#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 4.36 0.11 4.31 1.43 -1.26 -0.41 118.68 127.22 1vgg s LEU 3 Ca 0.00 0.45 0.03 0.00 -1.03 0.00 0.00 54.13 53.58 1vgg s LEU 3 Cb 0.00 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1vgg s LEU 3 CO 0.00 0.39 -0.09 -0.54 0.23 0.00 0.00 176.35 176.34 1vgg s LYS 4 N -0.93 0.90 -0.22 1.70 1.02 0.26 -4.98 119.74 117.48 1vgg s LYS 4 Ca 0.14 -1.28 0.02 0.00 0.02 0.00 0.00 55.97 54.87 1vgg s LYS 4 Cb -0.12 -0.47 0.04 0.00 -0.52 0.00 0.00 37.83 36.76 1vgg s LYS 4 CO 0.04 0.05 -0.15 -1.17 -0.92 0.00 0.00 175.35 173.20 1vgg s LEU 5 N -2.80 2.79 -0.28 3.17 2.96 -1.26 -0.74 118.68 122.53 1vgg s LEU 5 Ca 0.10 -0.99 -0.06 0.00 -0.22 0.00 0.00 54.13 52.96 1vgg s LEU 5 Cb 0.01 -1.53 0.01 0.00 0.50 0.00 0.00 46.19 45.18 1vgg s LEU 5 CO -0.01 -0.09 0.06 -0.63 -1.32 0.00 0.00 176.35 174.36 1vgg s ILE 6 N 1.21 3.85 0.43 6.68 -1.09 0.70 -4.90 121.20 128.09 1vgg s ILE 6 Ca -0.01 -0.68 -0.21 0.00 -2.23 0.00 0.00 60.65 57.52 1vgg s ILE 6 Cb -0.16 -2.96 -0.10 0.00 -1.58 0.00 0.00 42.46 37.66 1vgg s ILE 6 CO -0.09 0.13 0.98 -2.84 -1.23 0.00 0.00 174.94 171.89 1vgg s PRO 7 N 1.49 4.13 -0.20 2.79 0.02 -1.26 0.22 135.00 142.19 1vgg s PRO 7 Ca 0.03 1.23 -0.09 0.00 0.02 0.00 0.00 61.00 62.19 1vgg s PRO 7 Cb -0.17 -2.23 -0.05 0.00 0.02 0.00 0.00 34.50 32.07 1vgg s PRO 7 CO 0.02 -0.13 0.11 0.42 -0.33 0.00 0.00 177.00 177.09 1vgg s ILE 8 N -2.04 5.20 -0.15 2.83 -1.09 -0.42 -4.92 121.20 120.61 1vgg s ILE 8 Ca 0.62 0.11 -0.12 0.00 -2.23 0.00 0.00 60.65 59.03 1vgg s ILE 8 Cb -0.13 -3.37 -0.05 0.00 -1.58 0.00 0.00 42.46 37.34 1vgg s ILE 8 CO 0.17 0.44 0.25 -0.70 -1.23 0.00 0.00 174.94 173.87 1vgg s GLU 9 N 0.45 4.10 -0.30 2.79 2.12 -1.26 -4.66 118.70 121.94 1vgg s GLU 9 Ca 0.06 0.04 -0.38 0.00 0.36 0.00 0.00 54.97 55.06 1vgg s GLU 9 Cb -0.12 -3.37 0.16 0.00 0.26 0.00 0.00 34.13 31.07 1vgg s GLU 9 CO -0.01 0.37 1.39 -1.59 -0.54 0.00 0.00 175.26 174.89 1vgg s LYS 10 N 0.08 0.01 0.64 4.30 0.00 -1.26 -4.94 119.74 118.58 1vgg s LYS 10 Ca 0.15 -0.00 -0.18 0.00 0.00 0.00 0.00 55.97 55.94 1vgg s LYS 10 Cb -0.13 0.01 -0.01 0.00 0.00 0.00 0.00 37.83 37.69 1vgg s LYS 10 CO 0.04 -0.01 1.30 -2.14 0.00 0.00 0.00 175.35 174.55 1vgg s PRO 11 N -1.88 2.58 0.38 1.78 0.02 -1.26 -4.89 135.00 131.73 1vgg s PRO 11 Ca 0.12 2.09 0.09 0.00 0.02 0.00 0.00 61.00 63.31 1vgg s PRO 11 Cb -0.01 -1.87 0.83 0.00 0.02 0.00 0.00 34.50 33.47 1vgg s PRO 11 CO -0.03 -1.58 1.93 0.93 -0.33 0.00 0.00 177.00 177.92 1vgg h GLU 12 N 0.60 0.64 -0.06 5.54 3.07 -2.01 -2.73 114.58 119.63 1vgg h GLU 12 Ca -0.51 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.31 1vgg h GLU 12 Cb 1.34 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 29.10 1vgg h GLU 12 CO 0.53 0.42 0.00 0.27 -1.40 0.00 0.00 179.01 178.83 1vgg n ASN 13 N -4.50 0.71 -4.89 1.42 6.94 -1.26 -4.80 115.26 108.88 1vgg n ASN 13 Ca 0.13 -1.51 -0.35 0.00 -0.02 0.00 0.00 54.58 52.82 1vgg n ASN 13 Cb 0.34 -0.04 -0.05 0.00 -2.36 0.00 0.00 39.78 37.67 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 -1.62 4.38 0.06 -4.53 1.43 -1.03 -4.80 118.68 112.57 1vgg s LEU 14 Ca 0.31 0.43 -0.06 0.00 -1.03 0.00 0.00 54.13 53.78 1vgg s LEU 14 Cb 0.15 -2.38 -0.05 0.00 0.03 0.00 0.00 46.19 43.95 1vgg s LEU 14 CO 0.25 0.33 0.31 0.20 0.23 0.00 0.00 176.35 177.66 1vgg s ASN 15 N -1.50 6.49 0.08 2.29 0.01 -1.25 -4.42 114.94 116.64 1vgg s ASN 15 Ca 0.22 0.56 0.05 0.00 -0.71 0.00 0.00 52.86 52.97 1vgg s ASN 15 Cb -0.12 -2.08 -0.03 0.00 0.41 0.00 0.00 41.25 39.42 1vgg s ASN 15 CO 0.12 0.18 -0.13 0.68 -1.51 0.00 0.00 177.10 176.43 1vgg s VAL 16 N -1.44 1.09 -0.15 1.60 -7.23 -0.17 -0.93 120.40 113.18 1vgg s VAL 16 Ca 0.33 -1.43 -0.00 0.00 -1.81 0.00 0.00 61.98 59.07 1vgg s VAL 16 Cb -0.13 -1.18 0.03 0.00 0.56 0.00 0.00 36.38 35.66 1vgg s VAL 16 CO 0.20 -0.33 -0.07 -0.63 -0.31 0.00 0.00 175.10 173.96 1vgg s ILE 17 N -1.65 1.19 -0.16 -0.62 1.01 0.08 -1.47 121.20 119.57 1vgg s ILE 17 Ca 0.01 -0.57 -0.03 0.00 0.00 0.00 0.00 60.65 60.06 1vgg s ILE 17 Cb -0.08 -1.28 -0.02 0.00 0.01 0.00 0.00 42.46 41.09 1vgg s ILE 17 CO 0.02 0.24 -0.07 -0.22 0.00 0.00 0.00 174.94 174.91 1vgg s LEU 18 N 1.62 3.02 0.00 2.97 2.96 -0.18 -0.49 118.68 128.58 1vgg s LEU 18 Ca 0.02 -0.24 -0.01 0.00 -0.22 0.00 0.00 54.13 53.68 1vgg s LEU 18 Cb -0.14 -1.72 0.00 0.00 0.50 0.00 0.00 46.19 44.83 1vgg s LEU 18 CO -0.08 0.13 0.11 0.61 -1.32 0.00 0.00 176.35 175.80 1vgg n GLY 19 N 3.79 2.74 3.17 7.98 0.00 -0.32 0.46 105.19 123.01 1vgg n GLY 19 Ca -0.18 -1.36 -0.29 0.00 0.00 0.00 0.00 46.02 44.19 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 -2.14 2.38 0.00 1.61 2.00 0.04 -0.72 119.66 122.84 1vgg s GLN 20 Ca 0.05 -0.72 0.00 0.00 -2.00 0.00 0.00 55.36 52.69 1vgg s GLN 20 Cb -0.00 -1.91 0.00 0.00 0.80 0.00 0.00 33.01 31.89 1vgg s GLN 20 CO 0.04 0.20 0.00 0.00 -0.50 0.00 0.00 175.29 175.03 1vgg n ALA 21 N 3.39 0.00 -3.56 1.58 0.00 0.25 -0.66 120.51 121.50 1vgg n ALA 21 Ca -0.19 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.18 1vgg n ALA 21 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.95 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 -0.14 -0.25 0.18 0.00 -3.43 -0.98 -4.79 115.29 105.89 1vgg s HIS 22 Ca 0.00 0.23 0.00 0.00 -0.80 0.00 0.00 55.06 54.49 1vgg s HIS 22 Cb 0.00 0.51 0.00 0.00 -1.43 0.00 0.00 32.58 31.66 1vgg s HIS 22 CO 0.00 -0.34 0.00 0.34 -2.00 0.00 0.00 174.74 172.74 1vgg n PHE 23 N 0.04 -1.84 0.33 0.38 -0.00 -1.26 -4.46 117.46 110.65 1vgg n PHE 23 Ca -0.05 0.97 0.21 0.00 -0.00 0.00 0.00 57.45 58.58 1vgg n PHE 23 Cb 0.59 -2.21 1.15 0.00 -0.00 0.00 0.00 39.48 39.01 1vgg n PHE 23 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.76 177.73 1vgg h ILE 24 N 0.95 0.11 0.00 -2.13 2.10 -2.01 -1.74 117.51 114.78 1vgg h ILE 24 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1vgg h ILE 24 Cb 0.00 0.98 0.00 0.00 -1.09 0.00 0.00 36.82 36.71 1vgg h ILE 24 CO 0.00 0.00 0.00 1.17 -1.08 0.00 0.00 178.15 178.24 1vgg n LYS 25 N -3.23 0.00 -0.28 2.19 4.81 -1.26 -2.63 118.16 117.77 1vgg n LYS 25 Ca -0.03 0.38 0.05 0.00 -0.87 0.00 0.00 58.31 57.84 1vgg n LYS 25 Cb 0.09 -1.50 0.19 0.00 0.02 0.00 0.00 35.03 33.83 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 0.76 0.96 3.15 2.02 -1.53 -1.66 112.91 116.62 1vgg h THR 26 Ca 0.00 -0.21 -0.05 0.00 0.77 0.00 0.00 66.41 66.92 1vgg h THR 26 Cb 0.11 0.10 0.01 0.00 -1.74 0.00 0.00 68.15 66.63 1vgg h THR 26 CO 0.00 0.11 -0.46 0.58 0.37 0.00 0.00 175.52 176.12 1vgg h VAL 27 N 0.61 0.03 -0.74 3.16 2.07 -1.77 -1.05 116.25 118.56 1vgg h VAL 27 Ca 0.42 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.88 1vgg h VAL 27 Cb 0.55 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 1vgg h VAL 27 CO -0.33 0.00 0.33 -0.33 0.02 0.00 0.00 177.57 177.25 1vgg h GLU 28 N -1.32 1.09 -0.53 1.57 5.08 -1.77 -1.46 114.58 117.23 1vgg h GLU 28 Ca -0.13 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.04 1vgg h GLU 28 Cb 0.99 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 30.03 1vgg h GLU 28 CO 0.22 0.87 0.29 -0.44 -1.00 0.00 0.00 179.01 178.95 1vgg h ASP 29 N 1.06 0.67 -0.36 1.42 5.19 -1.30 -0.50 116.42 122.60 1vgg h ASP 29 Ca 0.25 -0.09 -0.16 0.00 -0.62 0.00 0.00 57.03 56.41 1vgg h ASP 29 Cb 0.17 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 39.50 1vgg h ASP 29 CO -0.03 0.57 -0.39 -0.07 -3.12 0.00 0.00 179.24 176.20 1vgg h LEU 30 N 0.71 0.96 -0.34 1.55 3.38 -1.06 -0.28 115.31 120.24 1vgg h LEU 30 Ca 0.19 -0.48 0.02 0.00 0.09 0.00 0.00 57.88 57.70 1vgg h LEU 30 Cb 0.05 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1vgg h LEU 30 CO -0.03 1.24 0.18 -0.74 0.09 0.00 0.00 178.44 179.18 1vgg h HIS 31 N 0.70 0.34 -0.67 1.13 2.76 -1.10 -1.09 115.15 117.21 1vgg h HIS 31 Ca 0.05 0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 58.17 1vgg h HIS 31 Cb 0.99 -0.10 -0.03 0.00 1.55 0.00 0.00 27.41 29.81 1vgg h HIS 31 CO 0.07 0.19 0.17 0.93 -1.30 0.00 0.00 177.93 177.99 1vgg h GLU 32 N 0.37 1.05 -0.78 5.26 5.08 -0.99 -2.25 114.58 122.33 1vgg h GLU 32 Ca 0.14 -0.24 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 1vgg h GLU 32 Cb 0.03 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.10 1vgg h GLU 32 CO -0.08 0.92 0.37 0.00 -1.00 0.00 0.00 179.01 179.23 1vgg h ALA 33 N 1.18 1.19 -0.15 3.43 0.00 -0.60 -1.31 119.26 122.99 1vgg h ALA 33 Ca 0.21 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1vgg h ALA 33 Cb 0.34 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1vgg h ALA 33 CO -0.00 0.62 -0.17 -0.07 0.00 0.00 0.00 179.25 179.63 1vgg h LEU 34 N 1.11 0.41 -1.03 0.00 3.38 -0.86 -2.15 115.31 116.16 1vgg h LEU 34 Ca 0.27 -0.49 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1vgg h LEU 34 Cb 0.11 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1vgg h LEU 34 CO -0.03 0.82 -0.08 -0.37 0.09 0.00 0.00 178.44 178.86 1vgg h VAL 35 N 0.01 0.19 0.04 1.22 -1.51 -1.34 -2.46 116.25 112.41 1vgg h VAL 35 Ca 0.02 -0.84 -0.23 0.00 -1.23 0.00 0.00 66.70 64.42 1vgg h VAL 35 Cb 0.71 1.71 -0.02 0.00 -2.13 0.00 0.00 31.29 31.56 1vgg h VAL 35 CO 0.04 0.08 -1.05 0.74 -1.23 0.00 0.00 177.57 176.15 1vgg h THR 36 N 0.00 1.62 -0.12 7.19 2.02 -1.22 -3.35 112.91 119.05 1vgg h THR 36 Ca -0.00 -3.20 -0.20 0.00 0.77 0.00 0.00 66.41 63.78 1vgg h THR 36 Cb 0.71 2.82 0.01 0.00 -1.74 0.00 0.00 68.15 69.95 1vgg h THR 36 CO 0.01 0.92 -0.70 0.00 0.37 0.00 0.00 175.52 176.12 1vgg h ALA 37 N 0.88 0.25 -3.39 6.16 0.00 -1.00 -3.45 119.26 118.71 1vgg h ALA 37 Ca -0.05 -0.58 -0.42 0.00 0.00 0.00 0.00 54.91 53.87 1vgg h ALA 37 Cb 1.79 -0.00 -0.35 0.00 0.00 0.00 0.00 17.79 19.22 1vgg h ALA 37 CO 0.15 0.57 -0.77 0.08 0.00 0.00 0.00 179.25 179.29 1vgg s VAL 38 N -3.67 0.46 0.10 0.00 1.01 -0.96 -5.02 120.40 112.30 1vgg s VAL 38 Ca -0.11 -0.02 -0.31 0.00 0.00 0.00 0.00 61.98 61.54 1vgg s VAL 38 Cb 0.07 -0.54 -0.07 0.00 0.00 0.00 0.00 36.38 35.84 1vgg s VAL 38 CO 0.88 0.23 1.35 -2.16 0.00 0.00 0.00 175.10 175.41 1vgg s PRO 39 N 1.31 4.34 -0.42 2.72 0.04 -1.26 -2.74 135.00 138.98 1vgg s PRO 39 Ca -0.05 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.00 1vgg s PRO 39 Cb -0.13 -3.29 0.00 0.00 0.04 0.00 0.00 34.50 31.11 1vgg s PRO 39 CO -0.02 -0.41 0.00 0.41 0.04 0.00 0.00 177.00 177.01 1vgg n GLY 40 N 3.45 0.66 3.74 0.56 0.00 -1.26 -4.99 105.19 107.36 1vgg n GLY 40 Ca 0.11 -0.39 -0.39 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.73 3.44 -5.08 -0.61 3.06 -1.11 -5.00 119.36 111.34 1vgg n ILE 41 Ca -0.04 -0.50 -0.32 0.00 -2.50 0.00 0.00 62.75 59.39 1vgg n ILE 41 Cb 0.21 -1.67 -0.17 0.00 0.54 0.00 0.00 39.64 38.56 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 -2.70 3.09 0.24 9.51 1.81 -1.26 -4.91 118.95 124.72 1vgg s ARG 42 Ca 0.68 -0.85 -0.22 0.00 -1.72 0.00 0.00 55.73 53.62 1vgg s ARG 42 Cb -0.44 -2.36 0.04 0.00 -0.45 0.00 0.00 34.95 31.74 1vgg s ARG 42 CO 0.52 0.16 0.84 -0.59 -0.68 0.00 0.00 175.30 175.54 1vgg s PHE 43 N 0.41 -0.12 -0.02 -0.53 -0.71 -1.26 -0.24 117.98 115.51 1vgg s PHE 43 Ca -0.16 -0.29 0.03 0.00 -1.04 0.00 0.00 56.93 55.46 1vgg s PHE 43 Cb -0.17 0.69 -0.00 0.00 -1.21 0.00 0.00 43.02 42.33 1vgg s PHE 43 CO 0.07 -1.10 -0.10 0.20 -1.34 0.00 0.00 175.22 172.95 1vgg s GLY 44 N -2.97 0.54 -0.01 1.99 0.00 -0.02 -1.22 107.32 105.63 1vgg s GLY 44 Ca 0.12 -0.40 0.03 0.00 0.00 0.00 0.00 44.72 44.47 1vgg s GLY 44 CO 0.06 -0.22 -0.09 -2.27 0.00 0.00 0.00 173.10 170.58 1vgg s LEU 45 N 0.00 1.92 0.01 0.66 2.96 0.37 -0.40 118.68 124.19 1vgg s LEU 45 Ca -0.00 -0.17 0.01 0.00 -0.22 0.00 0.00 54.13 53.75 1vgg s LEU 45 Cb -0.07 -0.50 -0.01 0.00 0.50 0.00 0.00 46.19 46.11 1vgg s LEU 45 CO 0.00 0.09 -0.05 0.00 -1.32 0.00 0.00 176.35 175.08 1vgg s ALA 46 N -0.05 0.35 -0.04 5.97 0.00 -0.33 -1.48 121.76 126.18 1vgg s ALA 46 Ca 0.01 -0.32 0.01 0.00 0.00 0.00 0.00 51.96 51.67 1vgg s ALA 46 Cb -0.05 -0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.04 1vgg s ALA 46 CO -0.00 0.04 -0.06 0.12 0.00 0.00 0.00 175.76 175.86 1vgg s PHE 47 N -0.45 0.78 -0.64 0.00 2.19 0.75 -0.84 117.98 119.77 1vgg s PHE 47 Ca -0.02 -0.21 -0.19 0.00 0.33 0.00 0.00 56.93 56.84 1vgg s PHE 47 Cb -0.04 -0.64 0.10 0.00 -1.31 0.00 0.00 43.02 41.14 1vgg s PHE 47 CO -0.00 -0.15 0.78 0.45 1.83 0.00 0.00 175.22 178.13 1vgg s SER 48 N 0.64 6.23 0.21 6.13 0.15 0.01 -0.10 113.70 126.97 1vgg s SER 48 Ca -0.09 -1.45 -0.32 0.00 0.70 0.00 0.00 55.95 54.79 1vgg s SER 48 Cb -0.12 -2.33 -0.12 0.00 -1.71 0.00 0.00 66.02 61.74 1vgg s SER 48 CO 0.00 -1.15 1.70 1.21 1.20 0.00 0.00 173.24 176.21 1vgg n GLU 49 N 6.51 2.72 -0.20 5.44 2.13 -1.09 -0.49 120.64 135.65 1vgg n GLU 49 Ca -0.05 0.98 0.08 0.00 0.66 0.00 0.00 57.16 58.82 1vgg n GLU 49 Cb 0.44 -2.81 0.19 0.00 0.27 0.00 0.00 31.44 29.52 1vgg n GLU 49 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1vgg n ALA 50 N 3.79 2.28 -2.78 4.31 0.00 -1.26 -4.02 120.51 122.83 1vgg n ALA 50 Ca 0.16 -1.10 -0.16 0.00 0.00 0.00 0.00 53.44 52.34 1vgg n ALA 50 Cb 0.34 -0.59 -0.05 0.00 0.00 0.00 0.00 19.45 19.16 1vgg n ALA 50 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1vgg s SER 51 N -1.05 1.10 1.93 0.00 1.04 -1.26 -4.93 113.70 110.54 1vgg s SER 51 Ca 0.30 -1.55 0.00 0.00 0.48 0.00 0.00 55.95 55.17 1vgg s SER 51 Cb 0.16 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.93 1vgg s SER 51 CO 0.21 -1.27 0.00 0.61 0.98 0.00 0.00 173.24 173.77 1vgg n GLY 52 N -0.59 3.56 0.07 7.32 0.00 -1.26 -1.16 105.19 113.14 1vgg n GLY 52 Ca 0.02 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 46.05 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 13.87 0.11 -3.80 1.61 4.76 -1.26 -4.91 118.16 128.54 1vgg n LYS 53 Ca 0.00 0.31 -0.25 0.00 -2.87 0.00 0.00 58.31 55.50 1vgg n LYS 53 Cb 0.00 -1.70 0.02 0.00 -1.84 0.00 0.00 35.03 31.52 1vgg n LYS 53 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1vgg n ARG 54 N -1.90 -4.93 -3.91 1.97 1.74 -0.31 -4.96 116.66 104.35 1vgg n ARG 54 Ca 0.03 0.59 -0.37 0.00 -0.77 0.00 0.00 57.85 57.33 1vgg n ARG 54 Cb 0.23 -5.21 -0.06 0.00 -1.02 0.00 0.00 32.46 26.40 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 -6.91 4.34 0.11 0.55 1.43 -1.26 -4.80 118.68 112.14 1vgg s LEU 55 Ca 0.23 0.44 -0.31 0.00 -1.03 0.00 0.00 54.13 53.46 1vgg s LEU 55 Cb -0.11 -2.09 -0.07 0.00 0.03 0.00 0.00 46.19 43.94 1vgg s LEU 55 CO 0.83 0.40 1.34 -0.69 0.23 0.00 0.00 176.35 178.46 1vgg s VAL 56 N -1.04 3.45 -0.03 -1.59 1.01 -1.26 -2.68 120.40 118.26 1vgg s VAL 56 Ca 0.16 1.05 -0.01 0.00 0.00 0.00 0.00 61.98 63.18 1vgg s VAL 56 Cb -0.12 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 1vgg s VAL 56 CO 0.05 0.09 0.05 -0.13 0.00 0.00 0.00 175.10 175.15 1vgg s ARG 57 N 1.03 2.99 0.05 2.72 1.81 0.86 -4.93 118.95 123.46 1vgg s ARG 57 Ca 0.63 -0.48 -0.03 0.00 -1.72 0.00 0.00 55.73 54.13 1vgg s ARG 57 Cb -0.35 -2.81 -0.02 0.00 -0.45 0.00 0.00 34.95 31.31 1vgg s ARG 57 CO 0.30 0.66 0.03 -0.98 -0.68 0.00 0.00 175.30 174.64 1vgg s ARG 58 N -1.46 0.58 0.05 3.54 3.03 -1.26 -0.18 118.95 123.25 1vgg s ARG 58 Ca 0.19 -0.96 -0.27 0.00 2.03 0.00 0.00 55.73 56.72 1vgg s ARG 58 Cb -0.12 0.22 0.07 0.00 -1.03 0.00 0.00 34.95 34.09 1vgg s ARG 58 CO 0.10 -0.13 0.64 0.45 -1.13 0.00 0.00 175.30 175.23 1vgg s SER 59 N -2.45 -0.62 0.00 -2.89 0.15 -0.55 -5.01 113.70 102.33 1vgg s SER 59 Ca -0.00 0.38 0.00 0.00 0.70 0.00 0.00 55.95 57.03 1vgg s SER 59 Cb 0.02 0.57 0.00 0.00 -1.71 0.00 0.00 66.02 64.90 1vgg s SER 59 CO -0.07 -0.78 0.00 0.61 1.20 0.00 0.00 173.24 174.20 1vgg n GLY 60 N 0.31 -1.76 0.09 9.45 0.00 -1.26 -0.48 105.19 111.54 1vgg n GLY 60 Ca -0.18 -1.11 -0.08 0.00 0.00 0.00 0.00 46.02 44.64 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 1.27 1.19 -4.58 2.61 -2.24 -0.36 -4.97 114.28 107.20 1vgg n THR 61 Ca 0.00 -0.74 -0.23 0.00 -2.27 0.00 0.00 64.05 60.81 1vgg n THR 61 Cb 0.00 -0.52 -0.16 0.00 -2.10 0.00 0.00 70.33 67.55 1vgg n THR 61 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1vgg s ASP 62 N -5.15 1.63 0.30 3.42 1.11 -1.25 -4.98 116.67 111.75 1vgg s ASP 62 Ca -0.09 -0.26 0.02 0.00 0.18 0.00 0.00 52.55 52.40 1vgg s ASP 62 Cb 0.05 -0.47 0.59 0.00 1.07 0.00 0.00 42.92 44.16 1vgg s ASP 62 CO 0.73 0.10 1.87 -0.08 1.18 0.00 0.00 175.17 178.96 1vgg h GLU 63 N 6.38 0.93 -0.42 8.23 4.81 -1.93 -1.74 114.58 130.84 1vgg h GLU 63 Ca -0.33 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 58.77 1vgg h GLU 63 Cb 1.17 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.32 1vgg h GLU 63 CO 0.48 0.62 -0.04 0.00 -0.73 0.00 0.00 179.01 179.34 1vgg h ALA 64 N 1.54 1.15 -0.12 2.92 0.00 -1.98 -0.64 119.26 122.13 1vgg h ALA 64 Ca 0.45 -0.26 -0.22 0.00 0.00 0.00 0.00 54.91 54.88 1vgg h ALA 64 Cb 0.43 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1vgg h ALA 64 CO -0.21 0.54 -0.81 -0.07 0.00 0.00 0.00 179.25 178.70 1vgg h LEU 65 N 0.65 0.85 -0.72 0.00 3.38 -1.71 -2.70 115.31 115.06 1vgg h LEU 65 Ca 0.13 -0.58 -0.05 0.00 0.09 0.00 0.00 57.88 57.47 1vgg h LEU 65 Cb 0.46 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1vgg h LEU 65 CO 0.02 1.37 0.25 0.58 0.09 0.00 0.00 178.44 180.75 1vgg h VAL 66 N 0.47 1.26 -0.59 1.22 2.07 -1.11 -2.20 116.25 117.37 1vgg h VAL 66 Ca -0.06 -0.86 0.02 0.00 0.82 0.00 0.00 66.70 66.62 1vgg h VAL 66 Cb 1.43 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 1vgg h VAL 66 CO 0.16 0.34 0.38 -0.08 0.02 0.00 0.00 177.57 178.39 1vgg h GLU 67 N 1.06 0.74 -0.37 1.57 4.81 -1.07 -0.49 114.58 120.84 1vgg h GLU 67 Ca 0.24 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.44 1vgg h GLU 67 Cb 0.27 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1vgg h GLU 67 CO -0.01 0.49 0.22 -0.07 -0.73 0.00 0.00 179.01 178.91 1vgg h LEU 68 N 0.76 0.36 -0.03 1.64 4.07 -1.20 0.12 115.31 121.03 1vgg h LEU 68 Ca 0.23 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.19 1vgg h LEU 68 Cb -0.03 -0.08 -0.00 0.00 1.08 0.00 0.00 40.66 41.63 1vgg h LEU 68 CO -0.07 0.26 0.01 0.00 -1.08 0.00 0.00 178.44 177.56 1vgg h ALA 69 N 1.16 0.04 -0.14 1.53 0.00 -0.98 -2.31 119.26 118.55 1vgg h ALA 69 Ca 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1vgg h ALA 69 Cb -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1vgg h ALA 69 CO -0.06 -0.39 0.03 0.28 0.00 0.00 0.00 179.25 179.11 1vgg h VAL 70 N -0.10 1.20 -0.34 0.00 2.07 -0.96 -1.57 116.25 116.55 1vgg h VAL 70 Ca 0.01 -0.64 0.05 0.00 0.82 0.00 0.00 66.70 66.94 1vgg h VAL 70 Cb 0.15 1.36 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 1vgg h VAL 70 CO -0.00 0.19 0.06 0.50 0.02 0.00 0.00 177.57 178.34 1vgg h LYS 71 N 0.03 0.17 -0.48 1.57 3.64 -0.78 -0.07 116.57 120.66 1vgg h LYS 71 Ca 0.04 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.31 1vgg h LYS 71 Cb 0.27 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1vgg h LYS 71 CO 0.00 0.11 -0.09 -0.91 -2.27 0.00 0.00 179.45 176.29 1vgg h ASN 72 N 0.17 0.91 -0.62 4.20 2.35 -1.41 -2.73 115.58 118.45 1vgg h ASN 72 Ca 0.16 -0.35 -0.04 0.00 -0.55 0.00 0.00 56.30 55.52 1vgg h ASN 72 Cb 0.19 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 1vgg h ASN 72 CO -0.22 1.05 0.23 0.25 -1.65 0.00 0.00 177.43 177.08 1vgg h LEU 73 N 0.75 0.90 -1.09 1.61 5.85 -0.87 -1.57 115.31 120.89 1vgg h LEU 73 Ca 0.12 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 1vgg h LEU 73 Cb 0.64 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1vgg h LEU 73 CO 0.04 0.83 0.24 -0.07 -0.34 0.00 0.00 178.44 179.15 1vgg h LEU 74 N 0.95 0.81 -0.75 2.25 3.38 -0.89 -0.98 115.31 120.09 1vgg h LEU 74 Ca 0.22 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 1vgg h LEU 74 Cb 0.24 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1vgg h LEU 74 CO -0.01 0.73 -0.07 0.78 0.09 0.00 0.00 178.44 179.95 1vgg h ASN 75 N 0.88 0.86 -0.53 -0.43 2.35 -1.06 -2.86 115.58 114.79 1vgg h ASN 75 Ca 0.21 -0.25 -0.12 0.00 -0.55 0.00 0.00 56.30 55.59 1vgg h ASN 75 Cb 0.17 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1vgg h ASN 75 CO -0.02 0.96 -0.13 -0.07 -1.65 0.00 0.00 177.43 176.53 1vgg h LEU 76 N 0.79 1.03 -1.88 1.61 3.38 -0.79 -3.47 115.31 115.98 1vgg h LEU 76 Ca 0.14 -0.35 -0.50 0.00 0.09 0.00 0.00 57.88 57.25 1vgg h LEU 76 Cb 0.58 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.98 1vgg h LEU 76 CO 0.04 1.15 -0.89 0.00 0.09 0.00 0.00 178.44 178.83 1vgg n ALA 77 N -2.50 -1.98 -3.15 1.53 0.00 -0.42 -4.98 120.51 109.00 1vgg n ALA 77 Ca 0.01 -0.26 -0.32 0.00 0.00 0.00 0.00 53.44 52.87 1vgg n ALA 77 Cb 0.41 -1.55 -0.16 0.00 0.00 0.00 0.00 19.45 18.15 1vgg n ALA 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vgg s GLY 79 N 0.31 2.94 -0.66 0.00 0.00 -1.26 -3.04 107.32 105.61 1vgg s GLY 79 Ca -0.16 1.56 0.00 0.00 0.00 0.00 0.00 44.72 46.12 1vgg s GLY 79 CO 0.08 2.23 0.00 1.42 0.00 0.00 0.00 173.10 176.83 1vgg n HIS 80 N 0.37 0.00 -3.21 1.90 8.25 0.36 -4.96 115.22 117.93 1vgg n HIS 80 Ca 0.01 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.13 1vgg n HIS 80 Cb 0.40 -2.06 -0.06 0.00 1.12 0.00 0.00 29.99 29.38 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 -1.74 4.72 0.12 1.59 1.01 -1.17 -0.58 120.40 124.35 1vgg s VAL 81 Ca 0.00 0.95 0.06 0.00 0.00 0.00 0.00 61.98 62.99 1vgg s VAL 81 Cb 0.00 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 1vgg s VAL 81 CO 0.00 0.04 -0.15 0.72 0.00 0.00 0.00 175.10 175.70 1vgg s PHE 82 N -1.72 1.48 -0.02 5.22 -0.12 0.10 -0.81 117.98 122.12 1vgg s PHE 82 Ca 0.46 -0.52 0.00 0.00 -0.05 0.00 0.00 56.93 56.83 1vgg s PHE 82 Cb -0.13 -0.78 0.03 0.00 -0.63 0.00 0.00 43.02 41.51 1vgg s PHE 82 CO 0.19 0.17 0.02 -1.17 -0.05 0.00 0.00 175.22 174.38 1vgg s LEU 83 N -2.37 1.12 -0.12 -1.99 2.96 -0.02 -1.18 118.68 117.09 1vgg s LEU 83 Ca 0.09 0.01 0.00 0.00 -0.22 0.00 0.00 54.13 54.01 1vgg s LEU 83 Cb -0.06 -0.13 -0.02 0.00 0.50 0.00 0.00 46.19 46.48 1vgg s LEU 83 CO 0.04 -0.12 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.19 1vgg s ILE 84 N 1.04 3.03 -0.23 6.68 1.01 0.36 -1.18 121.20 131.90 1vgg s ILE 84 Ca -0.09 -0.68 -0.02 0.00 0.00 0.00 0.00 60.65 59.86 1vgg s ILE 84 Cb -0.13 -2.26 0.02 0.00 0.01 0.00 0.00 42.46 40.10 1vgg s ILE 84 CO -0.02 0.53 -0.08 -0.69 0.00 0.00 0.00 174.94 174.68 1vgg s VAL 85 N 0.21 2.82 0.00 2.92 1.01 0.46 -0.74 120.40 127.08 1vgg s VAL 85 Ca -0.08 -0.92 -0.17 0.00 0.00 0.00 0.00 61.98 60.81 1vgg s VAL 85 Cb -0.15 -2.37 -0.06 0.00 0.00 0.00 0.00 36.38 33.80 1vgg s VAL 85 CO 0.05 0.30 0.48 -0.76 0.00 0.00 0.00 175.10 175.17 1vgg s LEU 86 N 1.34 4.46 0.92 3.92 1.43 -0.10 -0.84 118.68 129.81 1vgg s LEU 86 Ca 0.02 1.04 -0.12 0.00 -1.03 0.00 0.00 54.13 54.04 1vgg s LEU 86 Cb -0.16 -2.71 0.14 0.00 0.03 0.00 0.00 46.19 43.49 1vgg s LEU 86 CO -0.06 0.25 1.09 -0.83 0.23 0.00 0.00 176.35 177.03 1vgg s GLY 87 N -0.76 1.60 0.22 -3.19 0.00 0.67 -3.85 107.32 102.00 1vgg s GLY 87 Ca 0.26 -0.15 -0.32 0.00 0.00 0.00 0.00 44.72 44.51 1vgg s GLY 87 CO 0.15 0.37 1.46 -2.21 0.00 0.00 0.00 173.10 172.86 1vgg n GLU 88 N -3.94 2.09 -0.27 2.90 2.13 -1.26 -2.24 120.64 120.05 1vgg n GLU 88 Ca 0.07 0.75 0.00 0.00 0.66 0.00 0.00 57.16 58.63 1vgg n GLU 88 Cb 0.56 -2.44 0.00 0.00 0.27 0.00 0.00 31.44 29.83 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 2.50 1.04 3.41 8.31 0.00 -1.26 -5.00 105.19 114.18 1vgg n GLY 89 Ca 0.13 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 -2.75 2.82 0.20 1.61 0.08 -0.95 -5.13 117.98 113.87 1vgg s PHE 90 Ca 0.00 -0.52 0.11 0.00 0.12 0.00 0.00 56.93 56.65 1vgg s PHE 90 Cb 0.00 -1.82 -0.04 0.00 -0.57 0.00 0.00 43.02 40.59 1vgg s PHE 90 CO 0.00 -0.12 -0.24 0.71 -0.10 0.00 0.00 175.22 175.48 1vgg s TYR 91 N 0.16 2.30 0.36 0.36 1.51 -1.26 -4.70 117.35 116.07 1vgg s TYR 91 Ca -0.06 -0.36 0.07 0.00 -1.01 0.00 0.00 57.07 55.71 1vgg s TYR 91 Cb -0.15 -1.13 0.77 0.00 -0.11 0.00 0.00 41.96 41.34 1vgg s TYR 91 CO 0.05 0.51 1.93 -1.35 -1.11 0.00 0.00 175.55 175.58 1vgg h PRO 92 N 3.13 0.71 0.00 -1.71 0.11 -1.95 -0.02 132.00 132.27 1vgg h PRO 92 Ca -0.46 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 1vgg h PRO 92 Cb 1.21 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 1vgg h PRO 92 CO 0.49 0.47 -0.01 -0.84 -0.21 0.00 0.00 178.00 177.90 1vgg h ILE 93 N 0.73 0.50 0.00 4.15 3.07 -2.00 0.30 117.51 124.27 1vgg h ILE 93 Ca 0.35 -0.04 -0.13 0.00 1.55 0.00 0.00 64.86 66.59 1vgg h ILE 93 Cb 0.39 1.02 -0.02 0.00 -0.27 0.00 0.00 36.82 37.95 1vgg h ILE 93 CO -0.13 0.01 -0.62 0.78 -1.05 0.00 0.00 178.15 177.14 1vgg h ASN 94 N 0.00 0.00 0.00 2.16 -0.26 -1.41 -3.38 115.58 112.69 1vgg h ASN 94 Ca -0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1vgg h ASN 94 Cb 0.02 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.28 1vgg h ASN 94 CO 0.00 0.62 0.00 1.33 -1.06 0.00 0.00 177.43 178.32 1vgg n VAL 95 N -3.77 0.00 -0.19 2.81 0.24 -0.48 -4.77 118.33 112.17 1vgg n VAL 95 Ca -0.01 -0.40 0.16 0.00 -2.04 0.00 0.00 64.34 62.05 1vgg n VAL 95 Cb 0.62 1.01 0.50 0.00 -1.47 0.00 0.00 33.84 34.50 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 0.42 -0.65 1.34 3.38 -0.64 -0.39 115.31 118.76 1vgg h LEU 96 Ca 0.00 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.08 1vgg h LEU 96 Cb 0.01 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 1vgg h LEU 96 CO 0.00 0.21 0.32 1.12 0.09 0.00 0.00 178.44 180.17 1vgg h HIS 97 N 0.44 0.57 -0.06 1.13 2.07 -1.84 0.32 115.15 117.77 1vgg h HIS 97 Ca 0.40 0.03 -0.13 0.00 -2.85 0.00 0.00 60.37 57.81 1vgg h HIS 97 Cb 0.91 -0.16 -0.01 0.00 2.57 0.00 0.00 27.41 30.71 1vgg h HIS 97 CO -0.00 0.22 -0.57 0.00 -3.07 0.00 0.00 177.93 174.52 1vgg h ALA 98 N 1.39 0.93 -0.07 6.11 0.00 -1.42 -2.09 119.26 124.11 1vgg h ALA 98 Ca 0.31 -0.52 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1vgg h ALA 98 Cb 0.30 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1vgg h ALA 98 CO -0.24 0.70 -0.08 0.28 0.00 0.00 0.00 179.25 179.91 1vgg h VAL 99 N 0.14 1.39 -1.01 0.00 2.07 -0.88 -2.51 116.25 115.45 1vgg h VAL 99 Ca -0.00 -1.28 0.05 0.00 0.82 0.00 0.00 66.70 66.28 1vgg h VAL 99 Cb 1.04 2.09 -0.06 0.00 -1.52 0.00 0.00 31.29 32.84 1vgg h VAL 99 CO 0.08 0.35 0.66 0.11 0.02 0.00 0.00 177.57 178.80 1vgg h LYS 100 N -0.28 1.20 0.00 1.57 1.57 -0.93 -2.27 116.57 117.43 1vgg h LYS 100 Ca 0.01 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1vgg h LYS 100 Cb 0.61 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1vgg h LYS 100 CO 0.02 0.80 0.00 0.00 -0.57 0.00 0.00 179.45 179.70 1vgg n ALA 101 N -2.37 2.24 -1.72 3.86 0.00 -0.79 -4.84 120.51 116.90 1vgg n ALA 101 Ca 0.14 -0.06 -0.42 0.00 0.00 0.00 0.00 53.44 53.11 1vgg n ALA 101 Cb 0.13 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.09 1vgg n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vgg h PRO 103 N 9.00 0.00 0.00 0.00 0.13 -1.89 -1.50 132.00 137.74 1vgg h PRO 103 Ca -0.46 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.61 1vgg h PRO 103 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1vgg h PRO 103 CO 0.95 0.00 -0.96 0.93 -0.23 0.00 0.00 178.00 178.69 1vgg h GLU 104 N 0.00 0.00 -6.43 0.86 3.07 -1.89 -3.46 114.58 106.73 1vgg h GLU 104 Ca 0.03 0.00 -0.54 0.00 -0.50 0.00 0.00 59.36 58.35 1vgg h GLU 104 Cb 0.25 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.16 1vgg h GLU 104 CO -0.00 0.12 0.64 0.08 -1.40 0.00 0.00 179.01 178.45 1vgg s VAL 105 N -3.19 4.01 -0.24 3.13 1.01 -0.57 -2.32 120.40 122.24 1vgg s VAL 105 Ca 0.00 1.42 -0.10 0.00 0.00 0.00 0.00 61.98 63.29 1vgg s VAL 105 Cb 0.09 -3.91 -0.17 0.00 0.00 0.00 0.00 36.38 32.39 1vgg s VAL 105 CO 0.78 0.07 -0.10 0.52 0.00 0.00 0.00 175.10 176.37 1vgg n VAL 106 N 4.19 1.56 -3.71 2.92 0.31 0.16 -4.87 118.33 118.89 1vgg n VAL 106 Ca 0.10 -0.40 -0.07 0.00 -0.01 0.00 0.00 64.34 63.96 1vgg n VAL 106 Cb 0.46 -1.78 -0.02 0.00 -0.91 0.00 0.00 33.84 31.59 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 1.44 -0.13 5.55 1.70 -1.04 -5.01 118.95 118.98 1vgg s ARG 107 Ca -0.33 -0.74 0.02 0.00 -0.47 0.00 0.00 55.73 54.21 1vgg s ARG 107 Cb 0.10 0.53 0.01 0.00 -0.57 0.00 0.00 34.95 35.03 1vgg s ARG 107 CO 0.58 -0.65 -0.18 0.42 -1.08 0.00 0.00 175.30 174.39 1vgg s ILE 108 N -3.65 1.72 0.04 4.99 1.01 -1.26 -0.78 121.20 123.27 1vgg s ILE 108 Ca 0.09 -0.77 -0.16 0.00 0.00 0.00 0.00 60.65 59.81 1vgg s ILE 108 Cb -0.03 -1.56 -0.30 0.00 0.01 0.00 0.00 42.46 40.58 1vgg s ILE 108 CO 0.00 0.48 1.07 1.88 0.00 0.00 0.00 174.94 178.37 1vgg h TYR 109 N 7.48 0.94 -2.28 3.97 0.05 -0.33 -3.48 116.97 123.32 1vgg h TYR 109 Ca -0.33 -0.60 -0.00 0.00 0.05 0.00 0.00 58.73 57.84 1vgg h TYR 109 Cb 1.17 -0.07 -0.17 0.00 1.01 0.00 0.00 36.73 38.68 1vgg h TYR 109 CO 0.47 1.45 0.29 0.00 -1.05 0.00 0.00 178.16 179.33 1vgg s ALA 110 N -2.90 -1.75 -0.10 3.88 0.00 -1.01 -4.86 121.76 115.02 1vgg s ALA 110 Ca -0.10 1.07 -0.03 0.00 0.00 0.00 0.00 51.96 52.89 1vgg s ALA 110 Cb 0.05 0.22 0.05 0.00 0.00 0.00 0.00 23.12 23.44 1vgg s ALA 110 CO 0.92 -0.53 0.09 0.00 0.00 0.00 0.00 175.76 176.24 1vgg s ALA 111 N -2.22 0.22 0.05 0.00 0.00 -1.26 -1.01 121.76 117.54 1vgg s ALA 111 Ca -0.04 0.06 -0.28 0.00 0.00 0.00 0.00 51.96 51.71 1vgg s ALA 111 Cb -0.01 -0.84 0.09 0.00 0.00 0.00 0.00 23.12 22.37 1vgg s ALA 111 CO -0.01 -0.79 0.99 -0.08 0.00 0.00 0.00 175.76 175.86 1vgg s THR 112 N 2.18 0.00 -0.34 0.00 -1.32 -0.54 -4.97 115.64 110.64 1vgg s THR 112 Ca 0.04 -0.32 0.04 0.00 -1.21 0.00 0.00 61.69 60.24 1vgg s THR 112 Cb -0.14 -1.55 -0.02 0.00 -1.51 0.00 0.00 72.50 69.29 1vgg s THR 112 CO -0.06 0.00 0.35 0.00 -2.21 0.00 0.00 174.62 172.70 1vgg n ALA 113 N -0.36 2.53 -1.56 11.08 0.00 -1.26 -1.00 120.51 129.94 1vgg n ALA 113 Ca -0.07 -0.27 -0.31 0.00 0.00 0.00 0.00 53.44 52.79 1vgg n ALA 113 Cb 0.61 -0.16 0.07 0.00 0.00 0.00 0.00 19.45 19.97 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 -1.03 5.01 0.29 0.00 0.02 -1.26 -4.78 114.94 113.18 1vgg s ASN 114 Ca 0.03 1.50 -0.30 0.00 -1.02 0.00 0.00 52.86 53.07 1vgg s ASN 114 Cb 0.03 -2.32 -0.12 0.00 0.02 0.00 0.00 41.25 38.87 1vgg s ASN 114 CO 0.13 -1.66 1.58 -2.65 0.02 0.00 0.00 177.10 174.52 1vgg n PRO 115 N -3.26 2.65 -4.66 -0.60 -0.02 -1.26 -4.68 135.00 123.17 1vgg n PRO 115 Ca 0.07 0.94 -0.22 0.00 -2.02 0.00 0.00 63.50 62.27 1vgg n PRO 115 Cb 0.55 -2.71 -0.15 0.00 -0.02 0.00 0.00 33.50 31.16 1vgg n PRO 115 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1vgg s LEU 116 N -0.43 2.03 -0.01 2.45 2.96 -1.26 -1.71 118.68 122.71 1vgg s LEU 116 Ca 0.64 -0.27 0.04 0.00 -0.22 0.00 0.00 54.13 54.32 1vgg s LEU 116 Cb -0.51 -0.74 -0.01 0.00 0.50 0.00 0.00 46.19 45.43 1vgg s LEU 116 CO 0.49 0.17 -0.12 -0.54 -1.32 0.00 0.00 176.35 175.03 1vgg s LYS 117 N -0.38 1.00 -0.14 1.98 1.02 -1.26 -1.30 119.74 120.66 1vgg s LYS 117 Ca 0.05 -0.43 -0.02 0.00 0.02 0.00 0.00 55.97 55.59 1vgg s LYS 117 Cb -0.06 -0.96 -0.02 0.00 -0.52 0.00 0.00 37.83 36.27 1vgg s LYS 117 CO -0.00 0.26 -0.09 0.08 -0.92 0.00 0.00 175.35 174.67 1vgg s VAL 118 N -0.26 3.39 -0.19 3.17 1.01 0.13 -4.46 120.40 123.18 1vgg s VAL 118 Ca 0.04 -0.54 -0.22 0.00 0.00 0.00 0.00 61.98 61.27 1vgg s VAL 118 Cb -0.05 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.85 1vgg s VAL 118 CO -0.00 0.51 0.68 -0.69 0.00 0.00 0.00 175.10 175.59 1vgg s VAL 119 N 0.40 4.99 0.16 2.92 1.01 0.07 -0.21 120.40 129.73 1vgg s VAL 119 Ca -0.08 1.29 0.07 0.00 0.00 0.00 0.00 61.98 63.26 1vgg s VAL 119 Cb -0.15 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 1vgg s VAL 119 CO 0.04 0.09 -0.14 0.68 0.00 0.00 0.00 175.10 175.77 1vgg s VAL 120 N 1.97 1.50 -0.03 2.92 -7.23 0.08 -0.48 120.40 119.13 1vgg s VAL 120 Ca 0.31 -1.99 0.07 0.00 -1.81 0.00 0.00 61.98 58.56 1vgg s VAL 120 Cb -0.16 -1.81 -0.02 0.00 0.56 0.00 0.00 36.38 34.95 1vgg s VAL 120 CO 0.11 -0.53 -0.24 0.00 -0.31 0.00 0.00 175.10 174.13 1vgg s ALA 121 N -2.66 2.24 -0.02 1.32 0.00 -0.16 -0.57 121.76 121.91 1vgg s ALA 121 Ca 0.16 -1.08 0.04 0.00 0.00 0.00 0.00 51.96 51.08 1vgg s ALA 121 Cb -0.02 -0.65 -0.01 0.00 0.00 0.00 0.00 23.12 22.44 1vgg s ALA 121 CO 0.04 0.51 -0.14 -2.00 0.00 0.00 0.00 175.76 174.17 1vgg s GLU 122 N -0.52 1.22 -0.25 0.00 2.12 0.45 -0.82 118.70 120.90 1vgg s GLU 122 Ca 0.07 -0.51 -0.02 0.00 0.36 0.00 0.00 54.97 54.87 1vgg s GLU 122 Cb -0.11 -1.16 0.14 0.00 0.26 0.00 0.00 34.13 33.26 1vgg s GLU 122 CO 0.00 0.29 0.38 -2.00 -0.54 0.00 0.00 175.26 173.38 1vgg s GLU 123 N -0.25 0.35 7.32 4.30 2.56 -0.41 -1.49 118.70 131.08 1vgg s GLU 123 Ca 0.04 0.44 0.00 0.00 0.00 0.00 0.00 54.97 55.45 1vgg s GLU 123 Cb -0.06 -0.48 0.00 0.00 2.00 0.00 0.00 34.13 35.58 1vgg s GLU 123 CO -0.00 -0.71 0.00 0.41 -0.56 0.00 0.00 175.26 174.39 1vgg n GLY 124 N 5.36 2.64 2.02 -1.50 0.00 -1.26 -2.09 105.19 110.36 1vgg n GLY 124 Ca -0.03 -0.29 -0.21 0.00 0.00 0.00 0.00 46.02 45.50 1vgg n GLY 124 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vgg n GLU 125 N 13.42 2.06 -4.20 1.61 1.02 -1.26 -4.91 120.64 128.39 1vgg n GLU 125 Ca 0.00 -2.49 -0.18 0.00 -0.02 0.00 0.00 57.16 54.48 1vgg n GLU 125 Cb 0.00 -1.97 -0.12 0.00 -0.02 0.00 0.00 31.44 29.32 1vgg n GLU 125 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1vgg s GLN 126 N -2.74 0.78 0.03 3.49 -0.21 -0.89 -5.02 119.66 115.10 1vgg s GLN 126 Ca 0.47 -0.84 -0.00 0.00 0.02 0.00 0.00 55.36 55.01 1vgg s GLN 126 Cb 0.40 -0.75 -0.02 0.00 1.00 0.00 0.00 33.01 33.64 1vgg s GLN 126 CO 0.08 0.17 -0.03 1.03 -2.12 0.00 0.00 175.29 174.42 1vgg s ARG 127 N -1.50 0.38 0.00 2.91 0.52 -1.26 -1.28 118.95 118.73 1vgg s ARG 127 Ca -0.02 -0.75 0.03 0.00 -0.52 0.00 0.00 55.73 54.47 1vgg s ARG 127 Cb -0.09 0.12 -0.01 0.00 0.52 0.00 0.00 34.95 35.49 1vgg s ARG 127 CO 0.02 -0.06 -0.09 0.00 0.02 0.00 0.00 175.30 175.19 1vgg s ALA 128 N -2.00 0.72 -0.20 2.13 0.00 0.00 -4.18 121.76 118.24 1vgg s ALA 128 Ca -0.11 -0.45 -0.24 0.00 0.00 0.00 0.00 51.96 51.16 1vgg s ALA 128 Cb -0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 1vgg s ALA 128 CO -0.03 0.15 0.80 0.42 0.00 0.00 0.00 175.76 177.10 1vgg s ILE 129 N -0.40 4.89 -0.14 0.00 1.01 -1.26 -0.99 121.20 124.31 1vgg s ILE 129 Ca 0.01 1.54 0.17 0.00 0.00 0.00 0.00 60.65 62.38 1vgg s ILE 129 Cb -0.04 -4.10 -0.24 0.00 0.01 0.00 0.00 42.46 38.08 1vgg s ILE 129 CO -0.00 0.01 0.33 0.18 0.00 0.00 0.00 174.94 175.46 1vgg n LEU 130 N 5.43 0.27 0.00 2.97 4.77 0.37 -4.97 117.00 125.84 1vgg n LEU 130 Ca 0.04 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1vgg n LEU 130 Cb 0.49 0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.89 1vgg n LEU 130 CO 0.47 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 1vgg n GLY 131 N 1.60 -0.59 0.00 -0.72 0.00 -1.16 -4.99 105.19 99.33 1vgg n GLY 131 Ca -0.23 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 44.77 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 -0.18 0.00 0.00 1.61 0.24 -1.26 -0.75 118.33 117.98 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 0.00 -1.34 4.64 -1.26 -4.97 116.55 113.62 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 -0.17 3.61 0.27 0.00 -0.70 -4.94 105.19 103.27 1vgg n GLY 135 Ca 0.00 -1.02 -0.27 0.00 0.00 0.00 0.00 46.02 44.74 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 2.50 0.71 1.61 0.40 -1.26 -4.96 117.98 116.98 1vgg s PHE 136 Ca 0.00 -0.58 -0.15 0.00 -0.60 0.00 0.00 56.93 55.60 1vgg s PHE 136 Cb 0.00 -1.64 0.03 0.00 0.51 0.00 0.00 43.02 41.92 1vgg s PHE 136 CO 0.00 0.46 1.19 0.95 0.70 0.00 0.00 175.22 178.52 1vgg s THR 137 N -2.64 2.51 0.42 0.64 -4.23 -1.26 -4.98 115.64 106.09 1vgg s THR 137 Ca 0.35 0.25 -0.24 0.00 -1.18 0.00 0.00 61.69 60.86 1vgg s THR 137 Cb 0.06 -2.80 -0.08 0.00 1.34 0.00 0.00 72.50 71.01 1vgg s THR 137 CO 0.18 -0.14 1.13 -2.16 -0.54 0.00 0.00 174.62 173.10 1vgg s PRO 138 N -3.94 4.00 -0.00 3.99 0.04 -1.26 -4.97 135.00 132.85 1vgg s PRO 138 Ca 0.73 1.71 0.18 0.00 0.04 0.00 0.00 61.00 63.66 1vgg s PRO 138 Cb -0.27 -2.55 -0.21 0.00 0.04 0.00 0.00 34.50 31.51 1vgg s PRO 138 CO 0.44 -0.33 0.73 1.28 0.04 0.00 0.00 177.00 179.16 1vgg n LEU 139 N -0.15 0.76 0.00 -3.56 4.77 -1.26 -5.07 117.00 112.49 1vgg n LEU 139 Ca 0.05 -0.44 0.00 0.00 -0.03 0.00 0.00 56.01 55.59 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 0.48 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 1vgg n GLY 140 N 1.43 -1.13 3.40 -0.72 0.00 -1.26 -5.15 105.19 101.76 1vgg n GLY 140 Ca 0.03 -0.90 -0.32 0.00 0.00 0.00 0.00 46.02 44.83 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 2.60 0.47 1.61 1.01 -1.26 -5.10 120.40 116.72 1vgg s VAL 141 Ca 0.00 -0.92 -0.24 0.00 0.00 0.00 0.00 61.98 60.82 1vgg s VAL 141 Cb 0.00 -1.97 -0.07 0.00 0.00 0.00 0.00 36.38 34.33 1vgg s VAL 141 CO 0.00 0.57 1.39 -1.83 0.00 0.00 0.00 175.10 175.23 1vgg s GLU 142 N -0.71 3.59 0.31 2.72 -1.05 -1.26 -5.03 118.70 117.26 1vgg s GLU 142 Ca 0.11 2.32 0.04 0.00 -0.15 0.00 0.00 54.97 57.30 1vgg s GLU 142 Cb -0.10 -2.56 0.04 0.00 -0.44 0.00 0.00 34.13 31.07 1vgg s GLU 142 CO 0.00 -0.86 0.37 -0.40 0.95 0.00 0.00 175.26 175.31 1vgg n ASP 143 N -0.37 1.42 -0.29 0.83 3.85 -1.26 -4.90 116.55 115.83 1vgg n ASP 143 Ca 0.06 -1.90 0.02 0.00 -0.71 0.00 0.00 54.79 52.26 1vgg n ASP 143 Cb 0.43 -0.16 0.22 0.00 -1.35 0.00 0.00 41.12 40.26 1vgg n ASP 143 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1vgg h GLU 144 N 0.00 1.05 -0.65 0.11 4.81 -1.99 -1.07 114.58 116.83 1vgg h GLU 144 Ca -0.16 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 58.94 1vgg h GLU 144 Cb 0.68 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 1vgg h GLU 144 CO 0.24 0.69 0.13 0.00 -0.73 0.00 0.00 179.01 179.34 1vgg h ALA 145 N 1.49 1.00 -0.03 2.92 0.00 -1.99 -1.39 119.26 121.25 1vgg h ALA 145 Ca 0.35 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 1vgg h ALA 145 Cb 0.05 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1vgg h ALA 145 CO -0.11 0.64 -0.63 0.93 0.00 0.00 0.00 179.25 180.09 1vgg h GLU 146 N 0.99 0.13 -0.32 0.00 4.39 -1.78 -0.53 114.58 117.47 1vgg h GLU 146 Ca 0.20 -0.10 -0.04 0.00 0.34 0.00 0.00 59.36 59.76 1vgg h GLU 146 Cb 0.39 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1vgg h GLU 146 CO 0.01 0.72 0.03 0.28 -1.16 0.00 0.00 179.01 178.88 1vgg h VAL 147 N 0.10 1.25 -0.85 3.13 2.07 -0.94 -1.58 116.25 119.42 1vgg h VAL 147 Ca -0.01 -0.88 -0.03 0.00 0.82 0.00 0.00 66.70 66.60 1vgg h VAL 147 Cb 1.13 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 32.06 1vgg h VAL 147 CO 0.09 0.29 0.41 0.00 0.02 0.00 0.00 177.57 178.38 1vgg h ALA 148 N 0.87 1.11 -0.03 1.67 0.00 -1.05 -2.36 119.26 119.47 1vgg h ALA 148 Ca 0.09 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1vgg h ALA 148 Cb 0.39 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1vgg h ALA 148 CO 0.01 0.67 0.02 2.35 0.00 0.00 0.00 179.25 182.29 1vgg h TRP 149 N 1.21 0.03 0.00 0.00 7.01 -0.80 -1.06 115.95 122.35 1vgg h TRP 149 Ca 0.29 0.00 -0.07 0.00 2.11 0.00 0.00 58.89 61.23 1vgg h TRP 149 Cb 0.12 -0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.16 1vgg h TRP 149 CO 0.02 0.03 -0.31 0.07 -2.79 0.00 0.00 178.44 175.45 1vgg h ARG 150 N 0.03 0.00 -0.11 2.65 0.11 -1.15 0.17 114.38 116.08 1vgg h ARG 150 Ca 0.01 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.99 1vgg h ARG 150 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.09 1vgg h ARG 150 CO -0.00 0.31 -0.31 0.87 0.10 0.00 0.00 179.97 180.94 1vgg h LYS 151 N 0.00 0.40 -0.61 0.08 1.57 -1.19 -2.95 116.57 113.87 1vgg h LYS 151 Ca -0.00 -0.29 -0.09 0.00 -1.87 0.00 0.00 60.65 58.40 1vgg h LYS 151 Cb 0.66 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 1vgg h LYS 151 CO 0.04 0.91 0.04 0.22 -0.57 0.00 0.00 179.45 180.09 1vgg h ASP 152 N -0.03 1.01 -0.42 0.86 3.58 -0.94 -2.95 116.42 117.54 1vgg h ASP 152 Ca -0.01 -0.26 0.08 0.00 0.42 0.00 0.00 57.03 57.26 1vgg h ASP 152 Cb 0.93 -0.27 -0.07 0.00 1.72 0.00 0.00 39.33 41.64 1vgg h ASP 152 CO 0.07 1.04 -0.02 0.25 -2.88 0.00 0.00 179.24 177.70 1vgg h LEU 153 N 0.96 -0.21 -1.50 2.28 5.85 -0.66 -0.02 115.31 122.02 1vgg h LEU 153 Ca 0.18 0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.96 1vgg h LEU 153 Cb 0.50 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 1vgg h LEU 153 CO 0.02 -0.07 -0.15 -0.07 -0.34 0.00 0.00 178.44 177.84 1vgg h LEU 154 N 0.09 0.13 -0.18 2.25 3.38 -1.36 -0.63 115.31 118.99 1vgg h LEU 154 Ca 0.20 -0.03 -0.21 0.00 0.09 0.00 0.00 57.88 57.94 1vgg h LEU 154 Cb 0.30 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.02 1vgg h LEU 154 CO -0.36 0.30 -0.71 0.03 0.09 0.00 0.00 178.44 177.79 1vgg h ARG 155 N 0.13 0.80 -0.01 1.13 3.08 -1.10 0.23 114.38 118.63 1vgg h ARG 155 Ca 0.03 -0.62 -0.08 0.00 0.07 0.00 0.00 59.98 59.38 1vgg h ARG 155 Cb 0.35 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 1vgg h ARG 155 CO 0.02 1.23 -0.37 0.00 -1.07 0.00 0.00 179.97 179.79 1vgg h ARG 156 N 0.54 0.02 0.00 0.04 3.08 -0.57 -2.01 114.38 115.48 1vgg h ARG 156 Ca -0.04 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1vgg h ARG 156 Cb 1.34 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.39 1vgg h ARG 156 CO 0.15 0.39 -0.00 1.28 -1.07 0.00 0.00 179.97 180.71 1vgg n LEU 157 N -4.10 0.66 0.00 3.04 4.77 -0.29 -4.92 117.00 116.17 1vgg n LEU 157 Ca -0.02 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.52 1vgg n LEU 157 Cb 0.41 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1vgg n LEU 157 CO 0.39 -0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 1vgg n GLY 158 N 1.35 0.75 0.14 -0.72 0.00 -0.76 -4.96 105.19 100.99 1vgg n GLY 158 Ca 0.06 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.17 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 -3.98 1.61 -1.99 -1.20 -3.46 116.97 107.95 1vgg h TYR 159 Ca 0.00 0.00 -0.38 0.00 2.00 0.00 0.00 58.73 60.35 1vgg h TYR 159 Cb 0.00 0.00 -0.23 0.00 2.00 0.00 0.00 36.73 38.50 1vgg h TYR 159 CO 0.00 0.00 -0.77 0.15 -0.00 0.00 0.00 178.16 177.54 1vgg s LYS 160 N -3.30 0.76 0.00 4.88 -0.14 -0.99 -4.98 119.74 115.96 1vgg s LYS 160 Ca 0.02 -0.77 0.28 0.00 -1.36 0.00 0.00 55.97 54.15 1vgg s LYS 160 Cb 0.09 -0.70 1.13 0.00 -1.68 0.00 0.00 37.83 36.66 1vgg s LYS 160 CO 0.75 0.16 1.79 1.28 -0.76 0.00 0.00 175.35 178.57