#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vpx s MET 1 N 0.00 4.30 -0.02 -0.41 0.00 -1.26 -4.96 119.30 116.95 1vpx s MET 1 Ca 0.00 2.20 -0.09 0.00 0.00 0.00 0.00 55.69 57.80 1vpx s MET 1 Cb 0.00 -3.17 -0.05 0.00 0.00 0.00 0.00 34.83 31.61 1vpx s MET 1 CO 0.00 -0.42 0.29 0.15 0.00 0.00 0.00 175.02 175.03 1vpx s LYS 2 N 0.34 3.65 -0.18 4.11 -0.14 -0.69 -5.02 119.74 121.81 1vpx s LYS 2 Ca 0.62 0.05 -0.00 0.00 -1.36 0.00 0.00 55.97 55.28 1vpx s LYS 2 Cb -0.40 -3.13 0.01 0.00 -1.68 0.00 0.00 37.83 32.63 1vpx s LYS 2 CO 0.36 0.68 -0.16 0.42 -0.76 0.00 0.00 175.35 175.90 1vpx s ILE 3 N -1.20 2.51 0.22 2.17 1.01 -1.26 -1.45 121.20 123.20 1vpx s ILE 3 Ca 0.24 -0.80 0.06 0.00 0.00 0.00 0.00 60.65 60.15 1vpx s ILE 3 Cb -0.14 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 1vpx s ILE 3 CO 0.13 0.51 0.20 -0.36 0.00 0.00 0.00 174.94 175.42 1vpx s PHE 4 N 1.14 3.17 -0.13 3.97 0.08 -0.66 -0.12 117.98 125.44 1vpx s PHE 4 Ca 0.01 -0.07 -0.04 0.00 0.12 0.00 0.00 56.93 56.95 1vpx s PHE 4 Cb -0.14 -1.46 -0.03 0.00 -0.57 0.00 0.00 43.02 40.81 1vpx s PHE 4 CO -0.06 0.51 0.01 -1.17 -0.10 0.00 0.00 175.22 174.42 1vpx s LEU 5 N -3.63 3.59 -0.94 -0.37 2.96 -0.66 -1.86 118.68 117.78 1vpx s LEU 5 Ca 0.32 0.07 -0.21 0.00 -0.22 0.00 0.00 54.13 54.09 1vpx s LEU 5 Cb -0.09 -1.86 0.08 0.00 0.50 0.00 0.00 46.19 44.83 1vpx s LEU 5 CO 0.25 0.26 1.27 -1.81 -1.32 0.00 0.00 176.35 175.00 1vpx s ASP 6 N -0.19 6.50 0.09 3.68 1.01 0.31 -0.17 116.67 127.90 1vpx s ASP 6 Ca 0.06 -1.60 -0.26 0.00 0.71 0.00 0.00 52.55 51.46 1vpx s ASP 6 Cb -0.12 -2.49 0.08 0.00 1.01 0.00 0.00 42.92 41.40 1vpx s ASP 6 CO 0.02 -1.34 0.78 0.28 0.21 0.00 0.00 175.17 175.12 1vpx s THR 7 N 4.00 0.00 0.00 -1.27 -1.32 -0.97 -4.53 115.64 111.56 1vpx s THR 7 Ca 0.38 -0.14 0.00 0.00 -1.21 0.00 0.00 61.69 60.72 1vpx s THR 7 Cb -0.04 -1.17 0.00 0.00 -1.51 0.00 0.00 72.50 69.78 1vpx s THR 7 CO -0.07 0.00 0.61 0.00 -2.21 0.00 0.00 174.62 172.95 1vpx n ALA 8 N -0.33 2.03 -2.68 11.08 0.00 -1.26 -4.44 120.51 124.91 1vpx n ALA 8 Ca -0.11 -0.61 -0.42 0.00 0.00 0.00 0.00 53.44 52.30 1vpx n ALA 8 Cb 0.63 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.05 1vpx n ALA 8 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1vpx s ASN 9 N -0.31 7.17 0.26 0.00 3.84 -1.26 -4.94 114.94 119.70 1vpx s ASN 9 Ca 0.00 1.44 0.13 0.00 0.21 0.00 0.00 52.86 54.65 1vpx s ASN 9 Cb 0.00 -2.54 0.22 0.00 -0.55 0.00 0.00 41.25 38.38 1vpx s ASN 9 CO 0.00 -0.47 1.51 -0.07 -2.79 0.00 0.00 177.10 175.28 1vpx h LEU 10 N 8.29 0.00 -0.08 3.21 -0.00 -1.99 -2.66 115.31 122.08 1vpx h LEU 10 Ca -0.29 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.57 1vpx h LEU 10 Cb 1.13 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.79 1vpx h LEU 10 CO 0.87 0.62 -0.02 -0.33 -0.00 0.00 0.00 178.44 179.58 1vpx h GLU 11 N 0.00 0.16 -0.25 1.13 3.07 -1.99 -0.07 114.58 116.64 1vpx h GLU 11 Ca -0.01 -0.06 -0.07 0.00 -0.50 0.00 0.00 59.36 58.72 1vpx h GLU 11 Cb 1.30 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 29.19 1vpx h GLU 11 CO 0.08 0.50 -0.15 1.05 -1.40 0.00 0.00 179.01 179.09 1vpx h GLU 12 N -0.18 0.42 -0.53 2.33 4.11 -1.98 -0.28 114.58 118.47 1vpx h GLU 12 Ca 0.02 -0.12 -0.07 0.00 0.07 0.00 0.00 59.36 59.26 1vpx h GLU 12 Cb 0.44 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 1vpx h GLU 12 CO 0.01 0.57 0.05 0.82 0.07 0.00 0.00 179.01 180.53 1vpx h ILE 13 N 0.39 1.26 -0.51 -1.06 2.04 -1.43 -0.44 117.51 117.77 1vpx h ILE 13 Ca 0.07 -1.01 0.02 0.00 1.00 0.00 0.00 64.86 64.94 1vpx h ILE 13 Cb 0.49 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 1vpx h ILE 13 CO 0.03 0.36 0.31 0.11 0.00 0.00 0.00 178.15 178.96 1vpx h LYS 14 N 0.79 0.60 -0.53 2.37 1.57 -0.46 -0.49 116.57 120.43 1vpx h LYS 14 Ca 0.16 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1vpx h LYS 14 Cb 0.46 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 1vpx h LYS 14 CO 0.02 0.40 0.30 0.87 -0.57 0.00 0.00 179.45 180.47 1vpx h LYS 15 N 0.62 0.73 -0.51 3.15 1.57 -0.90 0.21 116.57 121.44 1vpx h LYS 15 Ca 0.20 -0.08 0.09 0.00 -1.87 0.00 0.00 60.65 58.99 1vpx h LYS 15 Cb -0.00 -0.15 -0.07 0.00 0.08 0.00 0.00 32.23 32.09 1vpx h LYS 15 CO -0.08 0.55 0.10 0.78 -0.57 0.00 0.00 179.45 180.23 1vpx h GLY 16 N 0.71 0.62 1.80 3.86 0.00 -0.65 -0.47 103.07 108.95 1vpx h GLY 16 Ca 0.19 -0.03 -0.21 0.00 0.00 0.00 0.00 47.33 47.28 1vpx h GLY 16 CO -0.03 -0.07 -0.94 -0.39 0.00 0.00 0.00 176.54 175.11 1vpx h VAL 17 N 0.24 1.53 -0.97 4.60 -1.51 -0.72 -2.65 116.25 116.78 1vpx h VAL 17 Ca 0.25 -2.79 0.09 0.00 -1.23 0.00 0.00 66.70 63.03 1vpx h VAL 17 Cb 0.34 2.58 -0.07 0.00 -2.13 0.00 0.00 31.29 32.01 1vpx h VAL 17 CO -0.33 0.81 0.61 -0.33 -1.23 0.00 0.00 177.57 177.10 1vpx h GLU 18 N 0.08 1.00 0.00 5.19 5.08 -0.24 -1.14 114.58 124.55 1vpx h GLU 18 Ca -0.05 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1vpx h GLU 18 Cb 1.60 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1vpx h GLU 18 CO 0.14 0.66 0.00 -1.49 -1.00 0.00 0.00 179.01 177.32 1vpx h TRP 19 N 1.03 0.00 -2.22 4.33 6.55 -0.98 -3.47 115.95 121.19 1vpx h TRP 19 Ca 0.45 0.00 -0.23 0.00 0.95 0.00 0.00 58.89 60.06 1vpx h TRP 19 Cb 0.33 0.00 0.01 0.00 -0.86 0.00 0.00 29.16 28.64 1vpx h TRP 19 CO -0.01 0.00 -0.32 0.41 -1.05 0.00 0.00 178.44 177.47 1vpx n GLY 20 N 0.60 -0.04 0.01 1.49 0.00 -0.43 -4.91 105.19 101.91 1vpx n GLY 20 Ca 0.03 -0.33 0.01 0.00 0.00 0.00 0.00 46.02 45.72 1vpx n GLY 20 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1vpx n ILE 21 N -3.97 0.08 -3.62 -0.61 5.41 -1.03 -5.00 119.36 110.61 1vpx n ILE 21 Ca -0.10 -0.11 -0.37 0.00 1.00 0.00 0.00 62.75 63.18 1vpx n ILE 21 Cb 0.58 -0.00 -0.10 0.00 -0.71 0.00 0.00 39.64 39.41 1vpx n ILE 21 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1vpx s VAL 22 N -2.21 5.34 -0.45 1.39 1.01 -1.14 -4.25 120.40 120.10 1vpx s VAL 22 Ca -0.01 0.19 0.21 0.00 0.00 0.00 0.00 61.98 62.37 1vpx s VAL 22 Cb 0.02 -3.52 -0.29 0.00 0.00 0.00 0.00 36.38 32.59 1vpx s VAL 22 CO 0.15 0.30 0.66 0.47 0.00 0.00 0.00 175.10 176.68 1vpx n ASP 23 N 4.62 0.45 -1.66 3.32 8.00 0.83 -4.67 116.55 127.44 1vpx n ASP 23 Ca -0.14 -0.43 0.00 0.00 0.71 0.00 0.00 54.79 54.93 1vpx n ASP 23 Cb 0.52 1.56 0.00 0.00 -0.02 0.00 0.00 41.12 43.19 1vpx n ASP 23 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vpx n GLY 24 N 1.37 0.76 2.99 0.44 0.00 -1.23 -3.71 105.19 105.81 1vpx n GLY 24 Ca -0.01 -0.92 -0.12 0.00 0.00 0.00 0.00 46.02 44.97 1vpx n GLY 24 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vpx s VAL 25 N -2.24 0.01 -0.09 1.61 1.01 -0.06 -1.65 120.40 118.99 1vpx s VAL 25 Ca 0.07 -0.10 0.03 0.00 0.00 0.00 0.00 61.98 61.98 1vpx s VAL 25 Cb -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 36.38 36.18 1vpx s VAL 25 CO 0.00 -0.05 -0.18 0.42 0.00 0.00 0.00 175.10 175.29 1vpx s THR 26 N -0.13 2.69 0.27 3.92 -4.23 0.76 -0.96 115.64 117.95 1vpx s THR 26 Ca -0.02 -0.82 0.03 0.00 -1.18 0.00 0.00 61.69 59.71 1vpx s THR 26 Cb -0.02 -2.07 -0.06 0.00 1.34 0.00 0.00 72.50 71.70 1vpx s THR 26 CO 0.00 0.55 0.03 0.28 -0.54 0.00 0.00 174.62 174.95 1vpx s THR 27 N -0.01 1.01 0.13 3.99 -1.32 -0.75 -2.28 115.64 116.41 1vpx s THR 27 Ca -0.05 -2.02 -0.20 0.00 -1.21 0.00 0.00 61.69 58.21 1vpx s THR 27 Cb -0.15 -2.55 0.05 0.00 -1.51 0.00 0.00 72.50 68.35 1vpx s THR 27 CO 0.05 -0.16 0.51 0.54 -2.21 0.00 0.00 174.62 173.35 1vpx s ASN 28 N -3.37 -0.41 0.21 8.08 2.20 -1.26 -4.54 114.94 115.85 1vpx s ASN 28 Ca 0.33 -0.12 -0.09 0.00 -0.94 0.00 0.00 52.86 52.04 1vpx s ASN 28 Cb 0.07 0.54 0.27 0.00 -2.00 0.00 0.00 41.25 40.13 1vpx s ASN 28 CO 0.12 -0.90 1.78 -0.65 -2.94 0.00 0.00 177.10 174.51 1vpx h PRO 29 N 2.23 0.56 -0.69 3.55 0.11 -1.97 -3.11 132.00 132.68 1vpx h PRO 29 Ca -0.34 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 1vpx h PRO 29 Cb 1.28 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 1vpx h PRO 29 CO 0.42 0.37 0.41 1.79 -0.21 0.00 0.00 178.00 180.78 1vpx h THR 30 N 0.58 1.20 -0.81 -1.15 1.35 -1.98 -1.65 112.91 110.44 1vpx h THR 30 Ca 0.31 -0.46 0.15 0.00 -0.55 0.00 0.00 66.41 65.85 1vpx h THR 30 Cb 0.29 0.26 -0.06 0.00 -1.73 0.00 0.00 68.15 66.91 1vpx h THR 30 CO -0.24 0.21 0.53 -0.07 -0.25 0.00 0.00 175.52 175.71 1vpx h LEU 31 N 0.94 0.50 0.16 3.87 4.07 -1.97 0.15 115.31 123.03 1vpx h LEU 31 Ca 0.25 0.03 -0.01 0.00 0.08 0.00 0.00 57.88 58.23 1vpx h LEU 31 Cb -0.01 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.66 1vpx h LEU 31 CO -0.04 0.26 -0.08 0.40 -1.08 0.00 0.00 178.44 177.89 1vpx h ILE 32 N 0.53 0.00 0.00 1.22 2.04 -1.43 -2.78 117.51 117.09 1vpx h ILE 32 Ca 0.40 -0.83 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 1vpx h ILE 32 Cb 0.79 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1vpx h ILE 32 CO -0.15 0.00 -0.05 0.77 0.00 0.00 0.00 178.15 178.72 1vpx h SER 33 N -1.05 0.00 -0.19 1.72 4.64 -1.29 0.80 113.55 118.19 1vpx h SER 33 Ca -0.02 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.33 1vpx h SER 33 Cb 0.16 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.22 1vpx h SER 33 CO 0.04 0.05 -0.04 0.11 -0.87 0.00 0.00 176.83 176.11 1vpx h LYS 34 N 0.00 0.01 -0.00 4.77 6.56 -0.75 -2.03 116.57 125.13 1vpx h LYS 34 Ca -0.00 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1vpx h LYS 34 Cb 0.23 -0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.89 1vpx h LYS 34 CO 0.01 0.01 -0.01 0.39 -2.06 0.00 0.00 179.45 177.78 1vpx n GLU 35 N -5.18 0.68 -1.10 3.15 4.71 0.63 -4.94 120.64 118.58 1vpx n GLU 35 Ca -0.03 -0.04 -0.01 0.00 -0.01 0.00 0.00 57.16 57.07 1vpx n GLU 35 Cb 0.12 -1.50 -0.01 0.00 -1.01 0.00 0.00 31.44 29.04 1vpx n GLU 35 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1vpx n GLY 36 N 1.18 0.48 3.97 0.62 0.00 0.25 -5.04 105.19 106.64 1vpx n GLY 36 Ca 0.18 -1.01 -0.21 0.00 0.00 0.00 0.00 46.02 44.98 1vpx n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vpx s ALA 37 N -2.05 4.01 0.00 4.61 0.00 -1.00 -4.94 121.76 122.39 1vpx s ALA 37 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 50.66 1vpx s ALA 37 Cb 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 23.12 21.18 1vpx s ALA 37 CO 0.00 -0.34 0.00 -1.91 0.00 0.00 0.00 175.76 173.51 1vpx n GLU 38 N -1.98 0.00 0.04 0.00 0.00 -1.26 -4.05 120.64 113.39 1vpx n GLU 38 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.19 1vpx n GLU 38 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.02 1vpx n GLU 38 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 1vpx n PHE 39 N 0.00 -2.57 -0.27 4.31 7.35 -1.26 -4.69 117.46 120.33 1vpx n PHE 39 Ca 0.00 0.25 -0.07 0.00 -0.76 0.00 0.00 57.45 56.88 1vpx n PHE 39 Cb 0.00 0.99 0.06 0.00 0.35 0.00 0.00 39.48 40.88 1vpx n PHE 39 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1vpx h LYS 40 N 0.00 1.16 0.07 -4.13 1.57 -1.99 -0.36 116.57 112.89 1vpx h LYS 40 Ca 0.00 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1vpx h LYS 40 Cb 0.00 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.15 1vpx h LYS 40 CO 0.00 0.99 -0.03 1.96 -0.57 0.00 0.00 179.45 181.80 1vpx h GLN 41 N 1.11 -0.09 -0.09 3.15 1.08 -1.99 -2.62 115.11 115.67 1vpx h GLN 41 Ca 0.24 0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.40 1vpx h GLN 41 Cb 0.33 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.77 1vpx h GLN 41 CO -0.00 0.26 -0.16 -0.09 -0.95 0.00 0.00 178.83 177.89 1vpx h ARG 42 N -0.44 0.14 -0.65 1.46 9.65 -1.85 0.62 114.38 123.30 1vpx h ARG 42 Ca -0.01 -0.03 -0.04 0.00 -1.10 0.00 0.00 59.98 58.80 1vpx h ARG 42 Cb 0.39 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.92 1vpx h ARG 42 CO 0.01 0.30 0.26 0.28 2.80 0.00 0.00 179.97 183.63 1vpx h VAL 43 N 0.13 1.24 -0.28 0.20 2.07 -1.09 -0.83 116.25 117.69 1vpx h VAL 43 Ca 0.03 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 1vpx h VAL 43 Cb 0.37 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1vpx h VAL 43 CO 0.02 0.30 0.17 0.50 0.02 0.00 0.00 177.57 178.58 1vpx h LYS 44 N 0.92 0.38 -0.75 1.57 1.63 -0.67 -0.97 116.57 118.68 1vpx h LYS 44 Ca 0.22 -0.03 0.01 0.00 -0.85 0.00 0.00 60.65 60.00 1vpx h LYS 44 Cb 0.21 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 31.72 1vpx h LYS 44 CO -0.02 0.29 0.49 0.93 -3.45 0.00 0.00 179.45 177.70 1vpx h GLU 45 N 0.35 0.97 -0.29 1.90 5.08 -0.74 -1.57 114.58 120.29 1vpx h GLU 45 Ca 0.10 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1vpx h GLU 45 Cb 0.01 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 1vpx h GLU 45 CO -0.02 0.64 0.08 0.82 -1.00 0.00 0.00 179.01 179.53 1vpx h ILE 46 N 1.00 1.21 -0.31 3.13 2.04 -0.96 -2.32 117.51 121.30 1vpx h ILE 46 Ca 0.28 -0.70 0.05 0.00 1.00 0.00 0.00 64.86 65.49 1vpx h ILE 46 Cb -0.09 1.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 1vpx h ILE 46 CO -0.07 0.23 0.04 0.00 0.00 0.00 0.00 178.15 178.35 1vpx h ASP 48 N 0.14 0.57 0.03 0.00 5.19 -1.20 0.34 116.42 121.48 1vpx h ASP 48 Ca 0.15 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.56 1vpx h ASP 48 Cb 0.18 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.57 1vpx h ASP 48 CO -0.22 0.37 -0.01 -0.07 -3.12 0.00 0.00 179.24 176.19 1vpx h LEU 49 N 0.65 -0.03 0.03 1.55 3.38 -0.77 -3.38 115.31 116.74 1vpx h LEU 49 Ca 0.28 -0.61 -0.24 0.00 0.09 0.00 0.00 57.88 57.40 1vpx h LEU 49 Cb 0.26 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1vpx h LEU 49 CO -0.08 0.74 -1.09 0.58 0.09 0.00 0.00 178.44 178.68 1vpx h VAL 50 N -0.96 1.62 -6.64 1.22 2.07 -0.89 -3.48 116.25 109.19 1vpx h VAL 50 Ca -0.00 -3.23 -0.53 0.00 0.82 0.00 0.00 66.70 63.76 1vpx h VAL 50 Cb 0.64 2.87 -0.04 0.00 -1.52 0.00 0.00 31.29 33.24 1vpx h VAL 50 CO 0.01 0.93 -0.95 0.29 0.02 0.00 0.00 177.57 177.87 1vpx n LYS 51 N -3.44 -1.61 -3.64 1.57 5.02 0.10 -4.84 118.16 111.31 1vpx n LYS 51 Ca -0.04 0.28 -0.05 0.00 -2.02 0.00 0.00 58.31 56.48 1vpx n LYS 51 Cb 0.97 -3.78 0.02 0.00 -0.02 0.00 0.00 35.03 32.22 1vpx n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1vpx n GLY 52 N -2.04 0.84 3.70 0.72 0.00 -1.26 -5.02 105.19 102.13 1vpx n GLY 52 Ca -0.21 -1.19 -0.43 0.00 0.00 0.00 0.00 46.02 44.19 1vpx n GLY 52 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1vpx n PRO 53 N -0.59 2.65 -4.02 1.61 -0.02 -1.24 -4.76 135.00 128.63 1vpx n PRO 53 Ca -0.05 0.96 -0.31 0.00 -2.02 0.00 0.00 63.50 62.08 1vpx n PRO 53 Cb 0.55 -2.81 -0.15 0.00 -0.02 0.00 0.00 33.50 31.07 1vpx n PRO 53 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1vpx s VAL 54 N 1.80 2.01 -0.01 -1.45 1.01 -0.34 -0.88 120.40 122.54 1vpx s VAL 54 Ca 0.79 -1.72 -0.28 0.00 0.00 0.00 0.00 61.98 60.77 1vpx s VAL 54 Cb -0.54 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 1vpx s VAL 54 CO 0.36 -0.22 0.88 -0.44 0.00 0.00 0.00 175.10 175.68 1vpx s SER 55 N 1.13 7.25 -0.01 3.32 0.01 -0.14 -0.70 113.70 124.56 1vpx s SER 55 Ca -0.02 1.51 0.01 0.00 1.31 0.00 0.00 55.95 58.75 1vpx s SER 55 Cb -0.19 -2.52 0.01 0.00 0.21 0.00 0.00 66.02 63.53 1vpx s SER 55 CO -0.07 -0.19 -0.03 0.00 0.41 0.00 0.00 173.24 173.36 1vpx s ALA 56 N 0.85 0.34 0.33 1.44 0.00 0.13 -1.82 121.76 123.04 1vpx s ALA 56 Ca 0.47 -0.06 -0.14 0.00 0.00 0.00 0.00 51.96 52.22 1vpx s ALA 56 Cb -0.20 -0.17 -0.08 0.00 0.00 0.00 0.00 23.12 22.67 1vpx s ALA 56 CO 0.25 0.03 0.73 -1.83 0.00 0.00 0.00 175.76 174.94 1vpx s GLU 57 N 0.28 3.95 0.36 0.00 -1.05 -1.26 -1.14 118.70 119.83 1vpx s GLU 57 Ca -0.03 0.61 -0.03 0.00 -0.15 0.00 0.00 54.97 55.37 1vpx s GLU 57 Cb -0.06 -2.44 -0.04 0.00 -0.44 0.00 0.00 34.13 31.15 1vpx s GLU 57 CO -0.01 0.14 0.61 0.14 0.95 0.00 0.00 175.26 177.09 1vpx s VAL 58 N -2.03 5.03 -0.13 1.83 -7.23 -1.24 -4.91 120.40 111.72 1vpx s VAL 58 Ca 0.53 -0.14 -0.29 0.00 -1.81 0.00 0.00 61.98 60.28 1vpx s VAL 58 Cb -0.10 -3.82 -0.25 0.00 0.56 0.00 0.00 36.38 32.76 1vpx s VAL 58 CO 0.20 -0.55 0.83 0.58 -0.31 0.00 0.00 175.10 175.84 1vpx h VAL 59 N 0.83 1.74 -4.22 1.32 2.07 -1.95 -3.48 116.25 112.56 1vpx h VAL 59 Ca -0.48 -2.20 -0.50 0.00 0.82 0.00 0.00 66.70 64.33 1vpx h VAL 59 Cb 1.21 3.24 0.09 0.00 -1.52 0.00 0.00 31.29 34.30 1vpx h VAL 59 CO 0.63 0.57 0.37 -0.55 0.02 0.00 0.00 177.57 178.61 1vpx s SER 60 N -6.15 5.40 -0.00 0.57 0.15 -1.26 -4.99 113.70 107.41 1vpx s SER 60 Ca -0.19 1.86 0.03 0.00 0.70 0.00 0.00 55.95 58.36 1vpx s SER 60 Cb -0.02 -2.53 -0.03 0.00 -1.71 0.00 0.00 66.02 61.72 1vpx s SER 60 CO 0.69 -1.43 0.12 0.18 1.20 0.00 0.00 173.24 174.00 1vpx n LEU 61 N -2.40 0.13 -4.83 3.45 4.77 -1.26 -4.54 117.00 112.32 1vpx n LEU 61 Ca 0.09 -0.46 -0.33 0.00 -0.03 0.00 0.00 56.01 55.28 1vpx n LEU 61 Cb 0.53 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.55 1vpx n LEU 61 CO 0.49 0.03 0.52 1.51 -1.33 0.00 0.00 177.39 178.61 1vpx s ASP 62 N -1.36 6.87 0.17 -1.43 -4.77 -1.26 -4.72 116.67 110.16 1vpx s ASP 62 Ca 0.01 1.47 -0.18 0.00 -3.30 0.00 0.00 52.55 50.55 1vpx s ASP 62 Cb 0.02 -2.45 0.09 0.00 -1.09 0.00 0.00 42.92 39.49 1vpx s ASP 62 CO 0.12 -0.26 1.65 0.22 0.70 0.00 0.00 175.17 177.60 1vpx h TYR 63 N 2.16 -0.35 -0.01 2.11 3.20 -1.95 0.22 116.97 122.35 1vpx h TYR 63 Ca -0.48 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.43 1vpx h TYR 63 Cb 1.18 0.21 -0.00 0.00 1.54 0.00 0.00 36.73 39.66 1vpx h TYR 63 CO 0.62 -0.23 0.01 0.93 -1.64 0.00 0.00 178.16 177.85 1vpx h GLU 64 N -0.07 0.01 -0.59 1.82 5.08 -1.94 -1.95 114.58 116.94 1vpx h GLU 64 Ca 0.19 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.49 1vpx h GLU 64 Cb 0.36 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 1vpx h GLU 64 CO -0.44 0.01 0.14 0.78 -1.00 0.00 0.00 179.01 178.50 1vpx h GLY 65 N 0.01 0.99 0.95 -3.84 0.00 -1.88 -1.02 103.07 98.28 1vpx h GLY 65 Ca 0.00 -0.59 -0.02 0.00 0.00 0.00 0.00 47.33 46.72 1vpx h GLY 65 CO -0.00 0.55 0.18 -0.33 0.00 0.00 0.00 176.54 176.94 1vpx h MET 66 N 0.89 0.61 -0.21 4.80 2.86 -0.79 -1.99 114.93 121.10 1vpx h MET 66 Ca 0.19 -0.10 -0.06 0.00 -2.06 0.00 0.00 59.70 57.67 1vpx h MET 66 Cb 0.33 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 1vpx h MET 66 CO 0.00 0.55 -0.09 0.28 1.06 0.00 0.00 176.91 178.71 1vpx h VAL 67 N 0.53 1.30 -0.45 -2.22 2.07 -1.20 -0.33 116.25 115.95 1vpx h VAL 67 Ca 0.14 -1.14 0.09 0.00 0.82 0.00 0.00 66.70 66.61 1vpx h VAL 67 Cb 0.16 1.60 -0.09 0.00 -1.52 0.00 0.00 31.29 31.44 1vpx h VAL 67 CO -0.01 0.35 -0.19 -0.09 0.02 0.00 0.00 177.57 177.64 1vpx h ARG 68 N 0.14 -0.09 -0.05 1.57 2.43 -1.17 -1.88 114.38 115.33 1vpx h ARG 68 Ca 0.05 0.01 -0.20 0.00 -0.81 0.00 0.00 59.98 59.02 1vpx h ARG 68 Cb 0.57 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1vpx h ARG 68 CO 0.03 -0.06 -0.82 0.93 -1.51 0.00 0.00 179.97 178.54 1vpx h GLU 69 N -0.10 0.43 -0.51 0.20 5.08 -1.28 -2.96 114.58 115.45 1vpx h GLU 69 Ca 0.22 -0.40 0.01 0.00 -1.00 0.00 0.00 59.36 58.19 1vpx h GLU 69 Cb 0.43 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 1vpx h GLU 69 CO -0.52 1.04 0.33 0.00 -1.00 0.00 0.00 179.01 178.87 1vpx h ALA 70 N 0.83 0.64 -0.98 3.43 0.00 -0.84 -0.01 119.26 122.33 1vpx h ALA 70 Ca -0.05 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1vpx h ALA 70 Cb 1.42 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 1vpx h ALA 70 CO 0.14 0.08 0.65 0.00 0.00 0.00 0.00 179.25 180.12 1vpx h ARG 71 N 0.68 1.27 -0.19 0.00 3.08 -1.32 0.15 114.38 118.05 1vpx h ARG 71 Ca 0.19 -0.08 -0.08 0.00 0.07 0.00 0.00 59.98 60.08 1vpx h ARG 71 Cb -0.07 -0.29 -0.00 0.00 0.08 0.00 0.00 29.97 29.69 1vpx h ARG 71 CO -0.05 0.84 -0.21 1.49 -1.07 0.00 0.00 179.97 180.98 1vpx h GLU 72 N 1.31 0.48 -0.60 0.04 4.81 -1.29 -2.98 114.58 116.35 1vpx h GLU 72 Ca 0.37 -0.26 -0.06 0.00 -0.13 0.00 0.00 59.36 59.28 1vpx h GLU 72 Cb -0.12 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 1vpx h GLU 72 CO -0.09 0.84 0.13 -0.07 -0.73 0.00 0.00 179.01 179.08 1vpx h LEU 73 N 0.14 0.90 -1.75 1.64 3.38 -0.72 -2.83 115.31 116.07 1vpx h LEU 73 Ca 0.03 -0.18 0.04 0.00 0.09 0.00 0.00 57.88 57.86 1vpx h LEU 73 Cb 0.76 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1vpx h LEU 73 CO 0.05 0.89 0.25 0.00 0.09 0.00 0.00 178.44 179.71 1vpx h ALA 74 N 1.22 1.94 0.00 1.53 0.00 -0.65 -1.87 119.26 121.43 1vpx h ALA 74 Ca 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1vpx h ALA 74 Cb 0.36 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1vpx h ALA 74 CO 0.00 0.01 0.00 1.04 0.00 0.00 0.00 179.25 180.30 1vpx n GLN 75 N -4.48 0.10 -0.20 0.00 6.02 -1.07 -3.09 117.38 114.66 1vpx n GLN 75 Ca 0.04 0.30 -0.09 0.00 -0.01 0.00 0.00 57.00 57.24 1vpx n GLN 75 Cb 0.20 -1.68 0.02 0.00 1.02 0.00 0.00 30.24 29.80 1vpx n GLN 75 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1vpx h ILE 76 N 0.00 1.27 -1.71 5.09 2.04 -1.45 -3.47 117.51 119.28 1vpx h ILE 76 Ca 0.00 -1.15 0.06 0.00 1.00 0.00 0.00 64.86 64.77 1vpx h ILE 76 Cb 0.35 0.87 -0.21 0.00 -0.74 0.00 0.00 36.82 37.08 1vpx h ILE 76 CO 0.00 0.42 0.48 -0.55 0.00 0.00 0.00 178.15 178.50 1vpx s SER 77 N -6.53 -0.42 0.62 1.72 0.15 -1.18 -4.96 113.70 103.11 1vpx s SER 77 Ca -0.12 0.41 0.39 0.00 0.70 0.00 0.00 55.95 57.34 1vpx s SER 77 Cb 0.13 0.35 2.02 0.00 -1.71 0.00 0.00 66.02 66.81 1vpx s SER 77 CO 0.85 -0.42 2.24 1.05 1.20 0.00 0.00 173.24 178.16 1vpx h GLU 78 N 2.57 0.00 0.00 5.44 9.09 -1.91 -2.73 114.58 127.05 1vpx h GLU 78 Ca -0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.21 1vpx h GLU 78 Cb 1.17 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.27 1vpx h GLU 78 CO 0.32 0.01 -0.25 0.66 0.05 0.00 0.00 179.01 179.80 1vpx n TYR 79 N -3.18 0.73 -2.19 2.06 4.01 -1.26 -4.90 117.16 112.44 1vpx n TYR 79 Ca -0.02 0.21 -0.41 0.00 -0.16 0.00 0.00 57.90 57.52 1vpx n TYR 79 Cb 0.15 -0.80 -0.03 0.00 -0.31 0.00 0.00 39.34 38.35 1vpx n TYR 79 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1vpx s VAL 80 N -3.12 3.13 -0.06 -0.72 0.11 -1.03 -1.20 120.40 117.51 1vpx s VAL 80 Ca 0.09 0.93 0.06 0.00 -2.93 0.00 0.00 61.98 60.13 1vpx s VAL 80 Cb 0.13 -3.60 -0.01 0.00 -1.53 0.00 0.00 36.38 31.37 1vpx s VAL 80 CO 0.65 0.14 -0.24 -0.69 -3.33 0.00 0.00 175.10 171.62 1vpx s VAL 81 N 0.12 2.14 -0.25 2.04 1.01 0.12 -4.64 120.40 120.95 1vpx s VAL 81 Ca 0.57 -1.04 -0.16 0.00 0.00 0.00 0.00 61.98 61.35 1vpx s VAL 81 Cb -0.37 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 1vpx s VAL 81 CO 0.39 0.57 0.44 -0.63 0.00 0.00 0.00 175.10 175.87 1vpx s ILE 82 N -0.18 5.13 -0.11 2.22 1.01 -0.64 -0.69 121.20 127.94 1vpx s ILE 82 Ca -0.03 0.75 -0.30 0.00 0.00 0.00 0.00 60.65 61.07 1vpx s ILE 82 Cb -0.14 -3.77 -0.01 0.00 0.01 0.00 0.00 42.46 38.55 1vpx s ILE 82 CO 0.04 0.15 1.08 -0.54 0.00 0.00 0.00 174.94 175.67 1vpx s LYS 83 N 1.98 4.37 -0.10 2.79 1.02 -0.30 0.06 119.74 129.56 1vpx s LYS 83 Ca 0.19 1.48 0.03 0.00 0.02 0.00 0.00 55.97 57.69 1vpx s LYS 83 Cb -0.15 -3.58 0.01 0.00 -0.52 0.00 0.00 37.83 33.59 1vpx s LYS 83 CO 0.09 -0.42 -0.19 0.42 -0.92 0.00 0.00 175.35 174.33 1vpx s ILE 84 N 2.34 1.71 0.50 2.17 -1.09 0.27 -3.62 121.20 123.49 1vpx s ILE 84 Ca 0.50 -0.79 -0.22 0.00 -2.23 0.00 0.00 60.65 57.90 1vpx s ILE 84 Cb -0.20 -1.52 -0.06 0.00 -1.58 0.00 0.00 42.46 39.10 1vpx s ILE 84 CO 0.17 0.48 1.24 -2.16 -1.23 0.00 0.00 174.94 173.44 1vpx s PRO 85 N 0.70 3.50 -0.89 2.79 0.04 -1.26 -0.72 135.00 139.15 1vpx s PRO 85 Ca -0.12 1.95 -0.24 0.00 0.04 0.00 0.00 61.00 62.62 1vpx s PRO 85 Cb -0.16 -2.33 -0.01 0.00 0.04 0.00 0.00 34.50 32.03 1vpx s PRO 85 CO 0.02 -0.82 1.76 1.41 0.04 0.00 0.00 177.00 179.42 1vpx s MET 86 N -2.80 2.88 0.10 4.56 -2.45 -0.37 -4.42 119.30 116.80 1vpx s MET 86 Ca 0.67 -0.40 -0.01 0.00 -1.25 0.00 0.00 55.69 54.69 1vpx s MET 86 Cb -0.33 -5.01 -0.04 0.00 1.25 0.00 0.00 34.83 30.70 1vpx s MET 86 CO 0.39 -2.92 0.03 0.95 1.05 0.00 0.00 175.02 174.53 1vpx s THR 87 N 8.34 0.14 0.18 10.11 -4.23 -1.26 -5.01 115.64 123.91 1vpx s THR 87 Ca 0.61 -1.85 -0.18 0.00 -1.18 0.00 0.00 61.69 59.10 1vpx s THR 87 Cb -0.06 -1.84 0.13 0.00 1.34 0.00 0.00 72.50 72.07 1vpx s THR 87 CO 0.00 -0.66 1.64 -0.65 -0.54 0.00 0.00 174.62 174.41 1vpx h PRO 88 N 2.96 -0.08 -0.76 3.99 0.11 -1.99 0.10 132.00 136.34 1vpx h PRO 88 Ca -0.35 0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.78 1vpx h PRO 88 Cb 1.18 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 1vpx h PRO 88 CO 0.61 -0.05 0.51 -0.44 -0.21 0.00 0.00 178.00 178.42 1vpx h ASP 89 N -0.08 0.88 -0.94 -2.05 5.19 -1.94 -1.09 116.42 116.39 1vpx h ASP 89 Ca 0.22 -0.02 0.02 0.00 -0.62 0.00 0.00 57.03 56.62 1vpx h ASP 89 Cb 0.41 -0.22 -0.05 0.00 0.18 0.00 0.00 39.33 39.65 1vpx h ASP 89 CO -0.50 0.64 0.62 1.23 -3.12 0.00 0.00 179.24 178.10 1vpx h GLY 90 N 1.04 1.34 1.33 2.75 0.00 -1.63 0.85 103.07 108.74 1vpx h GLY 90 Ca 0.28 -0.48 -0.14 0.00 0.00 0.00 0.00 47.33 46.99 1vpx h GLY 90 CO -0.06 0.45 -0.36 -2.22 0.00 0.00 0.00 176.54 174.34 1vpx h ILE 91 N 1.23 1.28 -0.65 2.60 1.08 -0.42 -0.72 117.51 121.91 1vpx h ILE 91 Ca 0.36 -1.52 -0.01 0.00 -0.39 0.00 0.00 64.86 63.29 1vpx h ILE 91 Cb -0.08 1.42 -0.03 0.00 -3.07 0.00 0.00 36.82 35.06 1vpx h ILE 91 CO -0.09 0.50 0.36 0.50 -0.69 0.00 0.00 178.15 178.72 1vpx h LYS 92 N 0.62 0.91 -0.83 2.37 3.64 -0.86 -1.89 116.57 120.52 1vpx h LYS 92 Ca 0.06 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 1vpx h LYS 92 Cb 0.90 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 32.50 1vpx h LYS 92 CO 0.08 0.68 0.41 0.00 -2.27 0.00 0.00 179.45 178.36 1vpx h ALA 93 N 1.18 1.07 -0.60 5.00 0.00 -0.52 -2.53 119.26 122.86 1vpx h ALA 93 Ca 0.23 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1vpx h ALA 93 Cb 0.04 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 1vpx h ALA 93 CO -0.04 0.63 0.31 0.28 0.00 0.00 0.00 179.25 180.43 1vpx h VAL 94 N 1.18 1.20 -0.13 0.00 2.07 -0.78 0.15 116.25 119.95 1vpx h VAL 94 Ca 0.29 -0.55 0.04 0.00 0.82 0.00 0.00 66.70 67.30 1vpx h VAL 94 Cb 0.10 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.29 1vpx h VAL 94 CO -0.04 0.23 -0.13 0.50 0.02 0.00 0.00 177.57 178.15 1vpx h LYS 95 N 0.82 -0.15 -0.01 1.57 3.11 -1.15 0.08 116.57 120.83 1vpx h LYS 95 Ca 0.21 0.01 -0.00 0.00 -2.81 0.00 0.00 60.65 58.06 1vpx h LYS 95 Cb 0.09 0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 31.35 1vpx h LYS 95 CO -0.03 -0.10 0.01 1.15 -2.81 0.00 0.00 179.45 177.67 1vpx h THR 96 N -0.15 1.06 -0.46 1.00 2.02 -1.17 -2.79 112.91 112.42 1vpx h THR 96 Ca 0.09 -0.18 -0.13 0.00 0.77 0.00 0.00 66.41 66.96 1vpx h THR 96 Cb 0.28 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1vpx h THR 96 CO -0.22 0.05 -0.24 -0.07 0.37 0.00 0.00 175.52 175.41 1vpx h LEU 97 N -0.06 1.01 -0.73 2.58 3.38 -0.61 -2.85 115.31 118.04 1vpx h LEU 97 Ca 0.00 -0.41 0.03 0.00 0.09 0.00 0.00 57.88 57.60 1vpx h LEU 97 Cb 0.07 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 1vpx h LEU 97 CO -0.00 1.19 0.45 0.77 0.09 0.00 0.00 178.44 180.95 1vpx h SER 98 N 0.82 0.74 0.03 -0.43 4.64 -1.01 -0.64 113.55 117.70 1vpx h SER 98 Ca 0.10 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1vpx h SER 98 Cb 0.82 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.75 1vpx h SER 98 CO 0.07 0.51 -0.01 0.00 -0.87 0.00 0.00 176.83 176.53 1vpx h ALA 99 N 1.32 1.69 -0.51 5.18 0.00 -1.34 -1.74 119.26 123.86 1vpx h ALA 99 Ca 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1vpx h ALA 99 Cb 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1vpx h ALA 99 CO -0.12 0.02 0.00 0.39 0.00 0.00 0.00 179.25 179.54 1vpx n GLU 100 N -4.11 2.20 -1.21 0.00 1.02 -0.50 -4.94 120.64 113.10 1vpx n GLU 100 Ca -0.03 -1.86 -0.07 0.00 -0.02 0.00 0.00 57.16 55.18 1vpx n GLU 100 Cb 0.10 -1.41 -0.03 0.00 -0.02 0.00 0.00 31.44 30.08 1vpx n GLU 100 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vpx n GLY 101 N 1.33 0.92 3.66 0.62 0.00 -0.65 -5.00 105.19 106.07 1vpx n GLY 101 Ca 0.17 -0.57 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 1vpx n GLY 101 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vpx s ILE 102 N -2.21 5.30 0.34 -0.61 1.01 -0.37 -5.01 121.20 119.65 1vpx s ILE 102 Ca 0.00 0.36 -0.26 0.00 0.00 0.00 0.00 60.65 60.75 1vpx s ILE 102 Cb 0.00 -3.58 -0.10 0.00 0.01 0.00 0.00 42.46 38.80 1vpx s ILE 102 CO 0.00 0.31 1.00 -0.54 0.00 0.00 0.00 174.94 175.70 1vpx s LYS 103 N 1.17 4.47 0.08 2.79 1.02 -1.26 -3.75 119.74 124.26 1vpx s LYS 103 Ca 0.11 1.45 0.04 0.00 0.02 0.00 0.00 55.97 57.60 1vpx s LYS 103 Cb -0.14 -2.79 -0.03 0.00 -0.52 0.00 0.00 37.83 34.35 1vpx s LYS 103 CO 0.06 0.15 -0.12 0.95 -0.92 0.00 0.00 175.35 175.47 1vpx s THR 104 N -1.56 0.99 -0.25 2.17 -4.23 -1.26 -1.63 115.64 109.88 1vpx s THR 104 Ca 0.51 -1.40 -0.00 0.00 -1.18 0.00 0.00 61.69 59.62 1vpx s THR 104 Cb -0.22 -1.12 0.07 0.00 1.34 0.00 0.00 72.50 72.58 1vpx s THR 104 CO 0.27 -0.36 0.02 0.21 -0.54 0.00 0.00 174.62 174.22 1vpx s ASN 105 N -1.98 3.70 -0.19 3.99 3.84 0.11 -1.02 114.94 123.38 1vpx s ASN 105 Ca -0.00 -1.26 -0.26 0.00 0.21 0.00 0.00 52.86 51.54 1vpx s ASN 105 Cb -0.08 -0.97 -0.01 0.00 -0.55 0.00 0.00 41.25 39.65 1vpx s ASN 105 CO 0.01 -0.31 0.90 -0.69 -2.79 0.00 0.00 177.10 174.22 1vpx s VAL 106 N 1.55 4.81 0.46 -5.21 1.01 -0.16 -0.57 120.40 122.30 1vpx s VAL 106 Ca 0.01 1.76 0.05 0.00 0.00 0.00 0.00 61.98 63.79 1vpx s VAL 106 Cb -0.18 -4.19 -0.03 0.00 0.00 0.00 0.00 36.38 31.97 1vpx s VAL 106 CO -0.12 -0.05 0.11 0.28 0.00 0.00 0.00 175.10 175.33 1vpx s THR 107 N 2.55 1.77 -1.30 3.92 -1.32 0.10 -0.70 115.64 120.66 1vpx s THR 107 Ca 0.40 -1.84 -0.03 0.00 -1.21 0.00 0.00 61.69 59.01 1vpx s THR 107 Cb -0.16 -2.61 0.01 0.00 -1.51 0.00 0.00 72.50 68.23 1vpx s THR 107 CO 0.10 0.00 0.88 0.18 -2.21 0.00 0.00 174.62 173.57 1vpx n LEU 108 N -1.25 -3.37 -4.63 9.08 4.77 -1.25 -1.23 117.00 119.11 1vpx n LEU 108 Ca -0.08 -0.72 -0.38 0.00 -0.03 0.00 0.00 56.01 54.80 1vpx n LEU 108 Cb 0.66 -2.84 -0.09 0.00 -2.33 0.00 0.00 43.42 38.81 1vpx n LEU 108 CO 0.43 0.43 -0.05 -0.69 -1.33 0.00 0.00 177.39 176.18 1vpx s VAL 109 N -3.49 5.26 0.00 4.08 1.01 -1.20 -4.51 120.40 121.55 1vpx s VAL 109 Ca 0.14 0.39 0.00 0.00 0.00 0.00 0.00 61.98 62.51 1vpx s VAL 109 Cb -0.07 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.71 1vpx s VAL 109 CO 0.78 0.25 0.62 0.49 0.00 0.00 0.00 175.10 177.24 1vpx n PHE 110 N 4.81 0.00 -3.80 5.22 3.72 -1.26 -1.32 117.46 124.83 1vpx n PHE 110 Ca -0.12 -0.19 -0.12 0.00 -0.05 0.00 0.00 57.45 56.97 1vpx n PHE 110 Cb 0.51 -0.02 -0.09 0.00 -0.94 0.00 0.00 39.48 38.95 1vpx n PHE 110 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1vpx s SER 111 N -0.37 -0.11 0.55 4.37 1.04 -1.26 -5.03 113.70 112.89 1vpx s SER 111 Ca 0.00 -0.03 0.22 0.00 0.48 0.00 0.00 55.95 56.61 1vpx s SER 111 Cb 0.00 0.27 1.47 0.00 0.10 0.00 0.00 66.02 67.86 1vpx s SER 111 CO 0.00 -0.43 2.17 1.55 0.98 0.00 0.00 173.24 177.51 1vpx h PRO 112 N 3.98 0.00 -0.33 4.02 0.13 -1.96 -2.68 132.00 135.16 1vpx h PRO 112 Ca -0.30 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.81 1vpx h PRO 112 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1vpx h PRO 112 CO 0.40 0.00 0.13 0.00 -0.23 0.00 0.00 178.00 178.31 1vpx h ALA 113 N 1.96 0.43 -0.31 -0.56 0.00 -2.00 -1.78 119.26 117.01 1vpx h ALA 113 Ca 0.03 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.84 1vpx h ALA 113 Cb 0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1vpx h ALA 113 CO -0.00 0.04 0.10 1.96 0.00 0.00 0.00 179.25 181.35 1vpx h GLN 114 N 0.39 0.23 -0.51 0.00 4.20 -1.93 -2.70 115.11 114.78 1vpx h GLN 114 Ca 0.11 -0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.85 1vpx h GLN 114 Cb 0.19 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.89 1vpx h GLN 114 CO -0.01 0.15 0.34 0.00 -0.67 0.00 0.00 178.83 178.64 1vpx h ALA 115 N 1.20 1.79 -0.03 3.87 0.00 -1.21 -1.02 119.26 123.86 1vpx h ALA 115 Ca 0.14 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1vpx h ALA 115 Cb 0.11 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1vpx h ALA 115 CO -0.15 0.14 0.01 0.82 0.00 0.00 0.00 179.25 180.07 1vpx h ILE 116 N 0.55 1.20 -0.52 0.00 2.04 -1.05 -2.33 117.51 117.40 1vpx h ILE 116 Ca 0.21 -0.61 0.04 0.00 1.00 0.00 0.00 64.86 65.50 1vpx h ILE 116 Cb 0.15 1.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.75 1vpx h ILE 116 CO -0.06 0.16 0.28 -0.07 0.00 0.00 0.00 178.15 178.47 1vpx h LEU 117 N -0.19 0.42 -0.30 1.44 3.38 -1.05 0.13 115.31 119.13 1vpx h LEU 117 Ca 0.01 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.04 1vpx h LEU 117 Cb 0.26 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 1vpx h LEU 117 CO 0.00 0.29 0.07 0.00 0.09 0.00 0.00 178.44 178.89 1vpx h ALA 118 N 1.27 0.32 -0.48 1.53 0.00 -1.16 0.32 119.26 121.06 1vpx h ALA 118 Ca 0.22 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 1vpx h ALA 118 Cb 0.10 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1vpx h ALA 118 CO -0.14 -0.34 0.15 0.00 0.00 0.00 0.00 179.25 178.92 1vpx h ALA 119 N 1.22 0.62 -0.32 0.00 0.00 -1.03 -2.28 119.26 117.48 1vpx h ALA 119 Ca 0.14 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1vpx h ALA 119 Cb 0.14 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1vpx h ALA 119 CO -0.18 0.28 -0.03 0.87 0.00 0.00 0.00 179.25 180.19 1vpx h LYS 120 N 0.63 0.49 0.00 0.00 1.57 -0.48 -1.03 116.57 117.76 1vpx h LYS 120 Ca 0.15 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1vpx h LYS 120 Cb 0.27 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1vpx h LYS 120 CO -0.00 0.54 0.00 0.00 -0.57 0.00 0.00 179.45 179.42 1vpx h ALA 121 N 1.51 1.00 0.00 3.86 0.00 -0.82 -3.47 119.26 121.34 1vpx h ALA 121 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1vpx h ALA 121 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1vpx h ALA 121 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1vpx n GLY 122 N 0.19 1.60 3.74 0.00 0.00 -0.39 -3.62 105.19 106.72 1vpx n GLY 122 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 1vpx n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vpx n ALA 123 N -1.30 1.80 0.01 4.61 0.00 -0.87 -4.85 120.51 119.91 1vpx n ALA 123 Ca 0.00 0.24 -0.19 0.00 0.00 0.00 0.00 53.44 53.49 1vpx n ALA 123 Cb 0.00 -2.36 -0.09 0.00 0.00 0.00 0.00 19.45 17.00 1vpx n ALA 123 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1vpx h THR 124 N 2.13 1.31 -3.88 0.00 2.02 -1.71 -3.36 112.91 109.42 1vpx h THR 124 Ca -0.50 -2.09 -0.30 0.00 0.77 0.00 0.00 66.41 64.30 1vpx h THR 124 Cb 1.28 2.27 -0.19 0.00 -1.74 0.00 0.00 68.15 69.77 1vpx h THR 124 CO 0.60 0.64 -0.73 -0.31 0.37 0.00 0.00 175.52 176.09 1vpx s TYR 125 N -3.48 0.88 0.06 3.16 2.02 -0.19 -1.27 117.35 118.54 1vpx s TYR 125 Ca -0.11 -0.60 0.09 0.00 -0.37 0.00 0.00 57.07 56.08 1vpx s TYR 125 Cb 0.07 -0.50 -0.03 0.00 -0.40 0.00 0.00 41.96 41.09 1vpx s TYR 125 CO 0.89 -0.05 -0.25 0.14 -1.57 0.00 0.00 175.55 174.71 1vpx s VAL 126 N -2.00 2.06 -0.48 0.71 -7.23 -0.12 -0.99 120.40 112.35 1vpx s VAL 126 Ca -0.02 -1.43 0.03 0.00 -1.81 0.00 0.00 61.98 58.75 1vpx s VAL 126 Cb -0.06 -1.78 0.14 0.00 0.56 0.00 0.00 36.38 35.24 1vpx s VAL 126 CO -0.00 0.27 0.27 -0.44 -0.31 0.00 0.00 175.10 174.88 1vpx s SER 127 N -1.41 3.91 0.20 4.85 0.01 0.13 -0.39 113.70 120.99 1vpx s SER 127 Ca 0.11 -2.86 -0.30 0.00 1.31 0.00 0.00 55.95 54.21 1vpx s SER 127 Cb -0.10 -1.28 -0.08 0.00 0.21 0.00 0.00 66.02 64.77 1vpx s SER 127 CO 0.03 -0.24 1.23 -2.84 0.41 0.00 0.00 173.24 171.83 1vpx s PRO 128 N -0.01 4.46 -0.88 12.44 0.02 -1.22 -3.25 135.00 146.57 1vpx s PRO 128 Ca 0.18 1.93 -0.16 0.00 0.02 0.00 0.00 61.00 62.97 1vpx s PRO 128 Cb -0.23 -3.22 0.18 0.00 0.02 0.00 0.00 34.50 31.25 1vpx s PRO 128 CO -0.01 -0.12 0.95 -0.06 -0.33 0.00 0.00 177.00 177.42 1vpx s PHE 129 N -0.09 3.45 0.02 6.54 0.40 -0.43 -1.48 117.98 126.39 1vpx s PHE 129 Ca 0.53 -1.71 -0.28 0.00 -0.60 0.00 0.00 56.93 54.88 1vpx s PHE 129 Cb -0.34 -4.05 -0.16 0.00 0.51 0.00 0.00 43.02 38.99 1vpx s PHE 129 CO 0.38 -1.24 1.19 0.28 0.70 0.00 0.00 175.22 176.54 1vpx h VAL 130 N 5.28 0.14 -0.83 -0.44 2.07 -1.48 -3.04 116.25 117.96 1vpx h VAL 130 Ca 0.13 -0.31 0.05 0.00 0.82 0.00 0.00 66.70 67.40 1vpx h VAL 130 Cb 1.03 0.19 -0.05 0.00 -1.52 0.00 0.00 31.29 30.94 1vpx h VAL 130 CO 0.93 0.02 0.54 1.23 0.02 0.00 0.00 177.57 180.31 1vpx h GLY 131 N -1.15 1.17 1.67 2.17 0.00 -1.01 -0.54 103.07 105.38 1vpx h GLY 131 Ca -0.09 -0.39 -0.13 0.00 0.00 0.00 0.00 47.33 46.72 1vpx h GLY 131 CO 0.15 0.31 -0.45 3.21 0.00 0.00 0.00 176.54 179.76 1vpx h ARG 132 N 0.98 0.36 -0.29 4.80 3.08 -1.78 -1.93 114.38 119.60 1vpx h ARG 132 Ca 0.34 -0.19 -0.10 0.00 0.07 0.00 0.00 59.98 60.10 1vpx h ARG 132 Cb 0.12 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1vpx h ARG 132 CO -0.11 0.75 -0.21 0.52 -1.07 0.00 0.00 179.97 179.85 1vpx h MET 133 N 0.30 0.66 -0.79 0.04 2.86 -1.30 -3.17 114.93 113.53 1vpx h MET 133 Ca 0.02 -0.32 0.17 0.00 -2.06 0.00 0.00 59.70 57.51 1vpx h MET 133 Cb 0.92 -0.00 -0.11 0.00 0.06 0.00 0.00 31.60 32.47 1vpx h MET 133 CO 0.08 0.92 0.29 -0.44 1.06 0.00 0.00 176.91 178.81 1vpx h ASP 134 N 0.41 0.22 1.04 1.22 5.19 -0.86 -1.27 116.42 122.36 1vpx h ASP 134 Ca 0.06 0.13 0.00 0.00 -0.62 0.00 0.00 57.03 56.60 1vpx h ASP 134 Cb 0.75 0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.39 1vpx h ASP 134 CO 0.06 0.04 0.00 0.44 -3.12 0.00 0.00 179.24 176.66 1vpx h ASP 135 N 0.39 0.00 0.34 6.45 5.19 -1.33 0.14 116.42 127.60 1vpx h ASP 135 Ca 0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.86 1vpx h ASP 135 Cb 0.76 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.27 1vpx h ASP 135 CO -0.47 0.00 -0.04 0.18 -3.12 0.00 0.00 179.24 175.80 1vpx n LEU 136 N -2.79 0.21 -1.51 1.55 4.77 -0.49 -4.93 117.00 113.81 1vpx n LEU 136 Ca 0.02 0.10 -0.18 0.00 -0.03 0.00 0.00 56.01 55.91 1vpx n LEU 136 Cb 0.31 -0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 41.16 1vpx n LEU 136 CO 0.26 0.04 -0.18 -1.20 -1.33 0.00 0.00 177.39 174.97 1vpx n SER 137 N -1.05 -5.16 -1.27 -1.43 7.64 0.50 -4.89 113.62 107.97 1vpx n SER 137 Ca 0.17 0.34 0.10 0.00 1.01 0.00 0.00 58.87 60.49 1vpx n SER 137 Cb 0.23 -4.22 0.30 0.00 -1.01 0.00 0.00 64.21 59.50 1vpx n SER 137 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1vpx n ASN 138 N -0.99 3.93 -2.39 6.43 5.03 -1.15 -5.04 115.26 121.09 1vpx n ASN 138 Ca -0.19 -2.09 -0.00 0.00 0.87 0.00 0.00 54.58 53.17 1vpx n ASN 138 Cb 0.60 -0.46 0.00 0.00 -1.02 0.00 0.00 39.78 38.90 1vpx n ASN 138 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1vpx n ASP 139 N 1.34 -6.40 0.16 6.41 -0.08 -1.25 -4.84 116.55 111.90 1vpx n ASP 139 Ca 0.23 1.01 0.01 0.00 -1.51 0.00 0.00 54.79 54.53 1vpx n ASP 139 Cb 0.64 -4.17 0.24 0.00 2.34 0.00 0.00 41.12 40.17 1vpx n ASP 139 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1vpx h GLY 140 N 2.18 0.00 1.38 0.27 0.00 -1.77 -2.94 103.07 102.20 1vpx h GLY 140 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 1vpx h GLY 140 CO 0.08 0.00 -0.20 -0.33 0.00 0.00 0.00 176.54 176.09 1vpx h MET 141 N 0.00 0.72 -0.24 4.80 2.86 -1.93 -1.58 114.93 119.56 1vpx h MET 141 Ca -0.01 -0.27 -0.16 0.00 -2.06 0.00 0.00 59.70 57.20 1vpx h MET 141 Cb 0.99 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.61 1vpx h MET 141 CO 0.07 0.87 -0.50 0.07 1.06 0.00 0.00 176.91 178.48 1vpx h ARG 142 N 0.64 0.67 -0.65 1.72 0.11 -1.90 -0.56 114.38 114.41 1vpx h ARG 142 Ca 0.09 -0.40 -0.04 0.00 0.10 0.00 0.00 59.98 59.73 1vpx h ARG 142 Cb 0.68 0.04 -0.03 0.00 1.11 0.00 0.00 29.97 31.77 1vpx h ARG 142 CO 0.05 1.02 0.24 0.00 0.10 0.00 0.00 179.97 181.37 1vpx h MET 143 N 0.53 0.99 -0.48 0.08 -0.00 -1.38 -1.22 114.93 113.43 1vpx h MET 143 Ca 0.02 -0.19 -0.01 0.00 -0.00 0.00 0.00 59.70 59.52 1vpx h MET 143 Cb 1.05 -0.15 -0.02 0.00 -0.00 0.00 0.00 31.60 32.48 1vpx h MET 143 CO 0.10 0.84 0.27 1.25 -0.00 0.00 0.00 176.91 179.38 1vpx h LEU 144 N 0.92 0.60 -1.60 -0.10 5.85 -1.17 -2.31 115.31 117.51 1vpx h LEU 144 Ca 0.21 -0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.89 1vpx h LEU 144 Cb 0.24 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1vpx h LEU 144 CO -0.01 0.51 0.33 1.23 -0.34 0.00 0.00 178.44 180.15 1vpx h GLY 145 N 0.64 0.60 1.28 3.75 0.00 -0.68 -0.40 103.07 108.27 1vpx h GLY 145 Ca 0.17 -0.21 -0.14 0.00 0.00 0.00 0.00 47.33 47.15 1vpx h GLY 145 CO -0.03 0.18 -0.35 0.83 0.00 0.00 0.00 176.54 177.17 1vpx h GLU 146 N 0.52 0.80 -0.17 4.80 5.08 -0.82 -1.58 114.58 123.21 1vpx h GLU 146 Ca 0.20 -0.39 -0.10 0.00 -1.00 0.00 0.00 59.36 58.07 1vpx h GLU 146 Cb 0.15 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 1vpx h GLU 146 CO -0.05 1.02 -0.28 0.82 -1.00 0.00 0.00 179.01 179.52 1vpx h ILE 147 N 0.66 1.35 -0.57 3.13 2.04 -0.83 -1.13 117.51 122.16 1vpx h ILE 147 Ca 0.06 -1.51 0.07 0.00 1.00 0.00 0.00 64.86 64.49 1vpx h ILE 147 Cb 0.90 1.91 -0.06 0.00 -0.74 0.00 0.00 36.82 38.82 1vpx h ILE 147 CO 0.08 0.46 0.24 0.58 0.00 0.00 0.00 178.15 179.51 1vpx h VAL 148 N 0.14 0.85 -0.46 1.67 2.07 -1.08 0.26 116.25 119.70 1vpx h VAL 148 Ca 0.01 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 1vpx h VAL 148 Cb 0.86 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 1vpx h VAL 148 CO 0.06 0.08 0.23 -0.08 0.02 0.00 0.00 177.57 177.88 1vpx h GLU 149 N 0.45 0.66 -0.46 1.57 4.57 -1.19 0.27 114.58 120.45 1vpx h GLU 149 Ca 0.27 -0.09 -0.04 0.00 -1.18 0.00 0.00 59.36 58.32 1vpx h GLU 149 Cb 0.27 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.73 1vpx h GLU 149 CO -0.24 0.56 0.12 0.82 -1.18 0.00 0.00 179.01 179.08 1vpx h ILE 150 N 0.60 1.23 -0.16 2.32 2.04 -0.69 -1.24 117.51 121.61 1vpx h ILE 150 Ca 0.16 -0.80 -0.11 0.00 1.00 0.00 0.00 64.86 65.10 1vpx h ILE 150 Cb 0.11 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 1vpx h ILE 150 CO -0.02 0.29 -0.39 1.88 0.00 0.00 0.00 178.15 179.90 1vpx h TYR 151 N 0.62 0.41 -0.72 1.37 -1.99 -0.84 -2.42 116.97 113.39 1vpx h TYR 151 Ca 0.15 -0.11 -0.06 0.00 2.00 0.00 0.00 58.73 60.70 1vpx h TYR 151 Cb 0.31 -0.09 -0.03 0.00 2.00 0.00 0.00 36.73 38.92 1vpx h TYR 151 CO 0.02 0.69 0.21 -0.91 -0.00 0.00 0.00 178.16 178.17 1vpx h ASN 152 N 0.29 1.07 -0.60 3.88 2.35 -0.74 0.06 115.58 121.89 1vpx h ASN 152 Ca 0.03 -0.22 0.02 0.00 -0.55 0.00 0.00 56.30 55.58 1vpx h ASN 152 Cb 0.83 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.88 1vpx h ASN 152 CO 0.07 1.00 0.40 0.78 -1.65 0.00 0.00 177.43 178.03 1vpx h ASN 153 N 1.08 0.64 -0.00 5.81 4.21 -0.74 -3.25 115.58 123.33 1vpx h ASN 153 Ca 0.23 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.73 1vpx h ASN 153 Cb 0.33 -0.15 0.00 0.00 -1.12 0.00 0.00 38.32 37.38 1vpx h ASN 153 CO -0.00 0.45 -0.12 -1.22 -1.29 0.00 0.00 177.43 175.25 1vpx n TYR 154 N -4.46 0.00 -3.92 1.19 4.01 -1.08 -5.02 117.16 107.88 1vpx n TYR 154 Ca 0.07 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.52 1vpx n TYR 154 Cb 0.10 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.14 1vpx n TYR 154 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1vpx n GLY 155 N 0.73 -0.41 3.65 2.72 0.00 0.00 -4.92 105.19 106.97 1vpx n GLY 155 Ca 0.02 0.17 -0.45 0.00 0.00 0.00 0.00 46.02 45.75 1vpx n GLY 155 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1vpx n PHE 156 N -4.52 1.97 0.21 1.61 3.72 -1.23 -4.88 117.46 114.34 1vpx n PHE 156 Ca -0.07 0.51 0.07 0.00 -0.05 0.00 0.00 57.45 57.91 1vpx n PHE 156 Cb 0.57 -2.41 0.46 0.00 -0.94 0.00 0.00 39.48 37.17 1vpx n PHE 156 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1vpx h GLU 157 N 3.65 0.00 -6.32 -1.08 3.07 -1.91 -3.44 114.58 108.55 1vpx h GLU 157 Ca -0.44 0.00 -0.65 0.00 -0.50 0.00 0.00 59.36 57.76 1vpx h GLU 157 Cb 1.29 0.00 0.08 0.00 -0.84 0.00 0.00 28.75 29.28 1vpx h GLU 157 CO 0.72 0.29 0.26 2.41 -1.40 0.00 0.00 179.01 181.29 1vpx n THR 158 N -3.71 0.83 -3.92 1.13 -1.04 -1.26 -4.98 114.28 101.33 1vpx n THR 158 Ca -0.01 -0.21 -0.34 0.00 -2.04 0.00 0.00 64.05 61.45 1vpx n THR 158 Cb 0.40 -0.81 -0.05 0.00 -1.82 0.00 0.00 70.33 68.05 1vpx n THR 158 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1vpx s GLU 159 N -0.32 3.41 -0.25 -2.82 2.02 -0.39 -4.94 118.70 115.41 1vpx s GLU 159 Ca 0.74 -0.31 -0.15 0.00 0.02 0.00 0.00 54.97 55.27 1vpx s GLU 159 Cb -0.87 -3.09 -0.04 0.00 0.10 0.00 0.00 34.13 30.23 1vpx s GLU 159 CO 0.52 0.69 0.38 0.42 0.02 0.00 0.00 175.26 177.28 1vpx s ILE 160 N -1.28 5.19 -0.45 -1.63 1.01 -1.26 -0.94 121.20 121.83 1vpx s ILE 160 Ca 0.26 0.61 -0.13 0.00 0.00 0.00 0.00 60.65 61.38 1vpx s ILE 160 Cb -0.12 -3.70 0.08 0.00 0.01 0.00 0.00 42.46 38.72 1vpx s ILE 160 CO 0.17 0.19 0.34 -0.63 0.00 0.00 0.00 174.94 175.01 1vpx s ILE 161 N 1.79 4.80 -0.16 2.92 1.01 0.47 -1.26 121.20 130.76 1vpx s ILE 161 Ca 0.16 -1.21 -0.29 0.00 0.00 0.00 0.00 60.65 59.31 1vpx s ILE 161 Cb -0.15 -3.90 -0.05 0.00 0.01 0.00 0.00 42.46 38.37 1vpx s ILE 161 CO 0.09 -0.55 2.03 0.00 0.00 0.00 0.00 174.94 176.51 1vpx s ALA 162 N 1.55 3.04 0.52 9.38 0.00 0.28 -3.40 121.76 133.13 1vpx s ALA 162 Ca 0.04 0.84 0.03 0.00 0.00 0.00 0.00 51.96 52.86 1vpx s ALA 162 Cb -0.24 -3.98 0.00 0.00 0.00 0.00 0.00 23.12 18.91 1vpx s ALA 162 CO 0.05 -2.34 0.16 0.00 0.00 0.00 0.00 175.76 173.63 1vpx s ALA 163 N 6.73 4.19 -1.45 0.00 0.00 -0.55 -1.78 121.76 128.90 1vpx s ALA 163 Ca 0.91 -0.83 -0.07 0.00 0.00 0.00 0.00 51.96 51.97 1vpx s ALA 163 Cb -0.33 -0.27 0.05 0.00 0.00 0.00 0.00 23.12 22.56 1vpx s ALA 163 CO 0.36 -0.19 0.77 0.45 0.00 0.00 0.00 175.76 177.16 1vpx n SER 164 N -1.44 -2.63 -4.72 0.00 2.88 -1.26 -1.62 113.62 104.82 1vpx n SER 164 Ca -0.12 -0.85 -0.40 0.00 -1.33 0.00 0.00 58.87 56.18 1vpx n SER 164 Cb 0.66 -3.72 -0.05 0.00 -0.75 0.00 0.00 64.21 60.36 1vpx n SER 164 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1vpx s ILE 165 N -3.54 5.02 -0.00 2.46 -1.09 -1.26 -0.60 121.20 122.19 1vpx s ILE 165 Ca 0.32 1.49 0.00 0.00 -2.23 0.00 0.00 60.65 60.24 1vpx s ILE 165 Cb -0.17 -4.06 -0.01 0.00 -1.58 0.00 0.00 42.46 36.65 1vpx s ILE 165 CO 0.84 0.25 0.01 0.54 -1.23 0.00 0.00 174.94 175.35 1vpx n ARG 166 N 3.73 0.61 -3.59 2.79 5.12 -1.26 -4.48 116.66 119.58 1vpx n ARG 166 Ca -0.01 -0.00 -0.08 0.00 -1.93 0.00 0.00 57.85 55.82 1vpx n ARG 166 Cb 0.51 -0.97 -0.02 0.00 -1.16 0.00 0.00 32.46 30.83 1vpx n ARG 166 CO 0.00 0.00 0.00 -3.38 -1.93 0.00 0.00 177.63 172.32 1vpx s HIS 167 N -1.94 -0.34 0.32 -1.55 -3.43 -1.26 -4.93 115.29 102.17 1vpx s HIS 167 Ca -0.00 0.09 0.08 0.00 -0.80 0.00 0.00 55.06 54.42 1vpx s HIS 167 Cb 0.00 0.60 0.79 0.00 -1.43 0.00 0.00 32.58 32.54 1vpx s HIS 167 CO 0.02 -0.83 1.80 -1.35 -2.00 0.00 0.00 174.74 172.38 1vpx h PRO 168 N 2.00 0.70 -0.26 -0.38 0.11 -1.98 -2.16 132.00 130.03 1vpx h PRO 168 Ca -0.26 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.76 1vpx h PRO 168 Cb 1.26 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1vpx h PRO 168 CO 0.31 0.46 -0.07 0.52 -0.21 0.00 0.00 178.00 179.01 1vpx h MET 169 N 0.72 0.41 -0.70 1.05 2.86 -1.99 -0.93 114.93 116.35 1vpx h MET 169 Ca 0.55 -0.10 0.11 0.00 -2.06 0.00 0.00 59.70 58.20 1vpx h MET 169 Cb 0.92 -0.06 -0.08 0.00 0.06 0.00 0.00 31.60 32.45 1vpx h MET 169 CO -0.33 0.50 0.32 0.45 1.06 0.00 0.00 176.91 178.91 1vpx h HIS 170 N 0.39 0.56 -0.23 -0.22 3.86 -1.81 0.32 115.15 118.03 1vpx h HIS 170 Ca 0.08 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.24 1vpx h HIS 170 Cb 0.37 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 28.69 1vpx h HIS 170 CO 0.01 0.16 -0.18 0.28 0.86 0.00 0.00 177.93 179.06 1vpx h VAL 171 N 0.53 1.32 -0.27 2.45 2.07 -1.24 -1.38 116.25 119.73 1vpx h VAL 171 Ca 0.36 -1.32 -0.02 0.00 0.82 0.00 0.00 66.70 66.53 1vpx h VAL 171 Cb 0.43 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1vpx h VAL 171 CO -0.31 0.41 0.08 0.58 0.02 0.00 0.00 177.57 178.35 1vpx h VAL 172 N 0.22 1.20 -0.36 2.57 2.07 -1.06 0.05 116.25 120.94 1vpx h VAL 172 Ca 0.04 -0.66 -0.10 0.00 0.82 0.00 0.00 66.70 66.81 1vpx h VAL 172 Cb 0.72 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 1vpx h VAL 172 CO 0.05 0.22 -0.18 -0.33 0.02 0.00 0.00 177.57 177.34 1vpx h GLU 173 N 0.27 0.67 -0.62 1.57 5.08 -0.95 -0.22 114.58 120.37 1vpx h GLU 173 Ca 0.09 -0.24 -0.08 0.00 -1.00 0.00 0.00 59.36 58.13 1vpx h GLU 173 Cb 0.25 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1vpx h GLU 173 CO -0.00 0.81 0.08 0.00 -1.00 0.00 0.00 179.01 178.90 1vpx h ALA 174 N 1.21 0.97 -0.67 3.43 0.00 -1.08 -2.45 119.26 120.67 1vpx h ALA 174 Ca 0.09 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1vpx h ALA 174 Cb 0.64 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1vpx h ALA 174 CO 0.05 0.64 0.09 0.00 0.00 0.00 0.00 179.25 180.03 1vpx h ALA 175 N 1.12 0.90 0.00 0.00 0.00 -0.55 -1.87 119.26 118.85 1vpx h ALA 175 Ca 0.19 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1vpx h ALA 175 Cb 0.44 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1vpx h ALA 175 CO 0.01 0.67 -0.32 -0.07 0.00 0.00 0.00 179.25 179.54 1vpx h LEU 176 N 1.04 0.00 0.00 0.00 3.38 -0.87 -1.81 115.31 117.04 1vpx h LEU 176 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1vpx h LEU 176 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1vpx h LEU 176 CO 0.02 0.32 -0.47 1.15 0.09 0.00 0.00 178.44 179.55 1vpx n MET 177 N -4.09 0.06 -2.32 1.13 0.00 -0.94 -4.98 117.12 105.99 1vpx n MET 177 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1vpx n MET 177 Cb 0.37 -1.54 0.00 0.00 0.00 0.00 0.00 33.22 32.05 1vpx n MET 177 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1vpx n GLY 178 N 1.47 0.83 3.74 3.17 0.00 -0.68 -4.99 105.19 108.73 1vpx n GLY 178 Ca 0.05 -0.71 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 1vpx n GLY 178 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vpx s VAL 179 N -2.74 2.12 0.03 1.61 1.01 -0.76 -4.93 120.40 116.73 1vpx s VAL 179 Ca 0.00 0.08 -0.22 0.00 0.00 0.00 0.00 61.98 61.84 1vpx s VAL 179 Cb 0.00 -3.03 -0.15 0.00 0.00 0.00 0.00 36.38 33.20 1vpx s VAL 179 CO 0.00 -0.01 1.36 0.44 0.00 0.00 0.00 175.10 176.88 1vpx h ASP 180 N 0.84 0.28 -3.96 3.32 3.32 -1.89 -3.46 116.42 114.87 1vpx h ASP 180 Ca -0.51 -0.45 -0.21 0.00 0.02 0.00 0.00 57.03 55.88 1vpx h ASP 180 Cb 1.32 -0.08 -0.27 0.00 0.22 0.00 0.00 39.33 40.53 1vpx h ASP 180 CO 0.54 0.67 -0.69 -0.63 -1.72 0.00 0.00 179.24 177.42 1vpx s ILE 181 N -4.42 0.02 -0.15 0.35 1.01 -0.39 -1.70 121.20 115.92 1vpx s ILE 181 Ca -0.14 -0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.36 1vpx s ILE 181 Cb 0.05 -0.08 0.02 0.00 0.01 0.00 0.00 42.46 42.45 1vpx s ILE 181 CO 0.73 -0.09 -0.19 0.54 0.00 0.00 0.00 174.94 175.93 1vpx s VAL 182 N -0.26 1.87 -0.19 2.92 0.11 -0.53 -0.55 120.40 123.77 1vpx s VAL 182 Ca -0.03 -0.85 -0.08 0.00 -2.93 0.00 0.00 61.98 58.10 1vpx s VAL 182 Cb -0.02 -1.69 -0.04 0.00 -1.53 0.00 0.00 36.38 33.10 1vpx s VAL 182 CO -0.00 0.51 0.08 0.28 -3.33 0.00 0.00 175.10 172.64 1vpx s THR 183 N 1.09 4.88 0.04 5.04 -1.32 -0.73 -1.65 115.64 123.00 1vpx s THR 183 Ca -0.02 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.43 1vpx s THR 183 Cb -0.14 -3.21 -0.02 0.00 -1.51 0.00 0.00 72.50 67.61 1vpx s THR 183 CO -0.06 0.44 0.04 0.00 -2.21 0.00 0.00 174.62 172.83 1vpx s MET 184 N 0.47 0.57 0.70 7.08 0.23 -0.78 -4.25 119.30 123.32 1vpx s MET 184 Ca 0.04 -0.90 -0.16 0.00 -1.03 0.00 0.00 55.69 53.64 1vpx s MET 184 Cb -0.12 0.21 0.02 0.00 -1.53 0.00 0.00 34.83 33.41 1vpx s MET 184 CO 0.00 -0.13 1.23 -2.14 -2.03 0.00 0.00 175.02 171.95 1vpx s PRO 185 N -2.95 2.27 0.24 3.16 0.02 -1.26 -0.53 135.00 135.94 1vpx s PRO 185 Ca -0.02 1.83 -0.06 0.00 0.02 0.00 0.00 61.00 62.77 1vpx s PRO 185 Cb 0.01 -1.84 0.33 0.00 0.02 0.00 0.00 34.50 33.01 1vpx s PRO 185 CO -0.06 -1.75 1.84 0.35 -0.33 0.00 0.00 177.00 177.05 1vpx h PHE 186 N -0.04 0.94 -0.95 6.54 3.57 -1.96 -1.67 116.94 123.35 1vpx h PHE 186 Ca -0.49 0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.18 1vpx h PHE 186 Cb 1.30 -0.30 -0.08 0.00 2.79 0.00 0.00 35.95 39.67 1vpx h PHE 186 CO 0.46 0.46 0.60 0.00 -2.23 0.00 0.00 178.31 177.61 1vpx h ALA 187 N 1.40 1.68 -0.30 2.41 0.00 -1.97 0.27 119.26 122.76 1vpx h ALA 187 Ca 0.37 0.02 -0.18 0.00 0.00 0.00 0.00 54.91 55.12 1vpx h ALA 187 Cb 0.19 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1vpx h ALA 187 CO -0.18 0.06 -0.51 0.28 0.00 0.00 0.00 179.25 178.91 1vpx h VAL 188 N 0.83 1.28 -0.27 0.00 2.07 -1.68 -2.96 116.25 115.53 1vpx h VAL 188 Ca 0.48 -1.69 0.03 0.00 0.82 0.00 0.00 66.70 66.34 1vpx h VAL 188 Cb 0.63 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.97 1vpx h VAL 188 CO -0.25 0.55 0.08 0.25 0.02 0.00 0.00 177.57 178.22 1vpx h LEU 189 N 0.67 0.07 -0.64 2.57 5.85 -0.69 -2.30 115.31 120.83 1vpx h LEU 189 Ca 0.02 0.03 0.13 0.00 0.84 0.00 0.00 57.88 58.91 1vpx h LEU 189 Cb 1.11 0.03 -0.10 0.00 0.37 0.00 0.00 40.66 42.07 1vpx h LEU 189 CO 0.12 0.07 0.07 -0.33 -0.34 0.00 0.00 178.44 178.03 1vpx h GLU 190 N 0.19 0.18 -0.14 1.25 5.08 -1.02 -1.83 114.58 118.28 1vpx h GLU 190 Ca 0.12 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 1vpx h GLU 190 Cb 0.10 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1vpx h GLU 190 CO -0.14 0.12 0.01 0.87 -1.00 0.00 0.00 179.01 178.87 1vpx h LYS 191 N 0.18 0.20 -0.10 2.33 1.57 -1.25 -2.72 116.57 116.79 1vpx h LYS 191 Ca 0.35 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.08 1vpx h LYS 191 Cb 0.56 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1vpx h LYS 191 CO -0.50 0.21 -0.03 -0.07 -0.57 0.00 0.00 179.45 178.49 1vpx h LEU 192 N 0.20 0.12 -1.39 2.94 3.38 -0.98 -1.85 115.31 117.73 1vpx h LEU 192 Ca 0.05 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1vpx h LEU 192 Cb 0.12 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1vpx h LEU 192 CO 0.00 0.18 -0.26 -0.26 0.09 0.00 0.00 178.44 178.19 1vpx h PHE 193 N 0.14 0.07 -3.09 1.13 -1.00 -1.54 -3.46 116.94 109.19 1vpx h PHE 193 Ca 0.03 -0.01 -0.60 0.00 2.81 0.00 0.00 57.97 60.20 1vpx h PHE 193 Cb 0.15 -0.02 -0.05 0.00 3.61 0.00 0.00 35.95 39.64 1vpx h PHE 193 CO 0.00 0.32 -0.15 0.15 -1.61 0.00 0.00 178.31 177.02 1vpx s LYS 194 N -4.45 3.99 -0.23 1.51 1.02 -0.70 -5.08 119.74 115.80 1vpx s LYS 194 Ca -0.04 0.50 -0.19 0.00 0.02 0.00 0.00 55.97 56.26 1vpx s LYS 194 Cb 0.15 -3.21 0.06 0.00 -0.52 0.00 0.00 37.83 34.31 1vpx s LYS 194 CO 0.72 0.67 0.61 -1.58 -0.92 0.00 0.00 175.35 174.85 1vpx s HIS 195 N -1.11 -0.73 0.44 3.18 2.46 -1.26 -5.05 115.29 113.22 1vpx s HIS 195 Ca 0.26 1.69 0.11 0.00 0.47 0.00 0.00 55.06 57.59 1vpx s HIS 195 Cb -0.17 0.30 0.98 0.00 -0.13 0.00 0.00 32.58 33.56 1vpx s HIS 195 CO 0.15 -0.36 2.05 -1.00 -2.47 0.00 0.00 174.74 173.12 1vpx h PRO 196 N 5.63 0.27 0.00 2.88 0.13 -2.00 -2.42 132.00 136.50 1vpx h PRO 196 Ca -0.29 -0.03 -0.14 0.00 -0.87 0.00 0.00 66.00 64.67 1vpx h PRO 196 Cb 1.18 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 1vpx h PRO 196 CO 0.14 0.24 -0.68 0.52 -0.23 0.00 0.00 178.00 177.99 1vpx h MET 197 N 0.27 0.00 -0.37 0.86 2.86 -1.98 -1.87 114.93 114.69 1vpx h MET 197 Ca 0.07 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.68 1vpx h MET 197 Cb 0.07 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 1vpx h MET 197 CO -0.01 0.68 0.12 1.15 1.06 0.00 0.00 176.91 179.90 1vpx h THR 198 N 0.00 1.21 -0.66 2.22 2.02 -1.86 -1.28 112.91 114.56 1vpx h THR 198 Ca -0.01 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.47 1vpx h THR 198 Cb 1.26 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 68.60 1vpx h THR 198 CO 0.09 0.24 0.37 0.44 0.37 0.00 0.00 175.52 177.03 1vpx h ASP 199 N 0.45 0.83 -0.43 4.18 5.19 -1.29 -0.98 116.42 124.37 1vpx h ASP 199 Ca 0.12 -0.09 -0.12 0.00 -0.62 0.00 0.00 57.03 56.32 1vpx h ASP 199 Cb 0.26 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.54 1vpx h ASP 199 CO -0.00 0.68 -0.19 -0.07 -3.12 0.00 0.00 179.24 176.54 1vpx h LEU 200 N 0.91 0.94 -0.81 1.55 3.38 -1.36 -1.98 115.31 117.95 1vpx h LEU 200 Ca 0.23 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 1vpx h LEU 200 Cb 0.03 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 1vpx h LEU 200 CO -0.04 1.11 0.50 1.23 0.09 0.00 0.00 178.44 181.33 1vpx h GLY 201 N 0.92 1.17 0.98 0.83 0.00 -0.84 -0.58 103.07 105.55 1vpx h GLY 201 Ca 0.11 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.90 1vpx h GLY 201 CO 0.06 0.46 0.07 -2.22 0.00 0.00 0.00 176.54 174.91 1vpx h ILE 202 N 1.11 1.25 -0.60 2.60 2.04 -1.08 -2.79 117.51 120.05 1vpx h ILE 202 Ca 0.29 -0.93 0.05 0.00 1.00 0.00 0.00 64.86 65.27 1vpx h ILE 202 Cb -0.06 0.93 -0.05 0.00 -0.74 0.00 0.00 36.82 36.90 1vpx h ILE 202 CO -0.06 0.33 0.32 -0.08 0.00 0.00 0.00 178.15 178.67 1vpx h GLU 203 N 0.67 0.59 0.00 2.37 4.81 -1.11 -3.51 114.58 118.39 1vpx h GLU 203 Ca 0.14 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1vpx h GLU 203 Cb 0.40 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1vpx h GLU 203 CO 0.01 0.39 0.00 0.54 -0.73 0.00 0.00 179.01 179.22