02 0.00 -2.06 0.00 0.00 59.70 57.46 1vlj h MET 227 Cb 0.01 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 1vlj h MET 227 CO -0.02 0.89 0.01 1.15 1.06 0.00 0.00 176.91 180.00 1vlj h THR 228 N 0.55 0.92 -1.01 2.22 2.02 -0.82 -0.27 112.91 116.53 1vlj h THR 228 Ca 0.06 -0.02 0.07 0.00 0.77 0.00 0.00 66.41 67.30 1vlj h THR 228 Cb 0.82 0.86 -0.07 0.00 -1.74 0.00 0.00 68.15 68.02 1vlj h THR 228 CO 0.07 0.01 0.65 -0.33 0.37 0.00 0.00 175.52 176.29 1vlj h GLU 229 N 0.06 1.12 -0.67 6.66 5.08 -1.33 -0.77 114.58 124.73 1vlj h GLU 229 Ca 0.06 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 1vlj h GLU 229 Cb 0.06 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.03 1vlj h GLU 229 CO -0.09 0.74 0.15 0.00 -1.00 0.00 0.00 179.01 178.81 1vlj h ARG 230 N 1.15 1.07 -0.02 2.33 3.08 -1.04 -3.11 114.38 117.85 1vlj h ARG 230 Ca 0.44 -0.26 -0.16 0.00 0.07 0.00 0.00 59.98 60.07 1vlj h ARG 230 Cb 0.22 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1vlj h ARG 230 CO -0.19 0.97 -0.70 -0.07 -1.07 0.00 0.00 179.97 178.90 1vlj h LEU 231 N 1.00 0.17 -1.41 3.04 3.38 -0.34 0.19 115.31 121.33 1vlj h LEU 231 Ca 0.21 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.08 1vlj h LEU 231 Cb 0.38 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1vlj h LEU 231 CO 0.00 0.81 0.41 0.40 0.09 0.00 0.00 178.44 180.16 1vlj h ILE 232 N 0.09 1.13 0.13 1.22 2.04 -1.14 -2.55 117.51 118.43 1vlj h ILE 232 Ca -0.02 -0.27 -0.32 0.00 1.00 0.00 0.00 64.86 65.26 1vlj h ILE 232 Cb 1.25 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1vlj h ILE 232 CO 0.10 0.15 -1.58 -0.33 0.00 0.00 0.00 178.15 176.49 1vlj h GLU 233 N 0.79 0.28 -2.61 2.37 4.39 -1.42 -3.43 114.58 114.96 1vlj h GLU 233 Ca 0.24 -0.48 -0.58 0.00 0.34 0.00 0.00 59.36 58.87 1vlj h GLU 233 Cb -0.02 0.18 -0.39 0.00 -0.10 0.00 0.00 28.75 28.42 1vlj h GLU 233 CO -0.06 1.16 -0.84 0.21 -1.16 0.00 0.00 179.01 178.31 1vlj s LYS 234 N -2.61 0.60 0.46 2.33 2.20 0.63 -5.00 119.74 118.35 1vlj s LYS 234 Ca -0.10 -1.38 0.32 0.00 -0.36 0.00 0.00 55.97 54.44 1vlj s LYS 234 Cb 0.06 -1.37 1.59 0.00 -1.51 0.00 0.00 37.83 36.60 1vlj s LYS 234 CO 0.86 -1.21 1.96 -1.00 -0.36 0.00 0.00 175.35 175.60 1vlj h PRO 235 N 6.98 0.00 -0.70 4.03 0.13 -1.70 -2.27 132.00 138.47 1vlj h PRO 235 Ca 0.06 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.87 1vlj h PRO 235 Cb 0.97 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 31.91 1vlj h PRO 235 CO 0.28 0.00 0.31 -0.40 -0.23 0.00 0.00 178.00 177.95 1vlj n ASP 236 N -2.67 3.61 -4.55 1.44 5.68 -1.26 -4.47 116.55 114.33 1vlj n ASP 236 Ca -0.01 -3.54 -0.41 0.00 -0.50 0.00 0.00 54.79 50.33 1vlj n ASP 236 Cb 0.13 -0.74 -0.03 0.00 -1.14 0.00 0.00 41.12 39.34 1vlj n ASP 236 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1vlj s ASP 237 N -1.66 6.07 0.12 -1.12 -1.08 -0.85 -4.89 116.67 113.26 1vlj s ASP 237 Ca 0.52 -0.28 -0.19 0.00 -0.52 0.00 0.00 52.55 52.08 1vlj s ASP 237 Cb 0.44 -2.56 -0.06 0.00 -1.46 0.00 0.00 42.92 39.29 1vlj s ASP 237 CO 0.08 -1.87 1.77 0.22 0.52 0.00 0.00 175.17 175.88 1vlj h TYR 238 N 10.64 0.30 -0.88 -5.34 3.20 -1.91 -1.79 116.97 121.20 1vlj h TYR 238 Ca -0.27 0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.61 1vlj h TYR 238 Cb 1.07 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 39.19 1vlj h TYR 238 CO 1.11 0.21 0.58 0.93 -1.64 0.00 0.00 178.16 179.35 1vlj h GLU 239 N 0.31 1.15 -0.30 1.82 4.39 -1.99 0.27 114.58 120.24 1vlj h GLU 239 Ca 0.09 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 1vlj h GLU 239 Cb -0.01 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.36 1vlj h GLU 239 CO -0.02 0.77 0.16 0.00 -1.16 0.00 0.00 179.01 178.76 1vlj h ALA 240 N 1.45 0.39 -0.58 3.43 0.00 -1.84 -1.08 119.26 121.03 1vlj h ALA 240 Ca 0.32 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1vlj h ALA 240 Cb -0.13 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1vlj h ALA 240 CO -0.07 -0.08 0.31 0.00 0.00 0.00 0.00 179.25 179.42 1vlj h ARG 241 N 0.36 0.81 -0.26 0.00 2.47 -0.77 -1.59 114.38 115.40 1vlj h ARG 241 Ca 0.11 -0.10 -0.02 0.00 -1.26 0.00 0.00 59.98 58.71 1vlj h ARG 241 Cb 0.08 -0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.23 1vlj h ARG 241 CO -0.02 0.62 0.09 0.00 0.56 0.00 0.00 179.97 181.23 1vlj h ALA 242 N 1.14 0.34 -0.67 0.04 0.00 -0.30 0.18 119.26 119.99 1vlj h ALA 242 Ca 0.20 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1vlj h ALA 242 Cb 0.05 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1vlj h ALA 242 CO -0.03 -0.05 0.12 -0.91 0.00 0.00 0.00 179.25 178.38 1vlj h ASN 243 N 0.26 1.04 -0.55 0.00 2.35 -1.19 -2.01 115.58 115.49 1vlj h ASN 243 Ca 0.08 -0.25 -0.11 0.00 -0.55 0.00 0.00 56.30 55.47 1vlj h ASN 243 Cb 0.21 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1vlj h ASN 243 CO -0.00 1.03 -0.10 0.25 -1.65 0.00 0.00 177.43 176.96 1vlj h LEU 244 N 1.02 1.04 0.03 1.61 6.46 -1.17 -1.88 115.31 122.42 1vlj h LEU 244 Ca 0.20 -0.34 -0.00 0.00 -0.12 0.00 0.00 57.88 57.62 1vlj h LEU 244 Cb 0.42 -0.28 0.00 0.00 -0.73 0.00 0.00 40.66 40.07 1vlj h LEU 244 CO 0.01 1.14 -0.01 0.00 -0.62 0.00 0.00 178.44 178.96 1vlj h ALA 245 N 0.95 -0.04 -0.49 1.25 0.00 -0.25 -0.75 119.26 119.93 1vlj h ALA 245 Ca 0.14 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1vlj h ALA 245 Cb 0.67 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1vlj h ALA 245 CO 0.05 -0.51 0.01 2.35 0.00 0.00 0.00 179.25 181.14 1vlj h TRP 246 N -0.06 0.94 -0.75 0.00 -0.00 -1.38 -1.52 115.95 113.18 1vlj h TRP 246 Ca -0.00 -0.16 0.12 0.00 -0.00 0.00 0.00 58.89 58.85 1vlj h TRP 246 Cb 0.05 -0.25 -0.08 0.00 -0.00 0.00 0.00 29.16 28.88 1vlj h TRP 246 CO -0.07 0.88 0.35 0.77 -0.00 0.00 0.00 178.44 180.37 1vlj h SER 247 N 0.72 0.41 0.24 2.65 0.02 -1.11 -0.38 113.55 116.10 1vlj h SER 247 Ca 0.14 0.08 -0.11 0.00 -0.84 0.00 0.00 61.79 61.07 1vlj h SER 247 Cb 0.50 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 1vlj h SER 247 CO 0.02 0.20 -0.41 0.00 -1.14 0.00 0.00 176.83 175.50 1vlj h ALA 248 N 1.49 1.11 0.03 3.77 0.00 -0.89 -0.75 119.26 124.03 1vlj h ALA 248 Ca 0.39 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1vlj h ALA 248 Cb 0.51 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1vlj h ALA 248 CO -0.33 0.59 -0.01 1.15 0.00 0.00 0.00 179.25 180.64 1vlj h THR 249 N 0.19 1.23 0.00 0.00 2.02 -0.21 -3.23 112.91 112.91 1vlj h THR 249 Ca 0.02 -0.83 -0.04 0.00 0.77 0.00 0.00 66.41 66.32 1vlj h THR 249 Cb 0.82 1.79 -0.01 0.00 -1.74 0.00 0.00 68.15 69.00 1vlj h THR 249 CO 0.06 0.21 -0.21 0.16 0.37 0.00 0.00 175.52 176.12 1vlj h ILE 250 N -0.40 0.50 -0.96 3.11 3.07 -1.01 -2.42 117.51 119.40 1vlj h ILE 250 Ca -0.00 -1.07 0.20 0.00 1.55 0.00 0.00 64.86 65.53 1vlj h ILE 250 Cb 0.38 1.75 -0.08 0.00 -0.27 0.00 0.00 36.82 38.59 1vlj h ILE 250 CO 0.01 0.20 0.61 0.00 -1.05 0.00 0.00 178.15 177.92 1vlj h ALA 251 N 1.79 2.01 0.00 0.16 0.00 -1.15 -3.25 119.26 118.83 1vlj h ALA 251 Ca -0.00 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1vlj h ALA 251 Cb 0.73 -0.05 -0.16 0.00 0.00 0.00 0.00 17.79 18.32 1vlj h ALA 251 CO 0.03 -0.34 -0.67 -0.11 0.00 0.00 0.00 179.25 178.16 1vlj n LEU 252 N -4.61 1.02 -0.72 0.00 7.94 -1.08 -4.40 117.00 115.16 1vlj n LEU 252 Ca 0.21 -2.02 0.11 0.00 -1.11 0.00 0.00 56.01 53.21 1vlj n LEU 252 Cb 0.67 -0.12 0.33 0.00 0.53 0.00 0.00 43.42 44.84 1vlj n LEU 252 CO 0.27 0.55 0.76 -0.46 -1.11 0.00 0.00 177.39 177.40 1vlj n ASN 253 N -0.10 2.16 0.00 1.96 6.94 -0.93 -4.63 115.26 120.66 1vlj n ASN 253 Ca 0.07 -1.77 0.00 0.00 -0.02 0.00 0.00 54.58 52.86 1vlj n ASN 253 Cb 0.88 -0.11 0.00 0.00 -2.36 0.00 0.00 39.78 38.18 1vlj n ASN 253 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1vlj n GLY 254 N 1.24 2.50 0.36 4.83 0.00 -1.26 -4.88 105.19 107.98 1vlj n GLY 254 Ca 0.17 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.27 1vlj n GLY 254 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1vlj h THR 255 N 0.00 0.92 0.00 2.61 2.02 -1.89 -1.77 112.91 114.79 1vlj h THR 255 Ca 0.00 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 66.84 1vlj h THR 255 Cb 0.00 -0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.26 1vlj h THR 255 CO 0.00 0.18 -0.44 0.24 0.37 0.00 0.00 175.52 175.87 1vlj h MET 256 N 0.98 0.00 0.00 6.66 2.86 -1.80 -3.30 114.93 120.32 1vlj h MET 256 Ca 0.50 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 58.06 1vlj h MET 256 Cb 0.50 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.15 1vlj h MET 256 CO -0.26 0.00 -0.48 0.00 1.06 0.00 0.00 176.91 177.23 1vlj h ALA 257 N 2.41 0.76 -2.46 6.32 0.00 -1.67 -3.45 119.26 121.18 1vlj h ALA 257 Ca 0.00 -0.32 -0.54 0.00 0.00 0.00 0.00 54.91 54.05 1vlj h ALA 257 Cb 0.79 -0.01 0.04 0.00 0.00 0.00 0.00 17.79 18.61 1vlj h ALA 257 CO 0.00 0.41 1.05 0.28 0.00 0.00 0.00 179.25 180.99 1vlj n VAL 258 N -3.11 0.27 -0.94 0.00 0.31 -1.13 -1.62 118.33 112.12 1vlj n VAL 258 Ca 0.01 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 1vlj n VAL 258 Cb 0.67 -2.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.59 1vlj n VAL 258 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1vlj n GLY 259 N 4.10 0.60 0.03 2.92 0.00 -1.25 -4.81 105.19 106.77 1vlj n GLY 259 Ca 0.18 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.20 1vlj n GLY 259 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vlj n ARG 260 N -2.03 1.28 -0.38 1.61 1.74 -0.64 -1.23 116.66 117.01 1vlj n ARG 260 Ca 0.00 -0.02 0.08 0.00 -0.77 0.00 0.00 57.85 57.14 1vlj n ARG 260 Cb 0.05 0.00 0.25 0.00 -1.02 0.00 0.00 32.46 31.74 1vlj n ARG 260 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1vlj n ARG 261 N -0.72 3.13 0.00 5.56 1.74 -1.26 -4.70 116.66 120.40 1vlj n ARG 261 Ca 0.00 -2.53 0.00 0.00 -0.77 0.00 0.00 57.85 54.55 1vlj n ARG 261 Cb 0.00 -1.62 0.00 0.00 -1.02 0.00 0.00 32.46 29.83 1vlj n ARG 261 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vlj n GLY 262 N 0.45 0.60 0.00 -0.13 0.00 -1.26 -4.99 105.19 99.86 1vlj n GLY 262 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1vlj n GLY 262 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vlj n GLY 263 N -1.23 -0.68 0.02 -0.02 0.00 -1.26 -4.94 105.19 97.08 1vlj n GLY 263 Ca 0.00 -1.59 -0.00 0.00 0.00 0.00 0.00 46.02 44.43 1vlj n GLY 263 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1vlj h GLU 264 N 0.00 0.00 0.00 1.61 4.57 -1.12 -3.45 114.58 116.19 1vlj h GLU 264 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1vlj h GLU 264 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1vlj h GLU 264 CO 0.00 0.00 0.00 0.91 -1.18 0.00 0.00 179.01 178.74 1vlj n TRP 265 N -3.20 0.00 -0.11 0.92 7.02 -1.26 -3.92 117.44 116.90 1vlj n TRP 265 Ca -0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.39 1vlj n TRP 265 Cb 0.01 -0.29 -0.01 0.00 -2.42 0.00 0.00 31.31 28.60 1vlj n TRP 265 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1vlj h ALA 266 N 0.00 0.43 -0.27 6.99 0.00 -1.92 -1.26 119.26 123.24 1vlj h ALA 266 Ca 0.00 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1vlj h ALA 266 Cb 0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1vlj h ALA 266 CO 0.00 -0.06 0.16 0.00 0.00 0.00 0.00 179.25 179.35 1vlj h HIS 268 N 0.32 0.28 -0.26 0.00 -0.00 -1.96 0.25 115.15 113.79 1vlj h HIS 268 Ca 0.11 0.02 -0.17 0.00 -0.00 0.00 0.00 60.37 60.32 1vlj h HIS 268 Cb -0.00 -0.07 -0.00 0.00 -0.00 0.00 0.00 27.41 27.33 1vlj h HIS 268 CO -0.08 0.14 -0.51 0.00 -0.00 0.00 0.00 177.93 177.48 1vlj h ARG 269 N 0.33 0.74 -0.69 2.45 3.08 -0.93 -0.63 114.38 118.72 1vlj h ARG 269 Ca 0.16 -0.45 -0.00 0.00 0.07 0.00 0.00 59.98 59.76 1vlj h ARG 269 Cb 0.10 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 1vlj h ARG 269 CO -0.14 1.07 0.42 0.82 -1.07 0.00 0.00 179.97 181.08 1vlj h ILE 270 N 0.57 1.19 -0.63 2.04 2.04 -0.90 -2.83 117.51 119.00 1vlj h ILE 270 Ca 0.02 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 1vlj h ILE 270 Cb 1.09 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 1vlj h ILE 270 CO 0.11 0.20 0.35 -0.08 0.00 0.00 0.00 178.15 178.73 1vlj h GLU 271 N 0.94 0.87 -0.88 2.37 4.22 -0.43 -1.82 114.58 119.84 1vlj h GLU 271 Ca 0.25 -0.09 0.09 0.00 0.08 0.00 0.00 59.36 59.69 1vlj h GLU 271 Cb -0.04 -0.18 -0.06 0.00 0.50 0.00 0.00 28.75 28.97 1vlj h GLU 271 CO -0.05 0.63 0.57 0.45 -2.18 0.00 0.00 179.01 178.44 1vlj h HIS 272 N 0.88 0.96 -0.85 0.92 3.86 -0.87 0.12 115.15 120.18 1vlj h HIS 272 Ca 0.23 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.43 1vlj h HIS 272 Cb 0.01 -0.31 -0.04 0.00 1.06 0.00 0.00 27.41 28.13 1vlj h HIS 272 CO 0.00 0.46 0.40 0.77 0.86 0.00 0.00 177.93 180.43 1vlj h SER 273 N 0.91 1.11 -0.39 2.45 0.02 -1.37 0.15 113.55 116.43 1vlj h SER 273 Ca 0.40 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1vlj h SER 273 Cb 0.35 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 1vlj h SER 273 CO -0.16 0.94 0.25 -0.07 -1.14 0.00 0.00 176.83 176.65 1vlj h LEU 274 N 1.21 0.45 -0.85 5.07 3.38 -0.70 -1.48 115.31 122.38 1vlj h LEU 274 Ca 0.29 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 58.12 1vlj h LEU 274 Cb 0.12 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1vlj h LEU 274 CO -0.04 0.33 -0.49 0.28 0.09 0.00 0.00 178.44 178.62 1vlj h SER 275 N 0.52 0.22 -0.36 -0.43 0.02 -0.87 -0.44 113.55 112.21 1vlj h SER 275 Ca 0.14 -0.10 -0.11 0.00 -0.84 0.00 0.00 61.79 60.88 1vlj h SER 275 Cb -0.05 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1vlj h SER 275 CO -0.03 0.68 -0.21 0.00 -1.14 0.00 0.00 176.83 176.13 1vlj h ALA 276 N 1.33 0.51 0.07 3.77 0.00 -0.57 -0.82 119.26 123.55 1vlj h ALA 276 Ca 0.01 -0.37 -0.29 0.00 0.00 0.00 0.00 54.91 54.26 1vlj h ALA 276 Cb 0.92 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1vlj h ALA 276 CO 0.07 0.47 -1.50 -0.07 0.00 0.00 0.00 179.25 178.22 1vlj h LEU 277 N 0.56 0.23 -0.57 0.00 3.38 -1.22 -3.40 115.31 114.29 1vlj h LEU 277 Ca 0.08 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1vlj h LEU 277 Cb 0.76 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1vlj h LEU 277 CO 0.06 1.29 -0.01 -1.22 0.09 0.00 0.00 178.44 178.64 1vlj n TYR 278 N -3.34 0.00 -1.83 1.13 4.01 -0.18 -5.01 117.16 111.94 1vlj n TYR 278 Ca -0.14 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.40 1vlj n TYR 278 Cb 1.03 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 40.00 1vlj n TYR 278 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1vlj n ASP 279 N -0.43 -5.44 -4.76 7.72 2.03 -0.31 -4.98 116.55 110.38 1vlj n ASP 279 Ca 0.00 0.32 -0.32 0.00 0.52 0.00 0.00 54.79 55.32 1vlj n ASP 279 Cb 0.01 -4.60 0.09 0.00 -0.72 0.00 0.00 41.12 35.91 1vlj n ASP 279 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1vlj s ILE 280 N -2.81 3.13 0.33 5.18 -4.36 -1.26 -4.91 121.20 116.50 1vlj s ILE 280 Ca 0.00 0.40 -0.29 0.00 -0.26 0.00 0.00 60.65 60.51 1vlj s ILE 280 Cb 0.00 -2.85 -0.11 0.00 1.25 0.00 0.00 42.46 40.76 1vlj s ILE 280 CO 0.00 -0.44 1.42 0.00 0.24 0.00 0.00 174.94 176.16 1vlj s ALA 281 N -2.73 3.57 0.20 2.27 0.00 -1.26 -4.56 121.76 119.26 1vlj s ALA 281 Ca 0.63 1.42 -0.17 0.00 0.00 0.00 0.00 51.96 53.85 1vlj s ALA 281 Cb -0.19 -3.56 0.20 0.00 0.00 0.00 0.00 23.12 19.57 1vlj s ALA 281 CO 0.53 -0.85 1.60 1.25 0.00 0.00 0.00 175.76 178.29 1vlj h HIS 282 N 3.61 -0.69 -0.02 0.00 2.76 -1.93 -1.93 115.15 116.95 1vlj h HIS 282 Ca -0.49 0.07 -0.11 0.00 -2.20 0.00 0.00 60.37 57.64 1vlj h HIS 282 Cb 1.23 0.40 -0.01 0.00 1.55 0.00 0.00 27.41 30.58 1vlj h HIS 282 CO 0.56 -0.35 -0.50 0.78 -1.30 0.00 0.00 177.93 177.11 1vlj h GLY 283 N -0.09 0.06 0.95 5.26 0.00 -1.91 -1.83 103.07 105.51 1vlj h GLY 283 Ca 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.54 1vlj h GLY 283 CO -0.71 0.06 0.17 0.00 0.00 0.00 0.00 176.54 176.06 1vlj h ALA 284 N 1.45 0.41 -0.79 3.60 0.00 -1.66 -1.79 119.26 120.48 1vlj h ALA 284 Ca -0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1vlj h ALA 284 Cb 0.91 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.53 1vlj h ALA 284 CO 0.07 -0.05 0.43 0.78 0.00 0.00 0.00 179.25 180.48 1vlj h GLY 285 N 0.39 1.17 1.45 0.00 0.00 -1.02 -2.49 103.07 102.57 1vlj h GLY 285 Ca 0.11 -0.52 -0.08 0.00 0.00 0.00 0.00 47.33 46.84 1vlj h GLY 285 CO -0.02 0.50 -0.08 1.41 0.00 0.00 0.00 176.54 178.35 1vlj h LEU 286 N 1.10 0.64 -1.50 3.11 3.38 -1.13 -0.79 115.31 120.12 1vlj h LEU 286 Ca 0.28 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 58.13 1vlj h LEU 286 Cb 0.03 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1vlj h LEU 286 CO -0.04 0.77 0.40 0.00 0.09 0.00 0.00 178.44 179.65 1vlj h ALA 287 N 1.30 1.76 0.01 1.53 0.00 -0.88 0.19 119.26 123.18 1vlj h ALA 287 Ca 0.11 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1vlj h ALA 287 Cb 0.51 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1vlj h ALA 287 CO 0.03 0.15 -0.20 0.82 0.00 0.00 0.00 179.25 180.05 1vlj h ILE 288 N 0.63 1.62 0.06 0.00 2.04 -1.22 -3.38 117.51 117.25 1vlj h ILE 288 Ca 0.25 -2.07 -0.25 0.00 1.00 0.00 0.00 64.86 63.78 1vlj h ILE 288 Cb 0.20 2.97 0.01 0.00 -0.74 0.00 0.00 36.82 39.27 1vlj h ILE 288 CO -0.07 0.56 -1.08 0.58 0.00 0.00 0.00 178.15 178.13 1vlj h VAL 289 N -0.65 1.39 -0.10 1.67 2.07 -0.95 -3.35 116.25 116.32 1vlj h VAL 289 Ca -0.03 -2.59 -0.01 0.00 0.82 0.00 0.00 66.70 64.89 1vlj h VAL 289 Cb 1.02 2.60 -0.00 0.00 -1.52 0.00 0.00 31.29 33.39 1vlj h VAL 289 CO 0.04 0.77 0.01 0.15 0.02 0.00 0.00 177.57 178.56 1vlj h PHE 290 N 0.21 0.18 -0.94 1.57 3.04 -0.80 0.12 116.94 120.32 1vlj h PHE 290 Ca -0.12 -0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.80 1vlj h PHE 290 Cb 1.75 -0.05 -0.05 0.00 2.56 0.00 0.00 35.95 40.17 1vlj h PHE 290 CO 0.07 0.38 0.56 -1.35 -2.02 0.00 0.00 178.31 175.96 1vlj h PRO 291 N -0.08 1.27 -0.39 6.41 0.11 -1.77 -0.33 132.00 137.23 1vlj h PRO 291 Ca 0.03 -0.12 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 1vlj h PRO 291 Cb 0.30 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 31.13 1vlj h PRO 291 CO 0.00 0.89 0.22 0.00 -0.21 0.00 0.00 178.00 178.91 1vlj h ALA 292 N 1.33 0.50 -0.50 -0.75 0.00 -1.58 -1.55 119.26 116.70 1vlj h ALA 292 Ca 0.34 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.19 1vlj h ALA 292 Cb -0.05 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1vlj h ALA 292 CO -0.06 0.02 0.31 2.35 0.00 0.00 0.00 179.25 181.87 1vlj h TRP 293 N 0.51 0.59 -0.57 0.00 7.01 -0.57 -1.46 115.95 121.46 1vlj h TRP 293 Ca 0.14 0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.20 1vlj h TRP 293 Cb 0.04 -0.19 -0.04 0.00 -2.10 0.00 0.00 29.16 26.86 1vlj h TRP 293 CO -0.03 0.35 0.32 0.52 -2.79 0.00 0.00 178.44 176.82 1vlj h MET 294 N 0.63 0.60 -0.19 2.65 2.86 -0.91 -1.07 114.93 119.51 1vlj h MET 294 Ca 0.20 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.75 1vlj h MET 294 Cb -0.02 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 1vlj h MET 294 CO -0.07 0.40 -0.09 -0.22 1.06 0.00 0.00 176.91 177.99 1vlj h LYS 295 N 0.62 0.29 -0.01 1.72 3.11 -1.01 -2.47 116.57 118.83 1vlj h LYS 295 Ca 0.24 -0.06 -0.25 0.00 -2.81 0.00 0.00 60.65 57.77 1vlj h LYS 295 Cb 0.10 -0.04 0.01 0.00 -1.00 0.00 0.00 32.23 31.30 1vlj h LYS 295 CO -0.14 0.40 -0.99 -0.92 -2.81 0.00 0.00 179.45 174.99 1vlj h TYR 296 N 0.28 0.90 -0.01 1.91 3.20 -0.32 -3.39 116.97 119.54 1vlj h TYR 296 Ca 0.06 -0.48 0.00 0.00 3.14 0.00 0.00 58.73 61.45 1vlj h TYR 296 Cb 0.34 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.51 1vlj h TYR 296 CO 0.01 1.31 -0.30 1.33 -1.64 0.00 0.00 178.16 178.87 1vlj n VAL 297 N -3.82 0.00 0.10 1.81 0.24 -0.50 -4.72 118.33 111.44 1vlj n VAL 297 Ca -0.09 -0.35 0.07 0.00 -2.04 0.00 0.00 64.34 61.92 1vlj n VAL 297 Cb 0.86 1.21 0.52 0.00 -1.47 0.00 0.00 33.84 34.96 1vlj n VAL 297 CO 0.00 0.00 0.00 0.10 -2.14 0.00 0.00 176.83 174.79 1vlj h TYR 298 N 1.99 0.29 0.00 6.34 -0.00 -1.64 -0.27 116.97 123.68 1vlj h TYR 298 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.74 1vlj h TYR 298 Cb 0.57 -0.10 0.00 0.00 0.00 0.00 0.00 36.73 37.20 1vlj h TYR 298 CO 0.00 0.18 0.02 0.00 -0.00 0.00 0.00 178.16 178.36 1vlj h ARG 299 N 0.31 0.00 -0.01 0.10 3.08 -1.88 0.15 114.38 116.13 1vlj h ARG 299 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1vlj h ARG 299 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1vlj h ARG 299 CO -0.02 0.00 -0.26 1.63 -1.07 0.00 0.00 179.97 180.25 1vlj n LYS 300 N -2.72 0.67 -2.73 0.04 4.76 -0.11 -4.32 118.16 113.76 1vlj n LYS 300 Ca -0.02 -0.36 -0.08 0.00 -2.87 0.00 0.00 58.31 54.97 1vlj n LYS 300 Cb 0.07 -1.49 0.09 0.00 -1.84 0.00 0.00 35.03 31.86 1vlj n LYS 300 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1vlj n ASN 301 N -0.85 -1.28 -0.18 4.39 2.85 -0.02 -5.00 115.26 115.17 1vlj n ASN 301 Ca 0.12 -2.79 -0.03 0.00 -0.11 0.00 0.00 54.58 51.77 1vlj n ASN 301 Cb 0.33 0.85 0.17 0.00 1.24 0.00 0.00 39.78 42.38 1vlj n ASN 301 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1vlj h PRO 302 N 2.43 0.94 -0.59 1.20 0.13 -1.59 -2.73 132.00 131.78 1vlj h PRO 302 Ca -0.19 -0.16 -0.04 0.00 -0.87 0.00 0.00 66.00 64.74 1vlj h PRO 302 Cb 1.22 -0.16 -0.03 0.00 0.13 0.00 0.00 31.00 32.16 1vlj h PRO 302 CO 0.10 0.78 0.22 0.00 -0.23 0.00 0.00 178.00 178.86 1vlj h ALA 303 N 1.34 1.26 -0.00 -0.56 0.00 -1.96 0.77 119.26 120.11 1vlj h ALA 303 Ca 0.21 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1vlj h ALA 303 Cb 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1vlj h ALA 303 CO -0.02 0.53 -0.73 0.37 0.00 0.00 0.00 179.25 179.41 1vlj h GLN 304 N 0.86 0.02 -0.18 0.00 5.75 -1.89 -1.56 115.11 118.11 1vlj h GLN 304 Ca 0.20 -0.02 -0.18 0.00 -0.15 0.00 0.00 58.65 58.51 1vlj h GLN 304 Cb 0.20 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.75 1vlj h GLN 304 CO -0.01 0.74 -0.60 0.74 -2.65 0.00 0.00 178.83 177.04 1vlj h PHE 305 N 0.01 0.79 -0.21 3.99 0.04 -1.21 0.16 116.94 120.50 1vlj h PHE 305 Ca -0.01 -0.30 0.03 0.00 2.80 0.00 0.00 57.97 60.49 1vlj h PHE 305 Cb 1.29 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 39.27 1vlj h PHE 305 CO 0.00 1.06 0.05 0.93 -0.60 0.00 0.00 178.31 179.75 1vlj h GLU 306 N 0.46 0.13 -0.76 1.51 5.08 -0.72 -2.54 114.58 117.74 1vlj h GLU 306 Ca -0.00 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 1vlj h GLU 306 Cb 1.17 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.36 1vlj h GLU 306 CO 0.12 0.09 0.32 -0.09 -1.00 0.00 0.00 179.01 178.45 1vlj h ARG 307 N 0.14 1.12 -0.54 2.33 2.43 -1.00 -1.95 114.38 116.90 1vlj h ARG 307 Ca 0.10 -0.19 0.07 0.00 -0.81 0.00 0.00 59.98 59.15 1vlj h ARG 307 Cb 0.09 -0.19 -0.06 0.00 -0.42 0.00 0.00 29.97 29.39 1vlj h ARG 307 CO -0.12 0.90 0.21 0.35 -1.51 0.00 0.00 179.97 179.80 1vlj h PHE 308 N 1.09 0.37 -0.54 2.20 3.57 -0.53 0.18 116.94 123.28 1vlj h PHE 308 Ca 0.26 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.73 1vlj h PHE 308 Cb 0.18 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 1vlj h PHE 308 CO 0.02 0.12 0.13 0.00 -2.23 0.00 0.00 178.31 176.35 1vlj h ALA 309 N 1.35 0.71 -0.22 2.41 0.00 -0.95 -1.28 119.26 121.29 1vlj h ALA 309 Ca 0.26 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1vlj h ALA 309 Cb 0.28 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1vlj h ALA 309 CO -0.25 0.41 -0.22 0.87 0.00 0.00 0.00 179.25 180.06 1vlj h LYS 310 N 0.76 0.53 0.01 0.00 1.57 -1.09 -2.75 116.57 115.60 1vlj h LYS 310 Ca 0.17 -0.28 -0.24 0.00 -1.87 0.00 0.00 60.65 58.43 1vlj h LYS 310 Cb 0.34 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 1vlj h LYS 310 CO 0.00 0.86 -1.24 0.87 -0.57 0.00 0.00 179.45 179.38 1vlj h LYS 311 N 0.22 0.02 0.06 3.15 1.79 -0.60 -1.82 116.57 119.38 1vlj h LYS 311 Ca 0.04 -0.03 -0.34 0.00 -2.18 0.00 0.00 60.65 58.13 1vlj h LYS 311 Cb 0.76 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.39 1vlj h LYS 311 CO 0.05 0.86 -2.00 -0.89 -1.08 0.00 0.00 179.45 176.40 1vlj n ILE 312 N -3.27 1.65 0.22 1.86 2.08 -0.49 -4.58 119.36 116.83 1vlj n ILE 312 Ca -0.06 -0.71 0.02 0.00 0.56 0.00 0.00 62.75 62.56 1vlj n ILE 312 Cb 0.98 -1.34 -0.01 0.00 -0.75 0.00 0.00 39.64 38.52 1vlj n ILE 312 CO 0.00 0.00 0.00 0.49 0.56 0.00 0.00 176.55 177.60 1vlj n PHE 313 N -3.24 0.00 -1.93 1.39 3.72 -1.10 -4.96 117.46 111.34 1vlj n PHE 313 Ca -0.29 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 56.98 1vlj n PHE 313 Cb 1.05 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.57 1vlj n PHE 313 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1vlj n GLY 314 N 0.86 0.40 3.82 1.37 0.00 -0.68 -4.99 105.19 105.97 1vlj n GLY 314 Ca 0.02 -0.38 -0.33 0.00 0.00 0.00 0.00 46.02 45.33 1vlj n GLY 314 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vlj s PHE 315 N -2.58 3.24 0.15 1.61 0.08 -1.06 -4.96 117.98 114.46 1vlj s PHE 315 Ca 0.00 1.52 0.08 0.00 0.12 0.00 0.00 56.93 58.64 1vlj s PHE 315 Cb 0.00 -2.90 -0.04 0.00 -0.57 0.00 0.00 43.02 39.51 1vlj s PHE 315 CO 0.00 -0.60 -0.06 -1.21 -0.10 0.00 0.00 175.22 173.25 1vlj s GLU 316 N -3.82 2.22 0.00 0.44 8.01 -1.26 -4.19 118.70 120.10 1vlj s GLU 316 Ca 0.62 -1.12 0.00 0.00 0.01 0.00 0.00 54.97 54.48 1vlj s GLU 316 Cb -0.12 -2.29 0.00 0.00 -4.31 0.00 0.00 34.13 27.40 1vlj s GLU 316 CO 0.28 0.47 0.00 0.41 0.01 0.00 0.00 175.26 176.43 1vlj n GLY 317 N 0.21 0.56 3.47 -1.39 0.00 -1.26 -4.90 105.19 101.89 1vlj n GLY 317 Ca -0.11 -2.13 -0.09 0.00 0.00 0.00 0.00 46.02 43.68 1vlj n GLY 317 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vlj s GLU 318 N -0.42 1.33 3.11 1.61 8.01 -1.26 -4.96 118.70 126.11 1vlj s GLU 318 Ca 0.00 -1.01 0.00 0.00 0.01 0.00 0.00 54.97 53.97 1vlj s GLU 318 Cb 0.00 0.47 0.00 0.00 -4.31 0.00 0.00 34.13 30.29 1vlj s GLU 318 CO 0.00 -0.54 0.00 0.41 0.01 0.00 0.00 175.26 175.14 1vlj n GLY 319 N -0.30 0.30 0.32 -1.39 0.00 -1.26 -3.18 105.19 99.67 1vlj n GLY 319 Ca -0.08 -0.90 -0.05 0.00 0.00 0.00 0.00 46.02 44.99 1vlj n GLY 319 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1vlj h GLU 320 N 0.00 1.10 -0.39 1.61 4.81 -1.98 -1.33 114.58 118.39 1vlj h GLU 320 Ca 0.00 -0.15 0.08 0.00 -0.13 0.00 0.00 59.36 59.16 1vlj h GLU 320 Cb 0.00 -0.20 -0.08 0.00 0.63 0.00 0.00 28.75 29.10 1vlj h GLU 320 CO 0.00 0.84 -0.12 0.93 -0.73 0.00 0.00 179.01 179.93 1vlj h GLU 321 N 1.08 -0.03 -0.31 1.92 5.08 -2.00 -0.28 114.58 120.03 1vlj h GLU 321 Ca 0.27 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.61 1vlj h GLU 321 Cb 0.09 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1vlj h GLU 321 CO -0.04 -0.02 0.14 1.25 -1.00 0.00 0.00 179.01 179.34 1vlj h LEU 322 N -0.03 0.42 -0.68 1.33 5.85 -1.42 -1.82 115.31 118.95 1vlj h LEU 322 Ca 0.19 -0.14 0.10 0.00 0.84 0.00 0.00 57.88 58.87 1vlj h LEU 322 Cb 0.32 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.17 1vlj h LEU 322 CO -0.42 0.44 0.32 0.40 -0.34 0.00 0.00 178.44 178.84 1vlj h ILE 323 N 0.37 0.82 -0.03 4.05 2.04 -0.88 -2.01 117.51 121.87 1vlj h ILE 323 Ca 0.11 -0.19 -0.24 0.00 1.00 0.00 0.00 64.86 65.54 1vlj h ILE 323 Cb 0.14 0.23 0.01 0.00 -0.74 0.00 0.00 36.82 36.46 1vlj h ILE 323 CO -0.01 0.10 -0.96 -0.07 0.00 0.00 0.00 178.15 177.21 1vlj h LEU 324 N 0.54 0.79 -0.51 1.44 3.38 -0.90 -1.65 115.31 118.40 1vlj h LEU 324 Ca 0.34 -0.60 0.10 0.00 0.09 0.00 0.00 57.88 57.80 1vlj h LEU 324 Cb 0.38 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.81 1vlj h LEU 324 CO -0.28 1.40 0.01 0.11 0.09 0.00 0.00 178.44 179.77 1vlj h LYS 325 N 0.37 0.12 -0.43 1.13 6.56 -1.22 0.17 116.57 123.27 1vlj h LYS 325 Ca -0.10 -0.01 -0.07 0.00 -1.06 0.00 0.00 60.65 59.41 1vlj h LYS 325 Cb 1.60 -0.03 -0.02 0.00 -0.57 0.00 0.00 32.23 33.21 1vlj h LYS 325 CO 0.18 0.08 -0.02 0.78 -2.06 0.00 0.00 179.45 178.42 1vlj h GLY 326 N 0.13 0.84 1.03 3.86 0.00 -1.00 -0.35 103.07 107.57 1vlj h GLY 326 Ca 0.26 -0.63 -0.06 0.00 0.00 0.00 0.00 47.33 46.90 1vlj h GLY 326 CO -0.41 0.58 0.17 -2.22 0.00 0.00 0.00 176.54 174.66 1vlj h ILE 327 N 0.61 1.25 -0.49 2.60 2.04 -1.08 -1.28 117.51 121.17 1vlj h ILE 327 Ca 0.12 -0.91 -0.10 0.00 1.00 0.00 0.00 64.86 64.97 1vlj h ILE 327 Cb 0.52 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1vlj h ILE 327 CO 0.03 0.35 -0.10 -0.08 0.00 0.00 0.00 178.15 178.34 1vlj h GLU 328 N 0.95 0.88 -0.67 2.37 4.57 -0.89 -1.07 114.58 120.73 1vlj h GLU 328 Ca 0.21 -0.30 -0.08 0.00 -1.18 0.00 0.00 59.36 58.00 1vlj h GLU 328 Cb 0.34 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.83 1vlj h GLU 328 CO -0.00 0.94 0.10 0.00 -1.18 0.00 0.00 179.01 178.87 1vlj h ALA 329 N 1.09 0.90 0.15 2.92 0.00 -0.90 0.10 119.26 123.52 1vlj h ALA 329 Ca 0.13 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1vlj h ALA 329 Cb 0.61 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1vlj h ALA 329 CO 0.04 0.67 -0.07 0.35 0.00 0.00 0.00 179.25 180.24 1vlj h PHE 330 N 1.04 -0.19 -0.80 0.00 3.57 -0.91 -0.13 116.94 119.52 1vlj h PHE 330 Ca 0.20 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.79 1vlj h PHE 330 Cb 0.46 0.06 -0.07 0.00 2.79 0.00 0.00 35.95 39.19 1vlj h PHE 330 CO 0.03 -0.06 0.46 -0.22 -2.23 0.00 0.00 178.31 176.29 1vlj h LYS 331 N -0.28 0.76 -0.05 1.11 3.64 -1.08 -1.62 116.57 119.05 1vlj h LYS 331 Ca -0.02 -0.05 -0.13 0.00 -1.27 0.00 0.00 60.65 59.18 1vlj h LYS 331 Cb 0.22 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1vlj h LYS 331 CO 0.03 0.50 -0.57 -0.91 -2.27 0.00 0.00 179.45 176.24 1vlj h ASN 332 N 0.78 0.19 -0.05 4.20 2.35 -0.82 -0.87 115.58 121.35 1vlj h ASN 332 Ca 0.38 -0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1vlj h ASN 332 Cb 0.33 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.65 1vlj h ASN 332 CO -0.24 0.72 0.01 -0.25 -1.65 0.00 0.00 177.43 176.02 1vlj h TRP 333 N 0.13 0.09 -0.77 1.19 7.01 -0.49 0.45 115.95 123.55 1vlj h TRP 333 Ca -0.00 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.07 1vlj h TRP 333 Cb 1.04 -0.02 -0.07 0.00 -2.10 0.00 0.00 29.16 28.01 1vlj h TRP 333 CO 0.01 0.28 0.44 -0.07 -2.79 0.00 0.00 178.44 176.31 1vlj h LEU 334 N -0.13 0.65 -0.43 0.65 3.38 -1.10 -1.39 115.31 116.93 1vlj h LEU 334 Ca 0.02 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1vlj h LEU 334 Cb 0.24 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1vlj h LEU 334 CO 0.00 0.39 0.09 0.50 0.09 0.00 0.00 178.44 179.52 1vlj h LYS 335 N 0.77 0.69 -0.53 1.13 3.64 -1.06 -1.43 116.57 119.78 1vlj h LYS 335 Ca 0.36 -0.17 0.06 0.00 -1.27 0.00 0.00 60.65 59.63 1vlj h LYS 335 Cb 0.28 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 31.96 1vlj h LYS 335 CO -0.22 0.71 0.24 -0.22 -2.27 0.00 0.00 179.45 177.69 1vlj h LYS 336 N 0.56 0.45 -0.00 1.90 3.64 -0.30 -1.54 116.57 121.27 1vlj h LYS 336 Ca 0.13 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1vlj h LYS 336 Cb 0.33 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1vlj h LYS 336 CO 0.00 0.30 0.00 1.33 -2.27 0.00 0.00 179.45 178.81 1vlj n VAL 337 N -4.93 0.00 0.00 2.00 0.24 -0.58 -4.89 118.33 110.17 1vlj n VAL 337 Ca 0.06 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.31 1vlj n VAL 337 Cb 0.18 -0.32 0.00 0.00 -1.47 0.00 0.00 33.84 32.23 1vlj n VAL 337 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1vlj n GLY 338 N 1.03 0.66 3.80 7.63 0.00 -0.58 -4.96 105.19 112.77 1vlj n GLY 338 Ca 0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 1vlj n GLY 338 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vlj s ALA 339 N -2.00 2.81 0.31 4.61 0.00 -0.58 -5.00 121.76 121.91 1vlj s ALA 339 Ca 0.00 0.53 -0.29 0.00 0.00 0.00 0.00 51.96 52.20 1vlj s ALA 339 Cb 0.00 -3.25 -0.10 0.00 0.00 0.00 0.00 23.12 19.77 1vlj s ALA 339 CO 0.00 -0.54 1.24 -1.25 0.00 0.00 0.00 175.76 175.21 1vlj s PRO 340 N -3.58 4.44 -0.06 0.00 0.04 -1.26 -4.30 135.00 130.27 1vlj s PRO 340 Ca 0.66 2.08 0.09 0.00 0.04 0.00 0.00 61.00 63.87 1vlj s PRO 340 Cb -0.17 -3.12 0.14 0.00 0.04 0.00 0.00 34.50 31.40 1vlj s PRO 340 CO 0.27 -0.07 1.03 1.33 0.04 0.00 0.00 177.00 179.60 1vlj n VAL 341 N 1.06 1.17 -3.94 -0.36 0.24 -1.26 -3.12 118.33 112.13 1vlj n VAL 341 Ca 0.00 -1.36 -0.09 0.00 -2.04 0.00 0.00 64.34 60.86 1vlj n VAL 341 Cb 0.43 0.19 -0.08 0.00 -1.47 0.00 0.00 33.84 32.90 1vlj n VAL 341 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1vlj s SER 342 N -1.82 0.18 0.33 -1.34 1.04 -1.26 -4.76 113.70 106.07 1vlj s SER 342 Ca 0.16 -0.80 0.01 0.00 0.48 0.00 0.00 55.95 55.79 1vlj s SER 342 Cb 0.14 0.33 0.55 0.00 0.10 0.00 0.00 66.02 67.14 1vlj s SER 342 CO 0.01 -0.74 1.96 -0.07 0.98 0.00 0.00 173.24 175.39 1vlj h LEU 343 N 2.78 0.77 -0.49 2.42 3.38 -0.84 -2.34 115.31 121.01 1vlj h LEU 343 Ca -0.34 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1vlj h LEU 343 Cb 1.20 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1vlj h LEU 343 CO 0.56 0.60 0.32 0.50 0.09 0.00 0.00 178.44 180.51 1vlj h LYS 344 N 0.89 0.64 -0.77 1.13 1.63 -1.47 0.00 116.57 118.62 1vlj h LYS 344 Ca 0.23 -0.04 0.17 0.00 -0.85 0.00 0.00 60.65 60.16 1vlj h LYS 344 Cb -0.02 -0.14 -0.05 0.00 -0.60 0.00 0.00 32.23 31.42 1vlj h LYS 344 CO -0.04 0.43 0.52 -0.44 -3.45 0.00 0.00 179.45 176.47 1vlj h ASP 345 N 0.66 0.32 0.02 4.20 3.32 -1.71 -1.60 116.42 121.62 1vlj h ASP 345 Ca 0.18 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1vlj h ASP 345 Cb -0.07 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.45 1vlj h ASP 345 CO -0.04 0.15 -0.05 0.00 -1.72 0.00 0.00 179.24 177.59 1vlj n ALA 346 N -2.55 2.66 -0.87 3.45 0.00 -0.36 -4.93 120.51 117.90 1vlj n ALA 346 Ca 0.15 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1vlj n ALA 346 Cb 0.61 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.95 1vlj n ALA 346 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vlj n GLY 347 N 1.22 0.47 3.58 0.00 0.00 -0.60 -5.03 105.19 104.82 1vlj n GLY 347 Ca 0.17 -0.90 -0.38 0.00 0.00 0.00 0.00 46.02 44.91 1vlj n GLY 347 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vlj s ILE 348 N -2.00 5.17 0.22 -0.61 1.01 -0.16 -5.00 121.20 119.83 1vlj s ILE 348 Ca 0.00 0.12 -0.30 0.00 0.00 0.00 0.00 60.65 60.47 1vlj s ILE 348 Cb 0.00 -3.45 -0.09 0.00 0.01 0.00 0.00 42.46 38.92 1vlj s ILE 348 CO 0.00 0.27 1.40 -2.84 0.00 0.00 0.00 174.94 173.77 1vlj s PRO 349 N 1.65 4.31 0.49 2.79 0.02 -1.26 -3.76 135.00 139.23 1vlj s PRO 349 Ca 0.07 2.20 0.22 0.00 0.02 0.00 0.00 61.00 63.52 1vlj s PRO 349 Cb -0.16 -3.15 1.27 0.00 0.02 0.00 0.00 34.50 32.49 1vlj s PRO 349 CO 0.09 -0.37 1.95 1.49 -0.33 0.00 0.00 177.00 179.83 1vlj h GLU 350 N 5.37 0.16 0.00 5.54 4.81 -1.94 -0.67 114.58 127.85 1vlj h GLU 350 Ca -0.45 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1vlj h GLU 350 Cb 1.21 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.56 1vlj h GLU 350 CO 0.79 0.11 0.00 1.05 -0.73 0.00 0.00 179.01 180.23 1vlj h GLU 351 N 0.17 0.00 -0.01 1.92 9.09 -2.02 -2.35 114.58 121.38 1vlj h GLU 351 Ca 0.32 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.73 1vlj h GLU 351 Cb 1.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.15 1vlj h GLU 351 CO -0.05 0.00 -0.09 -0.25 0.05 0.00 0.00 179.01 178.67 1vlj n ASP 352 N -2.81 0.62 -0.26 3.06 9.92 -0.26 -4.21 116.55 122.61 1vlj n ASP 352 Ca -0.01 -0.81 0.05 0.00 -0.53 0.00 0.00 54.79 53.49 1vlj n ASP 352 Cb 0.16 -0.03 0.18 0.00 -0.64 0.00 0.00 41.12 40.78 1vlj n ASP 352 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 1vlj h ILE 353 N 0.83 0.72 -0.62 0.53 2.04 -1.57 -1.57 117.51 117.87 1vlj h ILE 353 Ca 0.00 -0.18 -0.04 0.00 1.00 0.00 0.00 64.86 65.64 1vlj h ILE 353 Cb 0.34 0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 1vlj h ILE 353 CO 0.00 0.10 0.22 0.44 0.00 0.00 0.00 178.15 178.90 1vlj h ASP 354 N 0.52 0.85 -0.56 1.72 3.32 -1.85 -0.04 116.42 120.39 1vlj h ASP 354 Ca 0.41 -0.13 -0.06 0.00 0.02 0.00 0.00 57.03 57.26 1vlj h ASP 354 Cb 0.57 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.87 1vlj h ASP 354 CO -0.36 0.78 0.12 0.11 -1.72 0.00 0.00 179.24 178.17 1vlj h LYS 355 N 0.90 0.95 -0.14 3.56 1.57 -1.61 -0.88 116.57 120.92 1vlj h LYS 355 Ca 0.21 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1vlj h LYS 355 Cb 0.22 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1vlj h LYS 355 CO -0.01 0.87 0.04 0.82 -0.57 0.00 0.00 179.45 180.59 1vlj h ILE 356 N 0.90 1.19 -0.80 1.86 2.04 -0.92 -2.39 117.51 119.39 1vlj h ILE 356 Ca 0.19 -0.58 0.05 0.00 1.00 0.00 0.00 64.86 65.52 1vlj h ILE 356 Cb 0.37 1.30 -0.06 0.00 -0.74 0.00 0.00 36.82 37.70 1vlj h ILE 356 CO 0.01 0.17 0.49 0.58 0.00 0.00 0.00 178.15 179.40 1vlj h VAL 357 N 0.04 1.05 -0.81 1.67 2.07 -0.87 -0.28 116.25 119.13 1vlj h VAL 357 Ca 0.05 -0.31 0.09 0.00 0.82 0.00 0.00 66.70 67.34 1vlj h VAL 357 Cb 0.23 0.06 -0.07 0.00 -1.52 0.00 0.00 31.29 29.99 1vlj h VAL 357 CO -0.00 0.17 0.46 0.44 0.02 0.00 0.00 177.57 178.66 1vlj h ASP 358 N 0.92 0.67 -0.20 0.57 3.32 -0.98 -0.79 116.42 119.93 1vlj h ASP 358 Ca 0.34 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 57.30 1vlj h ASP 358 Cb 0.12 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1vlj h ASP 358 CO -0.15 0.40 -0.33 -1.13 -1.72 0.00 0.00 179.24 176.30 1vlj h ASN 359 N 0.79 0.75 -0.62 6.45 -0.73 -0.60 -1.93 115.58 119.70 1vlj h ASN 359 Ca 0.38 -0.31 -0.03 0.00 1.87 0.00 0.00 56.30 58.21 1vlj h ASN 359 Cb 0.32 -0.21 -0.03 0.00 0.27 0.00 0.00 38.32 38.67 1vlj h ASN 359 CO -0.23 1.02 0.25 0.58 -0.37 0.00 0.00 177.43 178.68 1vlj h VAL 360 N 0.60 1.23 -0.22 2.57 2.07 -0.39 -1.76 116.25 120.36 1vlj h VAL 360 Ca 0.06 -0.71 -0.09 0.00 0.82 0.00 0.00 66.70 66.78 1vlj h VAL 360 Cb 0.86 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1vlj h VAL 360 CO 0.07 0.28 -0.26 0.24 0.02 0.00 0.00 177.57 177.92 1vlj h MET 361 N 0.86 0.43 -0.55 1.57 2.86 -0.97 -1.75 114.93 117.37 1vlj h MET 361 Ca 0.21 -0.16 -0.03 0.00 -2.06 0.00 0.00 59.70 57.66 1vlj h MET 361 Cb 0.19 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 1vlj h MET 361 CO -0.02 0.66 0.22 1.25 1.06 0.00 0.00 176.91 180.08 1vlj h LEU 362 N 0.38 0.76 -0.76 1.22 5.85 -1.03 -1.87 115.31 119.85 1vlj h LEU 362 Ca 0.06 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.62 1vlj h LEU 362 Cb 0.66 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 1vlj h LEU 362 CO 0.05 0.72 0.50 0.25 -0.34 0.00 0.00 178.44 179.62 1vlj h LEU 363 N 0.75 0.86 0.23 2.25 6.46 -0.79 0.25 115.31 125.33 1vlj h LEU 363 Ca 0.18 -0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.91 1vlj h LEU 363 Cb 0.20 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 39.92 1vlj h LEU 363 CO -0.01 0.62 -0.12 0.58 -0.62 0.00 0.00 178.44 178.89 1vlj h VAL 364 N 1.02 0.75 -0.18 1.05 2.07 -1.04 0.15 116.25 120.07 1vlj h VAL 364 Ca 0.28 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.82 1vlj h VAL 364 Cb -0.10 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 1vlj h VAL 364 CO -0.07 0.00 0.07 -0.33 0.02 0.00 0.00 177.57 177.26 1vlj h GLU 365 N -0.33 0.15 0.01 1.57 3.07 -0.94 -1.18 114.58 116.94 1vlj h GLU 365 Ca -0.03 -0.01 -0.32 0.00 -0.50 0.00 0.00 59.36 58.51 1vlj h GLU 365 Cb 0.26 -0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 28.08 1vlj h GLU 365 CO 0.04 0.10 -1.88 1.63 -1.40 0.00 0.00 179.01 177.50 1vlj n LYS 366 N -5.04 0.65 -0.10 2.33 4.76 0.84 -4.17 118.16 117.44 1vlj n LYS 366 Ca -0.03 0.23 -0.18 0.00 -2.87 0.00 0.00 58.31 55.47 1vlj n LYS 366 Cb 0.06 -1.73 -0.09 0.00 -1.84 0.00 0.00 35.03 31.44 1vlj n LYS 366 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1vlj n ASN 367 N -3.03 2.08 -0.08 4.39 4.05 0.47 -4.43 115.26 118.71 1vlj n ASN 367 Ca -0.22 0.04 -0.15 0.00 0.45 0.00 0.00 54.58 54.69 1vlj n ASN 367 Cb 1.07 -0.44 -0.12 0.00 1.23 0.00 0.00 39.78 41.53 1vlj n ASN 367 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1vlj h LEU 368 N -0.30 0.00 -1.19 1.20 3.38 -1.18 -3.39 115.31 113.82 1vlj h LEU 368 Ca -0.49 -0.77 -0.02 0.00 0.09 0.00 0.00 57.88 56.69 1vlj h LEU 368 Cb 1.61 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.33 1vlj h LEU 368 CO -0.17 1.11 0.33 0.11 0.09 0.00 0.00 178.44 179.91 1vlj h LYS 369 N -1.00 0.89 -0.35 1.13 6.56 -1.34 -0.91 116.57 121.54 1vlj h LYS 369 Ca -0.10 -0.10 0.06 0.00 -1.06 0.00 0.00 60.65 59.45 1vlj h LYS 369 Cb 1.02 -0.17 -0.02 0.00 -0.57 0.00 0.00 32.23 32.49 1vlj h LYS 369 CO -0.06 0.67 0.24 -1.35 -2.06 0.00 0.00 179.45 176.89 1vlj h PRO 370 N 0.89 0.18 -0.60 3.15 0.11 -1.77 -0.98 132.00 132.98 1vlj h PRO 370 Ca 0.22 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.24 1vlj h PRO 370 Cb 0.05 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 31.08 1vlj h PRO 370 CO -0.03 0.12 0.09 0.36 -0.21 0.00 0.00 178.00 178.33 1vlj n LYS 371 N -4.47 4.25 -1.49 1.05 2.85 -0.59 -4.93 118.16 114.82 1vlj n LYS 371 Ca 0.04 -3.12 -0.16 0.00 -1.05 0.00 0.00 58.31 54.03 1vlj n LYS 371 Cb 0.29 -2.21 -0.07 0.00 -0.65 0.00 0.00 35.03 32.40 1vlj n LYS 371 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1vlj n GLY 372 N 0.20 1.55 3.97 2.58 0.00 -0.37 -4.99 105.19 108.13 1vlj n GLY 372 Ca 0.32 -0.26 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 1vlj n GLY 372 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vlj s ALA 373 N -2.60 3.98 0.09 4.61 0.00 -0.45 -4.98 121.76 122.41 1vlj s ALA 373 Ca 0.00 -1.25 0.02 0.00 0.00 0.00 0.00 51.96 50.73 1vlj s ALA 373 Cb 0.00 -1.77 -0.04 0.00 0.00 0.00 0.00 23.12 21.31 1vlj s ALA 373 CO 0.00 0.12 -0.07 -1.54 0.00 0.00 0.00 175.76 174.27 1vlj s SER 374 N -4.04 1.13 -0.60 0.00 1.04 -1.26 -3.95 113.70 106.02 1vlj s SER 374 Ca 0.38 -0.95 -0.28 0.00 0.48 0.00 0.00 55.95 55.59 1vlj s SER 374 Cb -0.09 0.08 0.03 0.00 0.10 0.00 0.00 66.02 66.14 1vlj s SER 374 CO 0.31 -0.42 1.19 -0.22 0.98 0.00 0.00 173.24 175.08 1vlj s LEU 375 N -2.85 3.44 0.00 2.42 0.20 -1.26 -4.80 118.68 115.82 1vlj s LEU 375 Ca 0.09 -0.00 0.00 0.00 0.69 0.00 0.00 54.13 54.91 1vlj s LEU 375 Cb 0.03 -3.06 0.00 0.00 -0.43 0.00 0.00 46.19 42.73 1vlj s LEU 375 CO -0.04 -1.52 0.00 0.61 -0.29 0.00 0.00 176.35 175.11 1vlj n GLY 376 N 5.11 0.05 1.98 7.98 0.00 -1.25 -0.29 105.19 118.76 1vlj n GLY 376 Ca 0.07 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1vlj n GLY 376 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1vlj n ARG 377 N 0.19 0.00 0.22 1.61 0.63 -1.26 -4.58 116.66 113.46 1vlj n ARG 377 Ca 0.00 0.00 0.15 0.00 -0.92 0.00 0.00 57.85 57.08 1vlj n ARG 377 Cb 0.00 -0.01 0.54 0.00 0.45 0.00 0.00 32.46 33.44 1vlj n ARG 377 CO 0.00 0.00 0.00 -0.84 -2.51 0.00 0.00 177.63 174.28 1vlj h ILE 378 N 0.00 0.00 -2.83 5.15 3.07 -1.87 -3.39 117.51 117.64 1vlj h ILE 378 Ca 0.00 -0.50 -0.20 0.00 1.55 0.00 0.00 64.86 65.71 1vlj h ILE 378 Cb 0.01 1.43 -0.32 0.00 -0.27 0.00 0.00 36.82 37.67 1vlj h ILE 378 CO 0.00 0.00 -0.51 -0.32 -1.05 0.00 0.00 178.15 176.27 1vlj s MET 379 N -3.46 0.17 0.16 0.16 0.00 -1.26 -4.91 119.30 110.15 1vlj s MET 379 Ca 0.04 0.76 -0.30 0.00 0.00 0.00 0.00 55.69 56.19 1vlj s MET 379 Cb 0.09 -0.00 -0.07 0.00 0.00 0.00 0.00 34.83 34.85 1vlj s MET 379 CO 0.52 -0.27 1.00 0.08 0.00 0.00 0.00 175.02 176.35 1vlj s VAL 380 N 2.32 4.23 -0.27 10.11 1.01 -1.26 -4.43 120.40 132.12 1vlj s VAL 380 Ca -0.00 1.94 -0.10 0.00 0.00 0.00 0.00 61.98 63.82 1vlj s VAL 380 Cb -0.12 -4.24 -0.05 0.00 0.00 0.00 0.00 36.38 31.98 1vlj s VAL 380 CO -0.09 0.34 0.16 -0.76 0.00 0.00 0.00 175.10 174.75 1vlj s LEU 381 N -0.34 3.92 0.71 3.92 1.43 0.60 -5.00 118.68 123.93 1vlj s LEU 381 Ca 0.46 -0.03 -0.08 0.00 -1.03 0.00 0.00 54.13 53.46 1vlj s LEU 381 Cb -0.26 -2.08 0.06 0.00 0.03 0.00 0.00 46.19 43.94 1vlj s LEU 381 CO 0.32 -0.02 1.03 -1.61 0.23 0.00 0.00 176.35 176.30 1vlj s GLU 382 N 1.58 2.26 0.25 1.70 0.41 -1.26 -4.78 118.70 118.86 1vlj s GLU 382 Ca 0.07 -0.14 -0.14 0.00 -0.41 0.00 0.00 54.97 54.35 1vlj s GLU 382 Cb -0.15 -2.14 0.31 0.00 -1.78 0.00 0.00 34.13 30.37 1vlj s GLU 382 CO 0.08 -1.24 1.56 -0.09 -0.49 0.00 0.00 175.26 175.08 1vlj h ARG 383 N -0.64 -0.01 -0.76 1.61 2.43 -1.97 0.10 114.38 115.14 1vlj h ARG 383 Ca -0.45 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.71 1vlj h ARG 383 Cb 1.31 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.83 1vlj h ARG 383 CO 0.61 -0.01 0.43 0.93 -1.51 0.00 0.00 179.97 180.43 1vlj h GLU 384 N -0.01 1.05 -0.53 0.20 3.07 -1.99 -1.86 114.58 114.52 1vlj h GLU 384 Ca 0.39 -0.11 -0.10 0.00 -0.50 0.00 0.00 59.36 59.04 1vlj h GLU 384 Cb 0.64 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 28.32 1vlj h GLU 384 CO -0.98 0.76 -0.05 -0.44 -1.40 0.00 0.00 179.01 176.90 1vlj h ASP 385 N 1.06 0.96 -0.60 1.42 3.32 -1.22 -1.58 116.42 119.79 1vlj h ASP 385 Ca 0.27 -0.33 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1vlj h ASP 385 Cb 0.01 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 1vlj h ASP 385 CO -0.05 1.06 0.38 0.58 -1.72 0.00 0.00 179.24 179.50 1vlj h VAL 386 N 0.84 1.17 -0.54 -1.35 2.07 -0.88 -0.25 116.25 117.31 1vlj h VAL 386 Ca 0.14 -0.34 0.03 0.00 0.82 0.00 0.00 66.70 67.36 1vlj h VAL 386 Cb 0.60 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 1vlj h VAL 386 CO 0.04 0.17 0.31 -0.09 0.02 0.00 0.00 177.57 178.01 1vlj h ARG 387 N 0.81 0.59 -0.58 1.57 2.43 -1.21 -1.07 114.38 116.92 1vlj h ARG 387 Ca 0.22 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.25 1vlj h ARG 387 Cb -0.06 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 1vlj h ARG 387 CO -0.04 0.39 -0.02 0.93 -1.51 0.00 0.00 179.97 179.72 1vlj h GLU 388 N 0.61 1.03 -0.28 0.20 4.39 -0.77 -1.16 114.58 118.60 1vlj h GLU 388 Ca 0.22 -0.33 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 1vlj h GLU 388 Cb 0.06 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1vlj h GLU 388 CO -0.12 1.02 0.17 0.82 -1.16 0.00 0.00 179.01 179.74 1vlj h ILE 389 N 0.94 1.10 -0.52 3.13 2.04 -0.81 -1.54 117.51 121.85 1vlj h ILE 389 Ca 0.16 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.75 1vlj h ILE 389 Cb 0.57 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1vlj h ILE 389 CO 0.03 0.10 0.18 -0.07 0.00 0.00 0.00 178.15 178.39 1vlj h LEU 390 N 0.35 0.69 -0.69 1.44 3.38 -0.92 -2.07 115.31 117.49 1vlj h LEU 390 Ca 0.10 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1vlj h LEU 390 Cb 0.02 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1vlj h LEU 390 CO -0.02 0.65 0.43 0.11 0.09 0.00 0.00 178.44 179.70 1vlj h LYS 391 N 0.74 0.93 -0.12 1.13 1.57 -0.96 -0.54 116.57 119.32 1vlj h LYS 391 Ca 0.17 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.84 1vlj h LYS 391 Cb 0.19 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1vlj h LYS 391 CO -0.01 0.65 -0.09 -0.07 -0.57 0.00 0.00 179.45 179.35 1vlj h LEU 392 N 0.94 0.17 -0.14 2.94 3.38 -0.84 -2.42 115.31 119.34 1vlj h LEU 392 Ca 0.25 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1vlj h LEU 392 Cb -0.06 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1vlj h LEU 392 CO -0.05 0.30 -0.23 0.00 0.09 0.00 0.00 178.44 178.55 1vlj n ALA 393 N -2.50 2.96 -0.14 1.53 0.00 -0.82 -4.53 120.51 117.03 1vlj n ALA 393 Ca -0.01 -0.27 -0.10 0.00 0.00 0.00 0.00 53.44 53.06 1vlj n ALA 393 Cb 0.23 -1.27 -0.01 0.00 0.00 0.00 0.00 19.45 18.40 1vlj n ALA 393 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vlj h ALA 394 N 3.29 0.52 0.00 0.00 0.00 -0.59 0.27 119.26 122.75 1vlj h ALA 394 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1vlj h ALA 394 Cb 0.45 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1vlj h ALA 394 CO 0.00 0.20 0.00 0.36 0.00 0.00 0.00 179.25 179.81