#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vgg s LEU 3 N 0.00 4.10 0.09 -1.84 1.43 -1.26 -0.33 118.68 120.88 1vgg s LEU 3 Ca 0.00 0.32 0.02 0.00 -1.03 0.00 0.00 54.13 53.44 1vgg s LEU 3 Cb 0.00 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1vgg s LEU 3 CO 0.00 0.36 -0.06 -0.54 0.23 0.00 0.00 176.35 176.34 1vgg s LYS 4 N -1.21 0.81 -0.23 1.70 1.02 0.08 -4.99 119.74 116.92 1vgg s LYS 4 Ca 0.17 -1.30 0.02 0.00 0.02 0.00 0.00 55.97 54.89 1vgg s LYS 4 Cb -0.12 -0.19 0.05 0.00 -0.52 0.00 0.00 37.83 37.05 1vgg s LYS 4 CO 0.07 -0.02 -0.13 -1.17 -0.92 0.00 0.00 175.35 173.18 1vgg s LEU 5 N -2.95 2.83 -0.28 3.17 2.96 -1.26 -0.94 118.68 122.21 1vgg s LEU 5 Ca 0.10 -1.10 -0.06 0.00 -0.22 0.00 0.00 54.13 52.85 1vgg s LEU 5 Cb 0.04 -1.44 0.00 0.00 0.50 0.00 0.00 46.19 45.29 1vgg s LEU 5 CO -0.05 -0.14 0.06 -0.63 -1.32 0.00 0.00 176.35 174.28 1vgg s ILE 6 N 1.23 3.92 0.42 6.68 -1.09 0.34 -4.90 121.20 127.80 1vgg s ILE 6 Ca -0.04 -0.60 -0.23 0.00 -2.23 0.00 0.00 60.65 57.56 1vgg s ILE 6 Cb -0.17 -2.97 -0.09 0.00 -1.58 0.00 0.00 42.46 37.65 1vgg s ILE 6 CO -0.08 0.16 1.02 -2.84 -1.23 0.00 0.00 174.94 171.97 1vgg s PRO 7 N 1.51 4.13 -0.20 2.79 0.02 -1.26 0.21 135.00 142.20 1vgg s PRO 7 Ca 0.03 1.38 -0.12 0.00 0.02 0.00 0.00 61.00 62.32 1vgg s PRO 7 Cb -0.16 -2.39 -0.05 0.00 0.02 0.00 0.00 34.50 31.91 1vgg s PRO 7 CO 0.02 -0.15 0.23 0.42 -0.33 0.00 0.00 177.00 177.19 1vgg s ILE 8 N -1.83 5.33 -0.32 2.83 -1.09 -0.17 -4.90 121.20 121.06 1vgg s ILE 8 Ca 0.60 0.37 -0.29 0.00 -2.23 0.00 0.00 60.65 59.10 1vgg s ILE 8 Cb -0.18 -3.56 0.02 0.00 -1.58 0.00 0.00 42.46 37.15 1vgg s ILE 8 CO 0.23 0.37 1.07 -0.70 -1.23 0.00 0.00 174.94 174.68 1vgg s GLU 9 N 0.71 4.06 -0.27 2.79 2.12 -1.26 -4.64 118.70 122.21 1vgg s GLU 9 Ca 0.12 1.06 -0.02 0.00 0.36 0.00 0.00 54.97 56.50 1vgg s GLU 9 Cb -0.13 -3.74 0.16 0.00 0.26 0.00 0.00 34.13 30.68 1vgg s GLU 9 CO 0.03 -0.91 0.47 0.21 -0.54 0.00 0.00 175.26 174.52 1vgg s LYS 10 N 3.66 0.44 0.48 4.30 2.20 -1.26 -4.97 119.74 124.59 1vgg s LYS 10 Ca 0.45 0.69 -0.22 0.00 -0.36 0.00 0.00 55.97 56.54 1vgg s LYS 10 Cb -0.12 -0.07 -0.09 0.00 -1.51 0.00 0.00 37.83 36.03 1vgg s LYS 10 CO 0.15 -0.66 0.85 -2.30 -0.36 0.00 0.00 175.35 173.03 1vgg n PRO 11 N 5.39 1.00 -0.11 4.03 -0.02 -1.26 -4.83 135.00 139.19 1vgg n PRO 11 Ca -0.02 0.37 0.25 0.00 -2.02 0.00 0.00 63.50 62.07 1vgg n PRO 11 Cb 0.51 -1.93 0.70 0.00 -0.02 0.00 0.00 33.50 32.76 1vgg n PRO 11 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1vgg h GLU 12 N 1.00 0.03 -0.23 -0.52 3.07 -2.01 -1.87 114.58 114.05 1vgg h GLU 12 Ca -0.45 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.41 1vgg h GLU 12 Cb 1.36 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.27 1vgg h GLU 12 CO 0.53 0.02 0.00 0.27 -1.40 0.00 0.00 179.01 178.43 1vgg n ASN 13 N -4.32 1.41 -4.58 1.42 6.94 -1.26 -4.90 115.26 109.97 1vgg n ASN 13 Ca 0.15 -1.88 -0.25 0.00 -0.02 0.00 0.00 54.58 52.59 1vgg n ASN 13 Cb 0.81 -0.15 -0.09 0.00 -2.36 0.00 0.00 39.78 37.99 1vgg n ASN 13 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1vgg s LEU 14 N -1.20 2.97 0.14 -4.53 1.43 -0.70 -4.28 118.68 112.51 1vgg s LEU 14 Ca 0.23 -0.69 0.09 0.00 -1.03 0.00 0.00 54.13 52.73 1vgg s LEU 14 Cb 0.12 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.73 1vgg s LEU 14 CO 0.17 0.06 -0.15 0.20 0.23 0.00 0.00 176.35 176.86 1vgg s ASN 15 N -3.23 4.03 0.12 2.29 0.01 -1.21 -4.54 114.94 112.41 1vgg s ASN 15 Ca 0.28 -0.56 0.05 0.00 -0.71 0.00 0.00 52.86 51.92 1vgg s ASN 15 Cb -0.07 -0.62 -0.04 0.00 0.41 0.00 0.00 41.25 40.93 1vgg s ASN 15 CO 0.17 0.15 -0.12 0.68 -1.51 0.00 0.00 177.10 176.47 1vgg s VAL 16 N -1.34 1.17 -0.12 1.60 -7.23 -0.37 -0.72 120.40 113.38 1vgg s VAL 16 Ca 0.21 -1.75 -0.01 0.00 -1.81 0.00 0.00 61.98 58.62 1vgg s VAL 16 Cb -0.10 -1.52 0.04 0.00 0.56 0.00 0.00 36.38 35.36 1vgg s VAL 16 CO 0.12 -0.52 -0.02 -0.63 -0.31 0.00 0.00 175.10 173.74 1vgg s ILE 17 N -2.43 0.67 -0.15 -0.62 1.01 -0.37 -1.47 121.20 117.85 1vgg s ILE 17 Ca 0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 60.65 60.48 1vgg s ILE 17 Cb -0.03 -0.88 -0.02 0.00 0.01 0.00 0.00 42.46 41.54 1vgg s ILE 17 CO 0.02 0.16 -0.09 -0.22 0.00 0.00 0.00 174.94 174.80 1vgg s LEU 18 N 1.83 2.88 0.00 2.97 2.96 -0.34 -0.89 118.68 128.09 1vgg s LEU 18 Ca 0.03 -0.29 -0.01 0.00 -0.22 0.00 0.00 54.13 53.64 1vgg s LEU 18 Cb -0.14 -1.67 0.00 0.00 0.50 0.00 0.00 46.19 44.88 1vgg s LEU 18 CO -0.07 0.14 0.15 0.61 -1.32 0.00 0.00 176.35 175.87 1vgg n GLY 19 N 3.71 2.70 3.22 7.98 0.00 -0.35 0.03 105.19 122.48 1vgg n GLY 19 Ca -0.18 -1.40 -0.30 0.00 0.00 0.00 0.00 46.02 44.14 1vgg n GLY 19 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1vgg s GLN 20 N -2.21 2.36 0.00 1.61 2.00 0.47 -0.66 119.66 123.23 1vgg s GLN 20 Ca 0.08 -0.81 0.00 0.00 -2.00 0.00 0.00 55.36 52.63 1vgg s GLN 20 Cb -0.00 -1.99 0.00 0.00 0.80 0.00 0.00 33.01 31.82 1vgg s GLN 20 CO 0.06 0.32 0.00 0.00 -0.50 0.00 0.00 175.29 175.17 1vgg n ALA 21 N 3.06 0.00 -3.59 1.58 0.00 0.22 -1.04 120.51 120.74 1vgg n ALA 21 Ca -0.18 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.21 1vgg n ALA 21 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1vgg n ALA 21 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1vgg s HIS 22 N -0.25 -0.18 0.17 0.00 -3.43 -0.97 -4.79 115.29 105.85 1vgg s HIS 22 Ca 0.00 0.18 0.00 0.00 -0.80 0.00 0.00 55.06 54.44 1vgg s HIS 22 Cb 0.00 0.50 0.00 0.00 -1.43 0.00 0.00 32.58 31.65 1vgg s HIS 22 CO 0.00 -0.24 0.00 0.34 -2.00 0.00 0.00 174.74 172.84 1vgg n PHE 23 N 0.11 -1.53 0.29 0.38 7.35 -1.26 -4.44 117.46 118.36 1vgg n PHE 23 Ca -0.02 0.81 0.18 0.00 -0.76 0.00 0.00 57.45 57.66 1vgg n PHE 23 Cb 0.59 -1.93 0.98 0.00 0.35 0.00 0.00 39.48 39.47 1vgg n PHE 23 CO 0.00 0.00 0.00 0.97 -0.76 0.00 0.00 176.76 176.97 1vgg h ILE 24 N 0.63 0.34 0.00 -2.13 6.09 -2.02 -1.99 117.51 118.44 1vgg h ILE 24 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1vgg h ILE 24 Cb 0.00 0.95 0.00 0.00 0.47 0.00 0.00 36.82 38.24 1vgg h ILE 24 CO 0.00 0.00 0.00 1.17 -3.07 0.00 0.00 178.15 176.25 1vgg n LYS 25 N -3.58 0.03 -0.27 2.19 4.81 -1.26 -2.83 118.16 117.24 1vgg n LYS 25 Ca -0.02 0.32 0.04 0.00 -0.87 0.00 0.00 58.31 57.78 1vgg n LYS 25 Cb 0.14 -1.50 0.17 0.00 0.02 0.00 0.00 35.03 33.86 1vgg n LYS 25 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1vgg h THR 26 N 0.00 0.82 0.61 3.15 2.02 -1.57 -1.25 112.91 116.69 1vgg h THR 26 Ca 0.00 -0.22 -0.03 0.00 0.77 0.00 0.00 66.41 66.93 1vgg h THR 26 Cb 0.13 0.11 0.01 0.00 -1.74 0.00 0.00 68.15 66.65 1vgg h THR 26 CO 0.00 0.12 -0.29 0.58 0.37 0.00 0.00 175.52 176.30 1vgg h VAL 27 N 0.65 0.37 -0.51 3.16 2.07 -1.79 -0.31 116.25 119.89 1vgg h VAL 27 Ca 0.40 -0.13 -0.06 0.00 0.82 0.00 0.00 66.70 67.73 1vgg h VAL 27 Cb 0.47 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 1vgg h VAL 27 CO -0.30 0.02 0.07 -0.33 0.02 0.00 0.00 177.57 177.05 1vgg h GLU 28 N -0.91 0.84 -0.47 1.57 5.08 -1.77 -2.18 114.58 116.74 1vgg h GLU 28 Ca -0.08 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1vgg h GLU 28 Cb 0.66 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1vgg h GLU 28 CO 0.14 0.84 0.30 -0.44 -1.00 0.00 0.00 179.01 178.85 1vgg h ASP 29 N 0.72 0.55 -0.42 1.42 3.32 -1.19 -0.54 116.42 120.29 1vgg h ASP 29 Ca 0.15 -0.03 -0.15 0.00 0.02 0.00 0.00 57.03 57.02 1vgg h ASP 29 Cb 0.41 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1vgg h ASP 29 CO 0.01 0.42 -0.31 -0.07 -1.72 0.00 0.00 179.24 177.57 1vgg h LEU 30 N 0.63 1.00 -0.21 1.55 3.38 -1.00 -0.57 115.31 120.10 1vgg h LEU 30 Ca 0.17 -0.43 0.01 0.00 0.09 0.00 0.00 57.88 57.72 1vgg h LEU 30 Cb -0.04 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 1vgg h LEU 30 CO -0.03 1.22 0.12 -0.74 0.09 0.00 0.00 178.44 179.10 1vgg h HIS 31 N 0.80 0.22 -0.84 1.13 2.76 -1.23 -1.11 115.15 116.89 1vgg h HIS 31 Ca 0.08 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.24 1vgg h HIS 31 Cb 0.90 -0.07 -0.04 0.00 1.55 0.00 0.00 27.41 29.75 1vgg h HIS 31 CO 0.06 0.13 0.46 0.93 -1.30 0.00 0.00 177.93 178.22 1vgg h GLU 32 N 0.25 1.16 -0.78 5.26 5.08 -0.99 -2.07 114.58 122.48 1vgg h GLU 32 Ca 0.08 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1vgg h GLU 32 Cb -0.00 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 28.98 1vgg h GLU 32 CO -0.04 0.85 0.40 0.00 -1.00 0.00 0.00 179.01 179.23 1vgg h ALA 33 N 1.25 1.01 -0.18 3.43 0.00 -0.69 -1.54 119.26 122.54 1vgg h ALA 33 Ca 0.29 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1vgg h ALA 33 Cb 0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1vgg h ALA 33 CO -0.05 0.55 -0.02 -0.07 0.00 0.00 0.00 179.25 179.66 1vgg h LEU 34 N 1.10 0.32 -1.24 0.00 3.38 -0.84 -1.74 115.31 116.29 1vgg h LEU 34 Ca 0.27 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1vgg h LEU 34 Cb 0.08 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1vgg h LEU 34 CO -0.04 0.58 -0.13 -0.37 0.09 0.00 0.00 178.44 178.57 1vgg h VAL 35 N 0.05 0.33 0.03 1.22 -1.51 -1.30 -2.45 116.25 112.63 1vgg h VAL 35 Ca 0.05 -0.87 -0.22 0.00 -1.23 0.00 0.00 66.70 64.43 1vgg h VAL 35 Cb 0.43 1.66 -0.02 0.00 -2.13 0.00 0.00 31.29 31.23 1vgg h VAL 35 CO 0.01 0.13 -1.04 0.74 -1.23 0.00 0.00 177.57 176.18 1vgg h THR 36 N 0.00 1.64 -0.15 7.19 2.02 -1.20 -3.35 112.91 119.06 1vgg h THR 36 Ca -0.00 -3.23 -0.19 0.00 0.77 0.00 0.00 66.41 63.76 1vgg h THR 36 Cb 0.65 2.82 0.01 0.00 -1.74 0.00 0.00 68.15 69.89 1vgg h THR 36 CO 0.02 0.93 -0.64 0.00 0.37 0.00 0.00 175.52 176.19 1vgg h ALA 37 N 0.91 0.28 -3.37 6.16 0.00 -0.91 -3.45 119.26 118.88 1vgg h ALA 37 Ca -0.04 -0.55 -0.43 0.00 0.00 0.00 0.00 54.91 53.89 1vgg h ALA 37 Cb 1.78 -0.02 -0.36 0.00 0.00 0.00 0.00 17.79 19.19 1vgg h ALA 37 CO 0.15 0.56 -0.77 0.08 0.00 0.00 0.00 179.25 179.26 1vgg s VAL 38 N -3.77 0.51 0.15 0.00 1.01 -0.96 -5.02 120.40 112.32 1vgg s VAL 38 Ca -0.11 -0.05 -0.31 0.00 0.00 0.00 0.00 61.98 61.51 1vgg s VAL 38 Cb 0.08 -0.59 -0.08 0.00 0.00 0.00 0.00 36.38 35.79 1vgg s VAL 38 CO 0.87 0.25 1.31 -2.16 0.00 0.00 0.00 175.10 175.37 1vgg s PRO 39 N 1.35 4.38 -0.46 2.72 0.04 -1.26 -2.91 135.00 138.85 1vgg s PRO 39 Ca -0.04 2.00 0.00 0.00 0.04 0.00 0.00 61.00 63.00 1vgg s PRO 39 Cb -0.13 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.17 1vgg s PRO 39 CO -0.02 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.12 1vgg n GLY 40 N 2.89 0.65 3.72 0.56 0.00 -1.26 -4.96 105.19 106.79 1vgg n GLY 40 Ca 0.08 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1vgg n GLY 40 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1vgg n ILE 41 N -2.60 1.53 -4.07 -0.61 3.06 -1.15 -4.98 119.36 110.53 1vgg n ILE 41 Ca -0.04 -0.38 -0.35 0.00 -2.50 0.00 0.00 62.75 59.48 1vgg n ILE 41 Cb 0.28 -1.74 -0.13 0.00 0.54 0.00 0.00 39.64 38.59 1vgg n ILE 41 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 1vgg s ARG 42 N -1.27 3.55 0.25 9.51 0.52 -1.26 -4.83 118.95 125.43 1vgg s ARG 42 Ca 0.60 -0.55 -0.22 0.00 -0.52 0.00 0.00 55.73 55.04 1vgg s ARG 42 Cb -0.55 -3.04 0.03 0.00 0.52 0.00 0.00 34.95 31.91 1vgg s ARG 42 CO 0.56 -0.03 0.75 -0.59 0.02 0.00 0.00 175.30 176.01 1vgg s PHE 43 N 1.09 -0.21 -0.02 -0.53 -0.71 -1.26 -0.82 117.98 115.52 1vgg s PHE 43 Ca 0.02 -0.21 0.03 0.00 -1.04 0.00 0.00 56.93 55.73 1vgg s PHE 43 Cb -0.14 0.69 -0.00 0.00 -1.21 0.00 0.00 43.02 42.35 1vgg s PHE 43 CO 0.01 -1.14 -0.11 0.20 -1.34 0.00 0.00 175.22 172.84 1vgg s GLY 44 N -2.91 0.57 -0.03 1.99 0.00 -0.27 -1.47 107.32 105.20 1vgg s GLY 44 Ca 0.10 -0.44 0.03 0.00 0.00 0.00 0.00 44.72 44.41 1vgg s GLY 44 CO 0.05 -0.28 -0.13 -2.27 0.00 0.00 0.00 173.10 170.47 1vgg s LEU 45 N -0.07 1.85 0.03 0.66 2.96 0.39 -0.57 118.68 123.93 1vgg s LEU 45 Ca 0.01 -0.26 0.03 0.00 -0.22 0.00 0.00 54.13 53.69 1vgg s LEU 45 Cb -0.06 -0.74 -0.02 0.00 0.50 0.00 0.00 46.19 45.87 1vgg s LEU 45 CO 0.00 0.11 -0.09 0.00 -1.32 0.00 0.00 176.35 175.05 1vgg s ALA 46 N 0.10 0.72 -0.04 5.97 0.00 -0.49 -1.49 121.76 126.53 1vgg s ALA 46 Ca -0.03 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.31 1vgg s ALA 46 Cb -0.10 -0.07 0.03 0.00 0.00 0.00 0.00 23.12 22.97 1vgg s ALA 46 CO 0.01 0.09 0.00 0.12 0.00 0.00 0.00 175.76 175.99 1vgg s PHE 47 N -0.83 0.39 -0.79 0.00 5.99 -0.29 -1.10 117.98 121.35 1vgg s PHE 47 Ca -0.03 -0.02 -0.21 0.00 0.00 0.00 0.00 56.93 56.67 1vgg s PHE 47 Cb -0.07 -0.50 0.10 0.00 0.00 0.00 0.00 43.02 42.55 1vgg s PHE 47 CO 0.00 -0.17 1.05 0.45 -0.00 0.00 0.00 175.22 176.55 1vgg s SER 48 N 1.24 6.38 0.24 6.13 0.15 -0.08 -0.24 113.70 127.52 1vgg s SER 48 Ca -0.07 -1.47 -0.31 0.00 0.70 0.00 0.00 55.95 54.80 1vgg s SER 48 Cb -0.13 -2.41 -0.11 0.00 -1.71 0.00 0.00 66.02 61.65 1vgg s SER 48 CO -0.02 -1.28 1.65 -0.70 1.20 0.00 0.00 173.24 174.09 1vgg s GLU 49 N 3.48 4.13 -0.02 5.44 2.12 -0.83 -0.27 118.70 132.76 1vgg s GLU 49 Ca 0.27 2.57 0.11 0.00 0.36 0.00 0.00 54.97 58.29 1vgg s GLU 49 Cb -0.11 -3.06 0.33 0.00 0.26 0.00 0.00 34.13 31.55 1vgg s GLU 49 CO 0.01 -0.68 1.28 0.00 -0.54 0.00 0.00 175.26 175.32 1vgg n ALA 50 N 3.23 2.28 -3.97 6.30 0.00 -1.26 -4.00 120.51 123.09 1vgg n ALA 50 Ca 0.12 -1.28 -0.13 0.00 0.00 0.00 0.00 53.44 52.15 1vgg n ALA 50 Cb 0.36 -0.47 -0.03 0.00 0.00 0.00 0.00 19.45 19.31 1vgg n ALA 50 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1vgg n SER 51 N 0.40 -1.20 0.00 0.00 3.41 -1.26 -4.93 113.62 110.04 1vgg n SER 51 Ca 0.13 -2.76 0.00 0.00 -0.26 0.00 0.00 58.87 55.98 1vgg n SER 51 Cb 0.48 2.26 0.00 0.00 -0.26 0.00 0.00 64.21 66.69 1vgg n SER 51 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vgg n GLY 52 N -0.53 3.70 0.11 5.00 0.00 -1.26 -0.78 105.19 111.42 1vgg n GLY 52 Ca 0.01 0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.28 1vgg n GLY 52 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1vgg n LYS 53 N 14.00 0.19 -3.88 1.61 5.02 -1.26 -4.92 118.16 128.92 1vgg n LYS 53 Ca 0.00 0.35 -0.29 0.00 -2.02 0.00 0.00 58.31 56.36 1vgg n LYS 53 Cb 0.00 -1.82 0.03 0.00 -0.02 0.00 0.00 35.03 33.22 1vgg n LYS 53 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1vgg n ARG 54 N -2.16 -5.50 -3.82 1.97 1.74 0.04 -4.97 116.66 103.96 1vgg n ARG 54 Ca 0.03 0.61 -0.33 0.00 -0.77 0.00 0.00 57.85 57.39 1vgg n ARG 54 Cb 0.27 -5.45 -0.05 0.00 -1.02 0.00 0.00 32.46 26.22 1vgg n ARG 54 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1vgg s LEU 55 N -7.20 4.35 -0.11 0.55 1.43 -1.26 -4.78 118.68 111.67 1vgg s LEU 55 Ca 0.56 0.45 -0.30 0.00 -1.03 0.00 0.00 54.13 53.81 1vgg s LEU 55 Cb -0.28 -2.81 -0.02 0.00 0.03 0.00 0.00 46.19 43.12 1vgg s LEU 55 CO 0.83 0.21 1.14 -0.69 0.23 0.00 0.00 176.35 178.06 1vgg s VAL 56 N -1.40 4.46 0.10 -1.59 1.01 -1.26 -1.96 120.40 119.76 1vgg s VAL 56 Ca 0.31 1.76 -0.05 0.00 0.00 0.00 0.00 61.98 64.00 1vgg s VAL 56 Cb -0.13 -4.13 -0.05 0.00 0.00 0.00 0.00 36.38 32.06 1vgg s VAL 56 CO 0.20 -0.05 0.34 -0.13 0.00 0.00 0.00 175.10 175.46 1vgg s ARG 57 N 2.52 3.60 0.02 2.72 1.81 0.67 -4.91 118.95 125.37 1vgg s ARG 57 Ca 0.52 -0.12 0.02 0.00 -1.72 0.00 0.00 55.73 54.43 1vgg s ARG 57 Cb -0.21 -2.93 -0.01 0.00 -0.45 0.00 0.00 34.95 31.35 1vgg s ARG 57 CO 0.17 0.52 -0.06 -0.98 -0.68 0.00 0.00 175.30 174.28 1vgg s ARG 58 N -2.43 0.42 -0.10 3.54 1.70 -1.26 -1.13 118.95 119.69 1vgg s ARG 58 Ca 0.37 -0.46 -0.30 0.00 -0.47 0.00 0.00 55.73 54.87 1vgg s ARG 58 Cb -0.13 -0.27 0.08 0.00 -0.57 0.00 0.00 34.95 34.07 1vgg s ARG 58 CO 0.23 0.06 0.77 0.45 -1.08 0.00 0.00 175.30 175.73 1vgg s SER 59 N -0.88 -0.59 0.00 -2.89 0.15 -0.55 -5.02 113.70 103.91 1vgg s SER 59 Ca -0.05 0.70 0.00 0.00 0.70 0.00 0.00 55.95 57.30 1vgg s SER 59 Cb -0.06 0.56 0.00 0.00 -1.71 0.00 0.00 66.02 64.81 1vgg s SER 59 CO 0.00 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 174.54 1vgg n GLY 60 N 1.04 -1.69 0.20 9.45 0.00 -1.26 -0.46 105.19 112.46 1vgg n GLY 60 Ca -0.16 -1.09 0.02 0.00 0.00 0.00 0.00 46.02 44.78 1vgg n GLY 60 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1vgg n THR 61 N 0.84 0.72 -3.51 2.61 -2.24 -0.54 -4.93 114.28 107.22 1vgg n THR 61 Ca 0.00 -0.86 -0.10 0.00 -2.27 0.00 0.00 64.05 60.83 1vgg n THR 61 Cb 0.00 0.66 -0.09 0.00 -2.10 0.00 0.00 70.33 68.80 1vgg n THR 61 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1vgg s ASP 62 N -0.81 0.10 0.25 3.42 -1.08 -1.18 -4.77 116.67 112.61 1vgg s ASP 62 Ca 0.07 0.56 -0.03 0.00 -0.52 0.00 0.00 52.55 52.63 1vgg s ASP 62 Cb 0.04 1.13 0.47 0.00 -1.46 0.00 0.00 42.92 43.10 1vgg s ASP 62 CO 0.05 -0.27 1.78 -0.08 0.52 0.00 0.00 175.17 177.18 1vgg h GLU 63 N 8.20 0.67 -0.57 4.34 4.57 -1.91 -1.20 114.58 128.68 1vgg h GLU 63 Ca -0.17 -0.04 -0.11 0.00 -1.18 0.00 0.00 59.36 57.86 1vgg h GLU 63 Cb 1.13 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.55 1vgg h GLU 63 CO 0.20 0.44 -0.07 0.00 -1.18 0.00 0.00 179.01 178.40 1vgg h ALA 64 N 1.51 0.78 -0.49 2.92 0.00 -1.97 -0.73 119.26 121.28 1vgg h ALA 64 Ca 0.43 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1vgg h ALA 64 Cb 0.52 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1vgg h ALA 64 CO -0.31 0.67 -0.04 -0.07 0.00 0.00 0.00 179.25 179.50 1vgg h LEU 65 N 0.95 0.83 -0.31 0.00 3.38 -1.74 -1.26 115.31 117.17 1vgg h LEU 65 Ca 0.15 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 1vgg h LEU 65 Cb 0.64 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1vgg h LEU 65 CO 0.04 0.92 0.04 0.58 0.09 0.00 0.00 178.44 180.12 1vgg h VAL 66 N 0.78 1.24 -0.31 1.22 2.07 -1.01 -1.55 116.25 118.69 1vgg h VAL 66 Ca 0.14 -0.83 -0.03 0.00 0.82 0.00 0.00 66.70 66.81 1vgg h VAL 66 Cb 0.53 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1vgg h VAL 66 CO 0.03 0.27 0.06 -0.33 0.02 0.00 0.00 177.57 177.62 1vgg h GLU 67 N 0.34 0.45 -0.40 1.57 5.08 -0.91 -0.66 114.58 120.05 1vgg h GLU 67 Ca 0.09 -0.07 -0.15 0.00 -1.00 0.00 0.00 59.36 58.24 1vgg h GLU 67 Cb 0.36 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1vgg h GLU 67 CO 0.01 0.43 -0.33 1.25 -1.00 0.00 0.00 179.01 179.37 1vgg h LEU 68 N 0.44 0.95 -0.32 1.33 5.85 -0.92 -0.82 115.31 121.82 1vgg h LEU 68 Ca 0.10 -0.41 -0.04 0.00 0.84 0.00 0.00 57.88 58.38 1vgg h LEU 68 Cb 0.20 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1vgg h LEU 68 CO -0.00 1.19 0.04 0.00 -0.34 0.00 0.00 178.44 179.32 1vgg h ALA 69 N 0.86 0.43 -0.38 1.25 0.00 -0.61 -2.30 119.26 118.52 1vgg h ALA 69 Ca 0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1vgg h ALA 69 Cb 0.90 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1vgg h ALA 69 CO 0.08 0.14 0.18 0.28 0.00 0.00 0.00 179.25 179.94 1vgg h VAL 70 N 0.36 1.17 -0.35 0.00 2.07 -1.04 -2.01 116.25 116.45 1vgg h VAL 70 Ca 0.10 -0.47 0.04 0.00 0.82 0.00 0.00 66.70 67.18 1vgg h VAL 70 Cb 0.37 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 1vgg h VAL 70 CO 0.01 0.18 0.12 0.50 0.02 0.00 0.00 177.57 178.39 1vgg h LYS 71 N 0.48 0.25 -0.92 1.57 3.64 -1.10 -1.30 116.57 119.19 1vgg h LYS 71 Ca 0.13 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1vgg h LYS 71 Cb 0.11 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 1vgg h LYS 71 CO -0.02 0.17 0.55 -0.91 -2.27 0.00 0.00 179.45 176.97 1vgg h ASN 72 N 0.26 1.12 0.65 4.20 2.35 -1.23 -2.32 115.58 120.62 1vgg h ASN 72 Ca 0.16 -0.07 -0.07 0.00 -0.55 0.00 0.00 56.30 55.76 1vgg h ASN 72 Cb 0.13 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 1vgg h ASN 72 CO -0.17 0.86 -0.35 -0.07 -1.65 0.00 0.00 177.43 176.05 1vgg h LEU 73 N 1.28 0.00 -0.75 1.61 3.38 -0.84 -0.70 115.31 119.28 1vgg h LEU 73 Ca 0.33 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.17 1vgg h LEU 73 Cb -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1vgg h LEU 73 CO -0.06 0.35 -0.52 -0.07 0.09 0.00 0.00 178.44 178.23 1vgg h LEU 74 N 0.00 0.29 -0.12 1.67 3.38 -0.73 0.12 115.31 119.93 1vgg h LEU 74 Ca -0.00 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.70 1vgg h LEU 74 Cb 0.78 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1vgg h LEU 74 CO 0.05 0.76 -0.40 0.78 0.09 0.00 0.00 178.44 179.72 1vgg h ASN 75 N 0.21 0.55 -0.37 -0.43 2.35 -0.96 -3.28 115.58 113.64 1vgg h ASN 75 Ca 0.01 -0.61 -0.08 0.00 -0.55 0.00 0.00 56.30 55.07 1vgg h ASN 75 Cb 0.99 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 39.19 1vgg h ASN 75 CO 0.08 1.07 -0.06 -0.07 -1.65 0.00 0.00 177.43 176.79 1vgg h LEU 76 N 0.06 0.70 -2.29 1.61 3.38 -1.08 -3.48 115.31 114.22 1vgg h LEU 76 Ca -0.02 -0.35 -0.48 0.00 0.09 0.00 0.00 57.88 57.13 1vgg h LEU 76 Cb 1.02 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1vgg h LEU 76 CO 0.08 0.88 -0.90 0.00 0.09 0.00 0.00 178.44 178.60 1vgg n ALA 77 N -2.42 -2.17 -3.63 1.53 0.00 0.02 -4.98 120.51 108.86 1vgg n ALA 77 Ca -0.02 -0.26 -0.33 0.00 0.00 0.00 0.00 53.44 52.83 1vgg n ALA 77 Cb 0.33 -2.22 -0.16 0.00 0.00 0.00 0.00 19.45 17.40 1vgg n ALA 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vgg n GLY 79 N 4.17 0.78 2.58 0.00 0.00 -1.26 -2.81 105.19 108.65 1vgg n GLY 79 Ca -0.20 0.44 -0.01 0.00 0.00 0.00 0.00 46.02 46.26 1vgg n GLY 79 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1vgg n HIS 80 N 1.47 0.00 -3.04 1.61 8.25 0.63 -4.95 115.22 119.20 1vgg n HIS 80 Ca 0.09 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.22 1vgg n HIS 80 Cb 0.33 -1.24 -0.06 0.00 1.12 0.00 0.00 29.99 30.14 1vgg n HIS 80 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1vgg s VAL 81 N -1.46 4.57 0.13 1.59 1.01 -1.12 -0.61 120.40 124.50 1vgg s VAL 81 Ca 0.00 1.17 0.06 0.00 0.00 0.00 0.00 61.98 63.21 1vgg s VAL 81 Cb 0.00 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 1vgg s VAL 81 CO 0.00 -0.15 -0.13 0.72 0.00 0.00 0.00 175.10 175.54 1vgg s PHE 82 N -1.95 1.37 -0.04 5.22 -0.12 0.17 -0.91 117.98 121.72 1vgg s PHE 82 Ca 0.54 -0.58 -0.01 0.00 -0.05 0.00 0.00 56.93 56.82 1vgg s PHE 82 Cb -0.11 -0.71 0.03 0.00 -0.63 0.00 0.00 43.02 41.60 1vgg s PHE 82 CO 0.17 0.14 0.09 -1.17 -0.05 0.00 0.00 175.22 174.40 1vgg s LEU 83 N -2.56 0.84 -0.14 -1.99 2.96 -0.26 -1.21 118.68 116.31 1vgg s LEU 83 Ca 0.10 0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 54.17 1vgg s LEU 83 Cb -0.04 0.14 -0.01 0.00 0.50 0.00 0.00 46.19 46.78 1vgg s LEU 83 CO 0.03 -0.15 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.16 1vgg s ILE 84 N 1.21 3.03 -0.23 6.68 1.01 -0.07 -1.40 121.20 131.41 1vgg s ILE 84 Ca -0.08 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 59.86 1vgg s ILE 84 Cb -0.12 -2.28 -0.01 0.00 0.01 0.00 0.00 42.46 40.06 1vgg s ILE 84 CO -0.04 0.51 -0.02 -0.69 0.00 0.00 0.00 174.94 174.70 1vgg s VAL 85 N 0.56 3.52 -0.10 2.92 1.01 0.26 -1.23 120.40 127.34 1vgg s VAL 85 Ca -0.08 -0.50 -0.13 0.00 0.00 0.00 0.00 61.98 61.27 1vgg s VAL 85 Cb -0.16 -2.64 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 1vgg s VAL 85 CO 0.04 0.37 0.32 -0.76 0.00 0.00 0.00 175.10 175.06 1vgg s LEU 86 N 1.49 4.34 0.89 3.92 1.43 0.10 -1.11 118.68 129.74 1vgg s LEU 86 Ca 0.05 0.67 -0.11 0.00 -1.03 0.00 0.00 54.13 53.71 1vgg s LEU 86 Cb -0.15 -2.42 0.13 0.00 0.03 0.00 0.00 46.19 43.78 1vgg s LEU 86 CO -0.02 0.21 1.09 -0.83 0.23 0.00 0.00 176.35 177.04 1vgg s GLY 87 N -0.25 1.63 0.20 -3.19 0.00 0.00 -3.31 107.32 102.40 1vgg s GLY 87 Ca 0.19 0.08 -0.32 0.00 0.00 0.00 0.00 44.72 44.67 1vgg s GLY 87 CO 0.07 0.55 1.33 -2.21 0.00 0.00 0.00 173.10 172.84 1vgg n GLU 88 N -3.93 1.69 -0.22 2.90 2.13 -1.26 -1.96 120.64 119.99 1vgg n GLU 88 Ca 0.08 0.60 0.00 0.00 0.66 0.00 0.00 57.16 58.50 1vgg n GLU 88 Cb 0.54 -2.21 0.00 0.00 0.27 0.00 0.00 31.44 30.04 1vgg n GLU 88 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1vgg n GLY 89 N 2.22 1.16 3.39 8.31 0.00 -1.26 -5.02 105.19 113.98 1vgg n GLY 89 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1vgg n GLY 89 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vgg s PHE 90 N -2.71 2.86 0.18 1.61 0.08 -0.83 -5.12 117.98 114.05 1vgg s PHE 90 Ca 0.00 -0.61 0.11 0.00 0.12 0.00 0.00 56.93 56.55 1vgg s PHE 90 Cb 0.00 -1.89 -0.04 0.00 -0.57 0.00 0.00 43.02 40.52 1vgg s PHE 90 CO 0.00 -0.21 -0.20 0.71 -0.10 0.00 0.00 175.22 175.42 1vgg s TYR 91 N 0.45 2.41 0.41 0.36 1.51 -1.26 -4.66 117.35 116.55 1vgg s TYR 91 Ca -0.08 -0.32 0.11 0.00 -1.01 0.00 0.00 57.07 55.77 1vgg s TYR 91 Cb -0.15 -1.20 0.93 0.00 -0.11 0.00 0.00 41.96 41.43 1vgg s TYR 91 CO 0.04 0.49 1.97 -1.35 -1.11 0.00 0.00 175.55 175.59 1vgg h PRO 92 N 3.20 0.51 0.00 -1.71 0.11 -1.96 -0.47 132.00 131.68 1vgg h PRO 92 Ca -0.47 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1vgg h PRO 92 Cb 1.20 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1vgg h PRO 92 CO 0.49 0.34 -0.06 -0.84 -0.21 0.00 0.00 178.00 177.71 1vgg h ILE 93 N 0.52 0.45 -0.00 4.15 3.07 -2.00 0.34 117.51 124.04 1vgg h ILE 93 Ca 0.29 -0.30 -0.15 0.00 1.55 0.00 0.00 64.86 66.26 1vgg h ILE 93 Cb 0.46 1.20 -0.02 0.00 -0.27 0.00 0.00 36.82 38.19 1vgg h ILE 93 CO -0.09 0.06 -0.70 0.78 -1.05 0.00 0.00 178.15 177.15 1vgg h ASN 94 N 0.00 0.04 0.00 2.16 -0.26 -1.50 -3.39 115.58 112.64 1vgg h ASN 94 Ca -0.00 -0.03 0.00 0.00 -0.56 0.00 0.00 56.30 55.71 1vgg h ASN 94 Cb 0.20 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.44 1vgg h ASN 94 CO 0.01 0.73 0.00 1.33 -1.06 0.00 0.00 177.43 178.44 1vgg n VAL 95 N -3.72 0.00 -0.08 2.81 0.24 -0.63 -4.76 118.33 112.18 1vgg n VAL 95 Ca -0.01 -0.44 0.13 0.00 -2.04 0.00 0.00 64.34 61.98 1vgg n VAL 95 Cb 0.69 1.02 0.52 0.00 -1.47 0.00 0.00 33.84 34.60 1vgg n VAL 95 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1vgg h LEU 96 N 0.00 0.34 -0.86 1.34 3.38 -0.55 -1.08 115.31 117.87 1vgg h LEU 96 Ca 0.00 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.04 1vgg h LEU 96 Cb 0.01 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 1vgg h LEU 96 CO 0.00 0.20 0.54 1.12 0.09 0.00 0.00 178.44 180.39 1vgg h HIS 97 N 0.37 1.00 -0.09 1.13 2.07 -1.85 0.47 115.15 118.25 1vgg h HIS 97 Ca 0.28 0.03 -0.16 0.00 -2.85 0.00 0.00 60.37 57.67 1vgg h HIS 97 Cb 0.62 -0.32 -0.01 0.00 2.57 0.00 0.00 27.41 30.26 1vgg h HIS 97 CO -0.00 0.52 -0.63 0.00 -3.07 0.00 0.00 177.93 174.74 1vgg h ALA 98 N 1.40 0.74 -0.18 6.11 0.00 -1.55 -2.00 119.26 123.77 1vgg h ALA 98 Ca 0.37 -0.56 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1vgg h ALA 98 Cb 0.14 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1vgg h ALA 98 CO -0.16 0.73 -0.26 0.28 0.00 0.00 0.00 179.25 179.84 1vgg h VAL 99 N 0.26 1.34 -0.68 0.00 2.07 -0.92 -2.44 116.25 115.88 1vgg h VAL 99 Ca -0.01 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.02 1vgg h VAL 99 Cb 1.17 1.88 -0.03 0.00 -1.52 0.00 0.00 31.29 32.78 1vgg h VAL 99 CO 0.11 0.45 0.38 0.11 0.02 0.00 0.00 177.57 178.63 1vgg h LYS 100 N 0.14 0.93 0.00 1.57 1.57 -0.89 -2.70 116.57 117.19 1vgg h LYS 100 Ca 0.02 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1vgg h LYS 100 Cb 0.83 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1vgg h LYS 100 CO 0.06 0.68 0.00 0.00 -0.57 0.00 0.00 179.45 179.62 1vgg h ALA 101 N 1.47 1.00 -2.36 3.86 0.00 -1.31 -3.46 119.26 118.46 1vgg h ALA 101 Ca 0.24 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.60 1vgg h ALA 101 Cb 0.01 0.00 0.03 0.00 0.00 0.00 0.00 17.79 17.84 1vgg h ALA 101 CO -0.04 0.00 1.11 0.00 0.00 0.00 0.00 179.25 180.32 1vgg h PRO 103 N 8.88 0.00 0.00 0.00 0.13 -1.90 -1.13 132.00 137.98 1vgg h PRO 103 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1vgg h PRO 103 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1vgg h PRO 103 CO 0.94 0.00 -0.72 0.93 -0.23 0.00 0.00 178.00 178.92 1vgg h GLU 104 N 0.00 0.00 -6.36 0.86 3.07 -1.89 -3.46 114.58 106.80 1vgg h GLU 104 Ca 0.04 0.00 -0.55 0.00 -0.50 0.00 0.00 59.36 58.36 1vgg h GLU 104 Cb 0.36 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.25 1vgg h GLU 104 CO -0.00 0.00 0.55 0.08 -1.40 0.00 0.00 179.01 178.23 1vgg s VAL 105 N -3.23 4.54 -0.22 3.13 1.01 -0.43 -2.30 120.40 122.90 1vgg s VAL 105 Ca 0.04 1.82 -0.11 0.00 0.00 0.00 0.00 61.98 63.74 1vgg s VAL 105 Cb 0.12 -4.17 -0.18 0.00 0.00 0.00 0.00 36.38 32.15 1vgg s VAL 105 CO 0.74 0.07 -0.03 0.52 0.00 0.00 0.00 175.10 176.40 1vgg n VAL 106 N 4.27 1.58 -3.67 2.92 0.31 -0.20 -4.89 118.33 118.64 1vgg n VAL 106 Ca 0.09 -0.40 -0.07 0.00 -0.01 0.00 0.00 64.34 63.95 1vgg n VAL 106 Cb 0.48 -1.78 -0.02 0.00 -0.91 0.00 0.00 33.84 31.62 1vgg n VAL 106 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1vgg s ARG 107 N -2.49 1.29 -0.13 5.55 1.70 -1.09 -5.01 118.95 118.77 1vgg s ARG 107 Ca -0.32 -0.64 0.02 0.00 -0.47 0.00 0.00 55.73 54.32 1vgg s ARG 107 Cb 0.09 0.49 0.01 0.00 -0.57 0.00 0.00 34.95 34.97 1vgg s ARG 107 CO 0.60 -0.58 -0.20 0.42 -1.08 0.00 0.00 175.30 174.46 1vgg s ILE 108 N -3.50 1.92 -0.02 4.99 1.01 -1.26 -0.39 121.20 123.95 1vgg s ILE 108 Ca 0.09 -0.89 -0.20 0.00 0.00 0.00 0.00 60.65 59.65 1vgg s ILE 108 Cb -0.02 -1.71 -0.32 0.00 0.01 0.00 0.00 42.46 40.42 1vgg s ILE 108 CO -0.01 0.52 0.95 1.88 0.00 0.00 0.00 174.94 178.28 1vgg h TYR 109 N 7.37 0.71 -2.49 3.97 0.05 -0.74 -3.48 116.97 122.36 1vgg h TYR 109 Ca -0.32 -0.51 -0.04 0.00 0.05 0.00 0.00 58.73 57.91 1vgg h TYR 109 Cb 1.18 -0.03 -0.16 0.00 1.01 0.00 0.00 36.73 38.74 1vgg h TYR 109 CO 0.47 1.39 0.20 0.00 -1.05 0.00 0.00 178.16 179.17 1vgg s ALA 110 N -2.55 -1.68 -0.10 3.88 0.00 -0.98 -4.86 121.76 115.48 1vgg s ALA 110 Ca -0.12 0.91 -0.03 0.00 0.00 0.00 0.00 51.96 52.72 1vgg s ALA 110 Cb 0.02 0.43 0.05 0.00 0.00 0.00 0.00 23.12 23.62 1vgg s ALA 110 CO 0.87 -0.56 0.13 0.00 0.00 0.00 0.00 175.76 176.20 1vgg s ALA 111 N -2.42 -0.00 0.04 0.00 0.00 -1.26 -1.20 121.76 116.92 1vgg s ALA 111 Ca -0.05 0.33 -0.28 0.00 0.00 0.00 0.00 51.96 51.96 1vgg s ALA 111 Cb -0.00 -0.84 0.09 0.00 0.00 0.00 0.00 23.12 22.36 1vgg s ALA 111 CO -0.01 -0.68 0.95 -0.08 0.00 0.00 0.00 175.76 175.94 1vgg s THR 112 N 2.25 0.00 -0.69 0.00 -1.32 -0.54 -4.98 115.64 110.35 1vgg s THR 112 Ca 0.04 -0.23 0.06 0.00 -1.21 0.00 0.00 61.69 60.34 1vgg s THR 112 Cb -0.13 -1.38 0.06 0.00 -1.51 0.00 0.00 72.50 69.54 1vgg s THR 112 CO -0.06 0.00 0.73 0.00 -2.21 0.00 0.00 174.62 173.08 1vgg n ALA 113 N -0.32 2.45 -2.10 11.08 0.00 -1.26 -1.24 120.51 129.12 1vgg n ALA 113 Ca -0.07 -0.60 -0.21 0.00 0.00 0.00 0.00 53.44 52.55 1vgg n ALA 113 Cb 0.61 -0.20 0.03 0.00 0.00 0.00 0.00 19.45 19.89 1vgg n ALA 113 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1vgg s ASN 114 N -0.53 5.48 0.28 0.00 0.02 -1.26 -4.87 114.94 114.05 1vgg s ASN 114 Ca 0.07 0.05 -0.30 0.00 -1.02 0.00 0.00 52.86 51.66 1vgg s ASN 114 Cb 0.05 -1.07 -0.11 0.00 0.02 0.00 0.00 41.25 40.14 1vgg s ASN 114 CO 0.07 -0.97 1.60 -2.84 0.02 0.00 0.00 177.10 174.98 1vgg s PRO 115 N -4.66 4.14 -0.01 -0.60 0.02 -1.26 -4.72 135.00 127.90 1vgg s PRO 115 Ca 0.54 2.55 0.04 0.00 0.02 0.00 0.00 61.00 64.15 1vgg s PRO 115 Cb -0.10 -3.04 -0.01 0.00 0.02 0.00 0.00 34.50 31.37 1vgg s PRO 115 CO 0.38 -0.63 -0.14 -1.17 -0.33 0.00 0.00 177.00 175.11 1vgg s LEU 116 N -0.25 1.99 0.04 -5.54 2.96 -1.26 -1.30 118.68 115.32 1vgg s LEU 116 Ca 0.64 -0.25 0.04 0.00 -0.22 0.00 0.00 54.13 54.34 1vgg s LEU 116 Cb -0.47 -0.73 -0.02 0.00 0.50 0.00 0.00 46.19 45.47 1vgg s LEU 116 CO 0.45 0.16 -0.12 -0.54 -1.32 0.00 0.00 176.35 174.98 1vgg s LYS 117 N -0.25 0.79 -0.13 1.98 1.02 -1.26 -1.00 119.74 120.89 1vgg s LYS 117 Ca 0.04 -0.71 0.00 0.00 0.02 0.00 0.00 55.97 55.32 1vgg s LYS 117 Cb -0.06 -0.74 -0.01 0.00 -0.52 0.00 0.00 37.83 36.49 1vgg s LYS 117 CO -0.00 0.18 -0.14 0.08 -0.92 0.00 0.00 175.35 174.54 1vgg s VAL 118 N -0.91 2.87 -0.16 3.17 1.01 0.13 -4.45 120.40 122.06 1vgg s VAL 118 Ca -0.01 -0.72 -0.22 0.00 0.00 0.00 0.00 61.98 61.03 1vgg s VAL 118 Cb -0.08 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 1vgg s VAL 118 CO 0.01 0.52 0.68 -0.69 0.00 0.00 0.00 175.10 175.62 1vgg s VAL 119 N 0.47 5.00 0.12 2.92 1.01 -0.33 -0.50 120.40 129.10 1vgg s VAL 119 Ca -0.10 1.32 0.06 0.00 0.00 0.00 0.00 61.98 63.26 1vgg s VAL 119 Cb -0.16 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 1vgg s VAL 119 CO 0.05 0.13 -0.15 0.68 0.00 0.00 0.00 175.10 175.81 1vgg s VAL 120 N 1.66 1.39 -0.06 2.92 -7.23 -0.12 -0.39 120.40 118.59 1vgg s VAL 120 Ca 0.32 -1.70 0.04 0.00 -1.81 0.00 0.00 61.98 58.83 1vgg s VAL 120 Cb -0.16 -1.54 -0.02 0.00 0.56 0.00 0.00 36.38 35.22 1vgg s VAL 120 CO 0.12 -0.37 -0.16 0.00 -0.31 0.00 0.00 175.10 174.38 1vgg s ALA 121 N -2.01 2.57 -0.04 1.32 0.00 -0.26 -0.74 121.76 122.60 1vgg s ALA 121 Ca 0.09 -0.98 0.04 0.00 0.00 0.00 0.00 51.96 51.10 1vgg s ALA 121 Cb -0.06 -0.94 -0.00 0.00 0.00 0.00 0.00 23.12 22.12 1vgg s ALA 121 CO 0.03 0.50 -0.16 -2.00 0.00 0.00 0.00 175.76 174.13 1vgg s GLU 122 N -0.51 1.66 -0.20 0.00 2.12 0.56 -0.77 118.70 121.56 1vgg s GLU 122 Ca 0.07 -0.58 -0.05 0.00 0.36 0.00 0.00 54.97 54.78 1vgg s GLU 122 Cb -0.12 -1.46 0.10 0.00 0.26 0.00 0.00 34.13 32.91 1vgg s GLU 122 CO 0.01 0.24 0.35 -2.00 -0.54 0.00 0.00 175.26 173.32 1vgg s GLU 123 N 0.02 0.28 7.04 4.30 2.56 -0.77 -1.42 118.70 130.72 1vgg s GLU 123 Ca -0.03 0.70 0.00 0.00 0.00 0.00 0.00 54.97 55.64 1vgg s GLU 123 Cb -0.11 -0.22 0.00 0.00 2.00 0.00 0.00 34.13 35.80 1vgg s GLU 123 CO 0.02 -0.45 0.00 0.41 -0.56 0.00 0.00 175.26 174.67 1vgg n GLY 124 N 5.37 2.77 2.20 -1.50 0.00 -1.26 -2.07 105.19 110.69 1vgg n GLY 124 Ca -0.06 -0.30 -0.24 0.00 0.00 0.00 0.00 46.02 45.42 1vgg n GLY 124 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1vgg n GLU 125 N 13.56 2.24 -4.18 1.61 2.13 -1.26 -4.92 120.64 129.83 1vgg n GLU 125 Ca 0.00 -2.93 -0.17 0.00 0.66 0.00 0.00 57.16 54.72 1vgg n GLU 125 Cb 0.00 -2.15 -0.12 0.00 0.27 0.00 0.00 31.44 29.45 1vgg n GLU 125 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 1vgg s GLN 126 N -3.23 0.84 0.01 5.31 -0.21 -0.88 -5.01 119.66 116.50 1vgg s GLN 126 Ca 0.56 -1.02 -0.01 0.00 0.02 0.00 0.00 55.36 54.91 1vgg s GLN 126 Cb 0.47 -0.77 -0.01 0.00 1.00 0.00 0.00 33.01 33.69 1vgg s GLN 126 CO 0.10 0.16 0.01 1.03 -2.12 0.00 0.00 175.29 174.47 1vgg s ARG 127 N -2.02 0.29 -0.00 2.91 0.52 -1.26 -1.84 118.95 117.56 1vgg s ARG 127 Ca 0.00 -0.47 0.05 0.00 -0.52 0.00 0.00 55.73 54.80 1vgg s ARG 127 Cb -0.08 0.11 -0.01 0.00 0.52 0.00 0.00 34.95 35.48 1vgg s ARG 127 CO 0.02 -0.05 -0.17 0.00 0.02 0.00 0.00 175.30 175.12 1vgg s ALA 128 N -1.20 1.40 -0.18 2.13 0.00 0.05 -4.14 121.76 119.82 1vgg s ALA 128 Ca -0.13 -0.75 -0.25 0.00 0.00 0.00 0.00 51.96 50.82 1vgg s ALA 128 Cb -0.08 -0.34 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 1vgg s ALA 128 CO -0.00 0.34 0.83 0.42 0.00 0.00 0.00 175.76 177.34 1vgg s ILE 129 N -0.46 4.87 -0.14 0.00 1.01 -1.26 -1.10 121.20 124.13 1vgg s ILE 129 Ca 0.06 1.62 0.18 0.00 0.00 0.00 0.00 60.65 62.51 1vgg s ILE 129 Cb -0.07 -4.13 -0.24 0.00 0.01 0.00 0.00 42.46 38.03 1vgg s ILE 129 CO -0.00 0.01 0.37 0.18 0.00 0.00 0.00 174.94 175.49 1vgg n LEU 130 N 5.39 0.29 0.00 2.97 4.77 0.48 -4.97 117.00 125.93 1vgg n LEU 130 Ca 0.05 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1vgg n LEU 130 Cb 0.48 0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.86 1vgg n LEU 130 CO 0.48 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 1vgg n GLY 131 N 1.57 -0.21 0.00 -0.72 0.00 -1.18 -4.99 105.19 99.66 1vgg n GLY 131 Ca -0.21 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1vgg n GLY 131 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1vgg n VAL 132 N -0.19 0.00 0.00 1.61 0.24 -1.26 -1.18 118.33 117.55 1vgg n VAL 132 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1vgg n VAL 132 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1vgg n VAL 132 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1vgg n ASP 134 N 0.00 0.00 -0.03 -1.34 4.64 -1.26 -4.96 116.55 113.59 1vgg n ASP 134 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 1vgg n ASP 134 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 1vgg n ASP 134 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1vgg n GLY 135 N 0.00 -0.67 3.68 0.27 0.00 -0.42 -4.95 105.19 103.10 1vgg n GLY 135 Ca 0.00 -1.14 -0.25 0.00 0.00 0.00 0.00 46.02 44.63 1vgg n GLY 135 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vgg s PHE 136 N 0.00 2.58 0.72 1.61 0.08 -1.26 -4.99 117.98 116.71 1vgg s PHE 136 Ca 0.00 -0.54 -0.14 0.00 0.12 0.00 0.00 56.93 56.37 1vgg s PHE 136 Cb 0.00 -1.75 0.03 0.00 -0.57 0.00 0.00 43.02 40.73 1vgg s PHE 136 CO 0.00 0.34 1.13 0.95 -0.10 0.00 0.00 175.22 177.54 1vgg s THR 137 N -2.58 2.93 0.43 0.64 -4.23 -1.26 -4.98 115.64 106.59 1vgg s THR 137 Ca 0.38 0.40 -0.24 0.00 -1.18 0.00 0.00 61.69 61.05 1vgg s THR 137 Cb 0.03 -2.89 -0.08 0.00 1.34 0.00 0.00 72.50 70.90 1vgg s THR 137 CO 0.21 -0.29 1.12 -2.16 -0.54 0.00 0.00 174.62 172.95 1vgg s PRO 138 N -4.23 3.96 0.00 3.99 0.04 -1.26 -4.94 135.00 132.56 1vgg s PRO 138 Ca 0.68 1.69 0.22 0.00 0.04 0.00 0.00 61.00 63.62 1vgg s PRO 138 Cb -0.22 -2.50 -0.08 0.00 0.04 0.00 0.00 34.50 31.74 1vgg s PRO 138 CO 0.46 -0.36 1.03 1.28 0.04 0.00 0.00 177.00 179.45 1vgg n LEU 139 N -0.24 1.65 0.00 -3.56 4.77 -1.26 -5.06 117.00 113.31 1vgg n LEU 139 Ca 0.06 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 1vgg n LEU 139 Cb 0.48 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1vgg n LEU 139 CO 0.47 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 1vgg n GLY 140 N 1.45 -0.58 3.20 -0.72 0.00 -1.26 -5.15 105.19 102.14 1vgg n GLY 140 Ca 0.07 -0.95 -0.24 0.00 0.00 0.00 0.00 46.02 44.90 1vgg n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vgg s VAL 141 N -3.00 1.48 0.42 1.61 1.01 -1.26 -5.12 120.40 115.53 1vgg s VAL 141 Ca 0.00 -1.02 -0.26 0.00 0.00 0.00 0.00 61.98 60.70 1vgg s VAL 141 Cb 0.00 -1.27 -0.09 0.00 0.00 0.00 0.00 36.38 35.02 1vgg s VAL 141 CO 0.00 0.23 1.36 -1.83 0.00 0.00 0.00 175.10 174.86 1vgg s GLU 142 N -0.93 3.86 0.36 2.72 -1.05 -1.26 -5.04 118.70 117.37 1vgg s GLU 142 Ca 0.06 2.29 0.05 0.00 -0.15 0.00 0.00 54.97 57.22 1vgg s GLU 142 Cb -0.08 -2.73 0.05 0.00 -0.44 0.00 0.00 34.13 30.93 1vgg s GLU 142 CO 0.01 -0.63 0.43 -0.40 0.95 0.00 0.00 175.26 175.63 1vgg n ASP 143 N 0.02 1.55 -0.06 0.83 3.85 -1.26 -4.90 116.55 116.59 1vgg n ASP 143 Ca 0.04 -2.03 0.06 0.00 -0.71 0.00 0.00 54.79 52.14 1vgg n ASP 143 Cb 0.43 -0.20 0.41 0.00 -1.35 0.00 0.00 41.12 40.41 1vgg n ASP 143 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1vgg h GLU 144 N 0.00 0.58 -0.58 0.11 4.39 -1.99 -1.32 114.58 115.76 1vgg h GLU 144 Ca -0.18 -0.03 -0.10 0.00 0.34 0.00 0.00 59.36 59.38 1vgg h GLU 144 Cb 0.79 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.29 1vgg h GLU 144 CO 0.27 0.38 -0.03 0.00 -1.16 0.00 0.00 179.01 178.48 1vgg h ALA 145 N 1.70 0.78 -0.08 3.43 0.00 -1.99 -1.92 119.26 121.18 1vgg h ALA 145 Ca 0.21 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 1vgg h ALA 145 Cb 0.09 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1vgg h ALA 145 CO -0.05 0.64 -0.51 0.93 0.00 0.00 0.00 179.25 180.26 1vgg h GLU 146 N 0.93 0.22 -0.26 0.00 4.39 -1.77 -0.59 114.58 117.50 1vgg h GLU 146 Ca 0.16 -0.12 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 1vgg h GLU 146 Cb 0.59 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.24 1vgg h GLU 146 CO 0.04 0.68 0.08 0.28 -1.16 0.00 0.00 179.01 178.92 1vgg h VAL 147 N 0.17 1.19 -0.81 3.13 2.07 -1.07 -0.90 116.25 120.04 1vgg h VAL 147 Ca 0.01 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 1vgg h VAL 147 Cb 0.96 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 31.80 1vgg h VAL 147 CO 0.08 0.20 0.50 0.00 0.02 0.00 0.00 177.57 178.37 1vgg h ALA 148 N 0.91 1.35 -0.28 1.67 0.00 -1.07 -1.88 119.26 119.96 1vgg h ALA 148 Ca 0.08 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1vgg h ALA 148 Cb 0.23 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1vgg h ALA 148 CO -0.00 0.57 0.09 2.35 0.00 0.00 0.00 179.25 182.26 1vgg h TRP 149 N 1.12 0.45 0.00 0.00 7.01 -0.61 -1.13 115.95 122.78 1vgg h TRP 149 Ca 0.29 -0.04 -0.06 0.00 2.11 0.00 0.00 58.89 61.19 1vgg h TRP 149 Cb -0.06 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 26.86 1vgg h TRP 149 CO 0.00 0.48 -0.27 0.07 -2.79 0.00 0.00 178.44 175.93 1vgg h ARG 150 N 0.29 0.00 -0.08 2.65 0.11 -0.87 -0.42 114.38 116.05 1vgg h ARG 150 Ca 0.09 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 60.03 1vgg h ARG 150 Cb 0.24 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.32 1vgg h ARG 150 CO -0.00 0.27 -0.51 0.87 0.10 0.00 0.00 179.97 180.70 1vgg h LYS 151 N 0.00 0.49 -0.71 0.08 1.57 -1.18 -3.07 116.57 113.76 1vgg h LYS 151 Ca -0.00 -0.42 -0.02 0.00 -1.87 0.00 0.00 60.65 58.34 1vgg h LYS 151 Cb 0.71 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.08 1vgg h LYS 151 CO 0.04 1.05 0.35 0.22 -0.57 0.00 0.00 179.45 180.54 1vgg h ASP 152 N 0.06 0.92 -0.34 0.86 3.58 -0.91 -2.95 116.42 117.64 1vgg h ASP 152 Ca -0.04 -0.12 0.05 0.00 0.42 0.00 0.00 57.03 57.34 1vgg h ASP 152 Cb 1.17 -0.24 -0.05 0.00 1.72 0.00 0.00 39.33 41.94 1vgg h ASP 152 CO 0.11 0.78 0.04 0.25 -2.88 0.00 0.00 179.24 177.54 1vgg h LEU 153 N 0.99 -0.05 -1.61 2.28 5.85 -1.10 -0.82 115.31 120.85 1vgg h LEU 153 Ca 0.25 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.99 1vgg h LEU 153 Cb 0.10 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1vgg h LEU 153 CO -0.03 0.01 -0.20 -0.07 -0.34 0.00 0.00 178.44 177.81 1vgg h LEU 154 N 0.15 0.00 -0.09 2.25 3.38 -1.42 -0.48 115.31 119.10 1vgg h LEU 154 Ca 0.16 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.88 1vgg h LEU 154 Cb 0.20 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.96 1vgg h LEU 154 CO -0.23 0.20 -1.00 0.03 0.09 0.00 0.00 178.44 177.53 1vgg h ARG 155 N 0.00 0.52 -0.28 1.13 -0.00 -1.27 -0.05 114.38 114.43 1vgg h ARG 155 Ca -0.00 -0.57 -0.08 0.00 -0.50 0.00 0.00 59.98 58.82 1vgg h ARG 155 Cb 0.37 0.17 -0.01 0.00 0.00 0.00 0.00 29.97 30.49 1vgg h ARG 155 CO 0.03 1.20 -0.18 0.00 0.00 0.00 0.00 179.97 181.02 1vgg h ARG 156 N 0.29 0.50 0.00 0.04 3.08 -0.69 -2.46 114.38 115.14 1vgg h ARG 156 Ca -0.10 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 59.78 1vgg h ARG 156 Cb 1.65 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.66 1vgg h ARG 156 CO 0.18 0.66 0.00 -0.07 -1.07 0.00 0.00 179.97 179.68 1vgg h LEU 157 N 0.45 0.00 0.00 3.04 3.38 -1.07 -3.47 115.31 117.64 1vgg h LEU 157 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1vgg h LEU 157 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1vgg h LEU 157 CO 0.04 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.18 1vgg n GLY 158 N 1.03 0.64 0.13 0.83 0.00 -0.86 -4.94 105.19 102.02 1vgg n GLY 158 Ca 0.05 -0.19 0.12 0.00 0.00 0.00 0.00 46.02 45.99 1vgg n GLY 158 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1vgg h TYR 159 N 0.00 0.00 -3.96 1.61 -1.99 -1.28 -3.46 116.97 107.89 1vgg h TYR 159 Ca 0.00 0.00 -0.31 0.00 2.00 0.00 0.00 58.73 60.42 1vgg h TYR 159 Cb 0.00 0.00 -0.21 0.00 2.00 0.00 0.00 36.73 38.52 1vgg h TYR 159 CO 0.00 0.00 -0.75 0.15 -0.00 0.00 0.00 178.16 177.56 1vgg s LYS 160 N -3.32 0.61 0.00 4.88 -0.14 -0.96 -5.00 119.74 115.81 1vgg s LYS 160 Ca 0.01 -0.80 0.21 0.00 -1.36 0.00 0.00 55.97 54.04 1vgg s LYS 160 Cb 0.09 -0.44 0.16 0.00 -1.68 0.00 0.00 37.83 35.96 1vgg s LYS 160 CO 0.76 0.09 1.16 1.28 -0.76 0.00 0.00 175.35 177.88