#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vpx n HIS 0 N 0.00 -0.21 -2.08 4.41 8.25 -1.26 -4.94 115.22 119.39 1vpx n HIS 0 Ca 0.00 0.95 -0.42 0.00 -0.26 0.00 0.00 57.72 57.99 1vpx n HIS 0 Cb 0.00 -2.00 -0.03 0.00 1.12 0.00 0.00 29.99 29.08 1vpx n HIS 0 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 1vpx s MET 1 N -0.95 4.29 0.03 -0.41 1.75 -1.26 -4.95 119.30 117.79 1vpx s MET 1 Ca 0.66 2.19 -0.04 0.00 -1.25 0.00 0.00 55.69 57.25 1vpx s MET 1 Cb -0.94 -3.19 -0.04 0.00 2.84 0.00 0.00 34.83 33.49 1vpx s MET 1 CO 0.56 -0.46 0.24 0.15 -0.65 0.00 0.00 175.02 174.86 1vpx s LYS 2 N 0.77 3.51 -0.16 4.11 1.02 -0.73 -5.01 119.74 123.25 1vpx s LYS 2 Ca 0.65 -0.22 0.01 0.00 0.02 0.00 0.00 55.97 56.42 1vpx s LYS 2 Cb -0.40 -3.05 0.00 0.00 -0.52 0.00 0.00 37.83 33.87 1vpx s LYS 2 CO 0.33 0.63 -0.17 0.42 -0.92 0.00 0.00 175.35 175.65 1vpx s ILE 3 N -1.39 2.52 0.22 2.17 1.01 -1.26 -1.47 121.20 123.00 1vpx s ILE 3 Ca 0.30 -0.82 0.06 0.00 0.00 0.00 0.00 60.65 60.20 1vpx s ILE 3 Cb -0.13 -2.05 -0.04 0.00 0.01 0.00 0.00 42.46 40.25 1vpx s ILE 3 CO 0.20 0.52 0.16 -0.36 0.00 0.00 0.00 174.94 175.46 1vpx s PHE 4 N 0.88 3.10 -0.14 3.97 0.08 -0.05 -0.22 117.98 125.60 1vpx s PHE 4 Ca -0.04 -0.08 -0.06 0.00 0.12 0.00 0.00 56.93 56.86 1vpx s PHE 4 Cb -0.15 -1.43 -0.04 0.00 -0.57 0.00 0.00 43.02 40.83 1vpx s PHE 4 CO -0.02 0.52 0.06 -0.51 -0.10 0.00 0.00 175.22 175.18 1vpx s LEU 5 N -3.57 3.89 -0.95 -0.37 1.43 -0.78 -1.65 118.68 116.68 1vpx s LEU 5 Ca 0.32 0.19 -0.21 0.00 -1.03 0.00 0.00 54.13 53.40 1vpx s LEU 5 Cb -0.09 -1.95 0.09 0.00 0.03 0.00 0.00 46.19 44.27 1vpx s LEU 5 CO 0.24 0.29 1.27 -1.81 0.23 0.00 0.00 176.35 176.57 1vpx s ASP 6 N -0.30 6.54 -0.01 2.29 1.01 -0.51 -0.48 116.67 125.20 1vpx s ASP 6 Ca 0.09 -1.68 -0.29 0.00 0.71 0.00 0.00 52.55 51.38 1vpx s ASP 6 Cb -0.12 -2.48 0.10 0.00 1.01 0.00 0.00 42.92 41.43 1vpx s ASP 6 CO 0.02 -1.30 0.89 0.28 0.21 0.00 0.00 175.17 175.26 1vpx s THR 7 N 3.87 0.00 -0.00 -1.27 -1.32 -0.97 -4.49 115.64 111.46 1vpx s THR 7 Ca 0.38 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.86 1vpx s THR 7 Cb -0.03 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.96 1vpx s THR 7 CO -0.08 0.00 0.90 0.00 -2.21 0.00 0.00 174.62 173.23 1vpx n ALA 8 N -0.20 1.79 -2.62 11.08 0.00 -1.26 -4.51 120.51 124.79 1vpx n ALA 8 Ca -0.09 -0.90 -0.41 0.00 0.00 0.00 0.00 53.44 52.04 1vpx n ALA 8 Cb 0.62 -0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.01 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 -0.80 6.67 0.32 0.00 3.84 -1.26 -4.91 114.94 118.81 1vpx s ASN 9 Ca 0.00 0.76 0.17 0.00 0.21 0.00 0.00 52.86 53.99 1vpx s ASN 9 Cb 0.00 -2.39 0.42 0.00 -0.55 0.00 0.00 41.25 38.74 1vpx s ASN 9 CO 0.00 -0.50 1.61 -0.07 -2.79 0.00 0.00 177.10 175.35 1vpx h LEU 10 N 9.20 0.00 -0.13 3.21 3.38 -1.98 -2.19 115.31 126.79 1vpx h LEU 10 Ca -0.25 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.69 1vpx h LEU 10 Cb 1.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 1vpx h LEU 10 CO 0.84 0.47 -0.04 -0.33 0.09 0.00 0.00 178.44 179.47 1vpx h GLU 11 N 0.00 0.26 -0.06 1.13 5.08 -1.99 0.36 114.58 119.37 1vpx h GLU 11 Ca -0.00 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.18 1vpx h GLU 11 Cb 1.11 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1vpx h GLU 11 CO 0.06 0.56 -0.31 1.05 -1.00 0.00 0.00 179.01 179.37 1vpx h GLU 12 N -0.05 0.10 -0.34 2.33 4.11 -1.94 -0.18 114.58 118.62 1vpx h GLU 12 Ca 0.03 -0.04 -0.16 0.00 0.07 0.00 0.00 59.36 59.27 1vpx h GLU 12 Cb 0.46 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 1vpx h GLU 12 CO 0.01 0.41 -0.40 0.82 0.07 0.00 0.00 179.01 179.92 1vpx h ILE 13 N 0.09 1.28 -0.83 -1.06 2.04 -1.31 -1.13 117.51 116.59 1vpx h ILE 13 Ca 0.01 -1.58 -0.01 0.00 1.00 0.00 0.00 64.86 64.28 1vpx h ILE 13 Cb 0.60 1.50 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 1vpx h ILE 13 CO 0.04 0.52 0.47 0.50 0.00 0.00 0.00 178.15 179.69 1vpx h LYS 14 N 0.66 1.15 -0.48 2.37 1.63 -0.43 -0.41 116.57 121.06 1vpx h LYS 14 Ca 0.05 -0.12 -0.09 0.00 -0.85 0.00 0.00 60.65 59.63 1vpx h LYS 14 Cb 1.00 -0.23 -0.02 0.00 -0.60 0.00 0.00 32.23 32.38 1vpx h LYS 14 CO 0.10 0.84 -0.08 -0.22 -3.45 0.00 0.00 179.45 176.63 1vpx h LYS 15 N 1.15 0.86 -0.67 1.90 3.64 -0.95 0.89 116.57 123.39 1vpx h LYS 15 Ca 0.30 -0.28 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 1vpx h LYS 15 Cb 0.01 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 1vpx h LYS 15 CO -0.05 0.91 0.28 0.78 -2.27 0.00 0.00 179.45 179.11 1vpx h GLY 16 N 0.98 1.07 1.44 5.01 0.00 -0.67 -2.63 103.07 108.26 1vpx h GLY 16 Ca 0.13 -0.57 -0.25 0.00 0.00 0.00 0.00 47.33 46.65 1vpx h GLY 16 CO 0.04 0.54 -1.01 -0.39 0.00 0.00 0.00 176.54 175.72 1vpx h VAL 17 N 0.95 1.36 -0.84 4.60 -1.51 -0.79 -2.68 116.25 117.34 1vpx h VAL 17 Ca 0.23 -2.42 0.16 0.00 -1.23 0.00 0.00 66.70 63.43 1vpx h VAL 17 Cb 0.19 2.45 -0.10 0.00 -2.13 0.00 0.00 31.29 31.70 1vpx h VAL 17 CO -0.02 0.73 0.40 -0.33 -1.23 0.00 0.00 177.57 177.12 1vpx h GLU 18 N 0.27 0.53 0.00 5.19 5.08 -0.85 -0.33 114.58 124.48 1vpx h GLU 18 Ca -0.10 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1vpx h GLU 18 Cb 1.66 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.79 1vpx h GLU 18 CO 0.18 0.35 0.00 -1.49 -1.00 0.00 0.00 179.01 177.05 1vpx h TRP 19 N 0.55 0.00 -0.66 4.33 6.55 -1.42 -3.47 115.95 121.82 1vpx h TRP 19 Ca 0.47 0.00 -0.10 0.00 0.95 0.00 0.00 58.89 60.21 1vpx h TRP 19 Cb 0.72 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.01 1vpx h TRP 19 CO -0.11 0.00 -0.13 0.41 -1.05 0.00 0.00 178.44 177.56 1vpx n GLY 20 N 0.48 0.25 0.01 1.49 0.00 -0.13 -4.93 105.19 102.36 1vpx n GLY 20 Ca 0.02 -0.70 -0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 -3.84 0.17 -3.70 -0.61 5.41 -1.03 -4.99 119.36 110.76 1vpx n ILE 21 Ca -0.06 -0.14 -0.36 0.00 1.00 0.00 0.00 62.75 63.19 1vpx n ILE 21 Cb 0.49 -0.36 -0.09 0.00 -0.71 0.00 0.00 39.64 38.97 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 -2.19 5.33 -0.28 1.39 1.01 -1.11 -4.29 120.40 120.26 1vpx s VAL 22 Ca -0.02 0.17 0.17 0.00 0.00 0.00 0.00 61.98 62.30 1vpx s VAL 22 Cb 0.02 -3.47 -0.25 0.00 0.00 0.00 0.00 36.38 32.68 1vpx s VAL 22 CO 0.18 0.38 0.50 0.47 0.00 0.00 0.00 175.10 176.62 1vpx n ASP 23 N 4.06 0.92 -2.52 3.32 8.00 0.69 -4.70 116.55 126.32 1vpx n ASP 23 Ca -0.15 -0.29 -0.03 0.00 0.71 0.00 0.00 54.79 55.02 1vpx n ASP 23 Cb 0.52 1.55 0.02 0.00 -0.02 0.00 0.00 41.12 43.18 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 1.47 0.94 2.94 0.44 0.00 -1.23 -3.80 105.19 105.95 1vpx n GLY 24 Ca -0.01 -1.11 -0.12 0.00 0.00 0.00 0.00 46.02 44.78 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 -2.25 0.15 -0.04 1.61 1.01 0.11 -1.87 120.40 119.11 1vpx s VAL 25 Ca 0.15 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.73 1vpx s VAL 25 Cb -0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 36.38 36.13 1vpx s VAL 25 CO 0.05 -0.18 -0.14 0.42 0.00 0.00 0.00 175.10 175.25 1vpx s THR 26 N -0.63 3.12 0.23 3.92 -4.23 0.37 -1.23 115.64 117.19 1vpx s THR 26 Ca -0.06 -0.74 0.04 0.00 -1.18 0.00 0.00 61.69 59.76 1vpx s THR 26 Cb -0.05 -2.24 -0.05 0.00 1.34 0.00 0.00 72.50 71.50 1vpx s THR 26 CO -0.00 0.57 -0.03 -0.89 -0.54 0.00 0.00 174.62 173.72 1vpx s THR 27 N -0.76 1.21 0.11 3.99 2.01 -0.74 -2.29 115.64 119.16 1vpx s THR 27 Ca 0.12 -2.06 -0.17 0.00 0.31 0.00 0.00 61.69 59.89 1vpx s THR 27 Cb -0.11 -2.30 0.04 0.00 0.01 0.00 0.00 72.50 70.14 1vpx s THR 27 CO 0.01 -0.38 0.42 0.21 -0.69 0.00 0.00 174.62 174.19 1vpx s ASN 28 N -3.32 -0.27 0.57 3.53 2.47 -1.26 -4.57 114.94 112.08 1vpx s ASN 28 Ca 0.27 -0.23 0.25 0.00 0.42 0.00 0.00 52.86 53.57 1vpx s ASN 28 Cb 0.05 0.47 1.58 0.00 -1.45 0.00 0.00 41.25 41.90 1vpx s ASN 28 CO 0.08 -0.82 2.14 -0.65 -3.72 0.00 0.00 177.10 174.13 1vpx h PRO 29 N 2.46 0.00 -0.51 0.43 0.11 -1.97 -2.32 132.00 130.20 1vpx h PRO 29 Ca -0.33 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.79 1vpx h PRO 29 Cb 1.25 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 1vpx h PRO 29 CO 0.46 0.00 0.34 1.79 -0.21 0.00 0.00 178.00 180.37 1vpx h THR 30 N 0.00 1.10 0.12 -1.15 1.35 -1.97 0.29 112.91 112.65 1vpx h THR 30 Ca 0.06 -0.22 -0.23 0.00 -0.55 0.00 0.00 66.41 65.47 1vpx h THR 30 Cb 0.30 0.40 0.01 0.00 -1.73 0.00 0.00 68.15 67.12 1vpx h THR 30 CO -0.00 0.12 -1.12 -0.07 -0.25 0.00 0.00 175.52 174.19 1vpx h LEU 31 N 0.65 0.39 -1.44 3.87 4.07 -1.90 0.55 115.31 121.50 1vpx h LEU 31 Ca 0.19 -0.88 0.10 0.00 0.08 0.00 0.00 57.88 57.37 1vpx h LEU 31 Cb -0.02 -0.13 -0.05 0.00 1.08 0.00 0.00 40.66 41.55 1vpx h LEU 31 CO -0.05 1.51 0.49 0.16 -1.08 0.00 0.00 178.44 179.47 1vpx h ILE 32 N -0.38 0.93 0.00 1.22 -0.00 -1.15 0.11 117.51 118.24 1vpx h ILE 32 Ca -0.23 -0.21 -0.13 0.00 -0.00 0.00 0.00 64.86 64.28 1vpx h ILE 32 Cb 1.68 0.25 -0.02 0.00 -0.00 0.00 0.00 36.82 38.72 1vpx h ILE 32 CO 0.08 0.11 -1.62 -0.24 -0.00 0.00 0.00 178.15 176.49 1vpx n SER 33 N -4.49 0.53 -0.32 2.16 2.88 1.00 -0.19 113.62 115.19 1vpx n SER 33 Ca 0.12 0.23 0.18 0.00 -1.33 0.00 0.00 58.87 58.07 1vpx n SER 33 Cb 0.35 0.75 0.38 0.00 -0.75 0.00 0.00 64.21 64.93 1vpx n SER 33 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1vpx h LYS 34 N 0.00 0.39 -0.02 -1.46 3.11 0.19 -1.39 116.57 117.39 1vpx h LYS 34 Ca -0.16 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.66 1vpx h LYS 34 Cb 1.46 -0.09 0.00 0.00 -1.00 0.00 0.00 32.23 32.60 1vpx h LYS 34 CO 0.03 0.26 -0.29 0.39 -2.81 0.00 0.00 179.45 177.02 1vpx n GLU 35 N -5.03 1.57 -0.54 1.90 -0.58 -0.25 -5.00 120.64 112.71 1vpx n GLU 35 Ca 0.26 -1.14 0.00 0.00 -0.42 0.00 0.00 57.16 55.86 1vpx n GLU 35 Cb 0.79 -1.38 0.00 0.00 -0.57 0.00 0.00 31.44 30.28 1vpx n GLU 35 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1vpx n GLY 36 N 1.24 0.82 3.06 0.62 0.00 -0.53 -5.10 105.19 105.31 1vpx n GLY 36 Ca 0.09 -0.14 -0.16 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.97 0.76 0.72 4.61 0.00 0.73 -4.98 121.76 121.63 1vpx s ALA 37 Ca 0.00 -0.63 -0.15 0.00 0.00 0.00 0.00 51.96 51.18 1vpx s ALA 37 Cb 0.00 -0.09 0.03 0.00 0.00 0.00 0.00 23.12 23.06 1vpx s ALA 37 CO 0.00 0.11 1.20 -2.00 0.00 0.00 0.00 175.76 175.06 1vpx s GLU 38 N -0.97 2.24 -0.03 0.00 -6.30 -1.26 -4.14 118.70 108.24 1vpx s GLU 38 Ca -0.02 1.72 -0.18 0.00 -2.50 0.00 0.00 54.97 53.98 1vpx s GLU 38 Cb -0.07 -1.85 -0.11 0.00 0.00 0.00 0.00 34.13 32.11 1vpx s GLU 38 CO 0.00 -1.75 0.77 0.35 0.02 0.00 0.00 175.26 174.66 1vpx h PHE 39 N -0.22 -0.54 -0.51 5.30 3.57 -1.99 -2.20 116.94 120.35 1vpx h PHE 39 Ca -0.48 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 60.93 1vpx h PHE 39 Cb 1.29 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 40.19 1vpx h PHE 39 CO 0.48 -0.29 -0.01 0.87 -2.23 0.00 0.00 178.31 177.13 1vpx h LYS 40 N -1.12 0.90 -0.52 1.11 1.57 -1.99 -2.21 116.57 114.31 1vpx h LYS 40 Ca -0.06 -0.29 0.04 0.00 -1.87 0.00 0.00 60.65 58.47 1vpx h LYS 40 Cb 0.49 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.69 1vpx h LYS 40 CO 0.10 0.94 0.35 0.37 -0.57 0.00 0.00 179.45 180.63 1vpx h GLN 41 N 0.77 0.53 0.02 3.15 5.75 -1.98 -2.13 115.11 121.22 1vpx h GLN 41 Ca 0.14 -0.03 -0.22 0.00 -0.15 0.00 0.00 58.65 58.39 1vpx h GLN 41 Cb 0.53 -0.12 0.02 0.00 1.07 0.00 0.00 27.48 28.98 1vpx h GLN 41 CO 0.03 0.35 -0.88 -0.09 -2.65 0.00 0.00 178.83 175.59 1vpx h ARG 42 N 0.55 0.56 -0.84 1.69 9.65 -1.07 -3.04 114.38 121.88 1vpx h ARG 42 Ca 0.22 -0.63 -0.01 0.00 -1.10 0.00 0.00 59.98 58.45 1vpx h ARG 42 Cb 0.17 0.19 -0.04 0.00 -1.39 0.00 0.00 29.97 28.90 1vpx h ARG 42 CO -0.06 1.24 0.48 0.28 2.80 0.00 0.00 179.97 184.72 1vpx h VAL 43 N 0.14 1.24 0.05 0.20 2.07 -1.22 -1.50 116.25 117.24 1vpx h VAL 43 Ca -0.12 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 66.86 1vpx h VAL 43 Cb 1.57 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 1vpx h VAL 43 CO 0.17 0.26 -0.12 0.50 0.02 0.00 0.00 177.57 178.40 1vpx h LYS 44 N 1.16 -0.22 -0.92 1.57 1.63 -1.46 -1.15 116.57 117.18 1vpx h LYS 44 Ca 0.30 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.12 1vpx h LYS 44 Cb -0.01 0.05 -0.05 0.00 -0.60 0.00 0.00 32.23 31.63 1vpx h LYS 44 CO -0.05 -0.15 0.59 0.93 -3.45 0.00 0.00 179.45 177.32 1vpx h GLU 45 N -0.23 1.22 -0.41 1.90 5.08 -1.35 -1.85 114.58 118.93 1vpx h GLU 45 Ca 0.03 -0.08 -0.10 0.00 -1.00 0.00 0.00 59.36 58.20 1vpx h GLU 45 Cb 0.26 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1vpx h GLU 45 CO -0.08 0.82 -0.15 0.82 -1.00 0.00 0.00 179.01 179.42 1vpx h ILE 46 N 1.25 1.28 -0.24 3.13 2.04 -1.11 -2.57 117.51 121.29 1vpx h ILE 46 Ca 0.33 -1.27 0.02 0.00 1.00 0.00 0.00 64.86 64.95 1vpx h ILE 46 Cb -0.12 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 1vpx h ILE 46 CO -0.07 0.43 0.08 0.00 0.00 0.00 0.00 178.15 178.59 1vpx h ASP 48 N 0.19 0.54 0.01 0.00 3.32 -1.32 0.11 116.42 119.27 1vpx h ASP 48 Ca 0.10 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.08 1vpx h ASP 48 Cb 0.07 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1vpx h ASP 48 CO -0.11 0.37 -0.36 0.25 -1.72 0.00 0.00 179.24 177.67 1vpx h LEU 49 N 0.62 0.03 0.00 1.55 5.85 -1.01 -3.38 115.31 118.97 1vpx h LEU 49 Ca 0.23 -0.88 -0.20 0.00 0.84 0.00 0.00 57.88 57.88 1vpx h LEU 49 Cb 0.15 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 1vpx h LEU 49 CO -0.06 1.15 -0.97 -0.37 -0.34 0.00 0.00 178.44 177.85 1vpx h VAL 50 N -0.96 1.52 -6.67 1.05 -1.51 -0.99 -3.48 116.25 105.21 1vpx h VAL 50 Ca -0.09 -3.18 -0.54 0.00 -1.23 0.00 0.00 66.70 61.65 1vpx h VAL 50 Cb 1.11 2.75 -0.06 0.00 -2.13 0.00 0.00 31.29 32.97 1vpx h VAL 50 CO -0.04 0.87 -0.94 0.29 -1.23 0.00 0.00 177.57 176.51 1vpx n LYS 51 N -3.31 -1.78 -3.82 5.19 5.02 0.37 -4.84 118.16 114.99 1vpx n LYS 51 Ca -0.01 0.27 -0.06 0.00 -2.02 0.00 0.00 58.31 56.50 1vpx n LYS 51 Cb 0.91 -3.85 -0.00 0.00 -0.02 0.00 0.00 35.03 32.07 1vpx n LYS 51 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1vpx s GLY 52 N -4.06 0.04 -0.14 0.72 0.00 -1.26 -5.01 107.32 97.61 1vpx s GLY 52 Ca 0.18 -0.35 -0.39 0.00 0.00 0.00 0.00 44.72 44.16 1vpx s GLY 52 CO 0.93 0.19 1.53 -1.05 0.00 0.00 0.00 173.10 174.70 1vpx n PRO 53 N -0.51 0.98 -3.97 2.90 -0.02 -1.25 -4.74 135.00 128.38 1vpx n PRO 53 Ca -0.06 0.36 -0.31 0.00 -2.02 0.00 0.00 63.50 61.47 1vpx n PRO 53 Cb 0.60 -2.00 -0.15 0.00 -0.02 0.00 0.00 33.50 31.93 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 2.10 1.81 -0.02 -1.45 1.01 -0.52 -0.72 120.40 122.63 1vpx s VAL 54 Ca 0.93 -1.65 -0.30 0.00 0.00 0.00 0.00 61.98 60.96 1vpx s VAL 54 Cb -1.07 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 1vpx s VAL 54 CO 0.59 -0.29 1.05 -0.44 0.00 0.00 0.00 175.10 176.02 1vpx s SER 55 N 1.21 7.25 -0.02 3.32 0.01 -0.37 -1.27 113.70 123.84 1vpx s SER 55 Ca -0.00 1.72 0.00 0.00 1.31 0.00 0.00 55.95 58.98 1vpx s SER 55 Cb -0.19 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.49 1vpx s SER 55 CO -0.09 -0.38 -0.01 0.00 0.41 0.00 0.00 173.24 173.18 1vpx s ALA 56 N 1.38 0.23 0.29 1.44 0.00 0.09 -1.79 121.76 123.39 1vpx s ALA 56 Ca 0.53 0.07 -0.11 0.00 0.00 0.00 0.00 51.96 52.45 1vpx s ALA 56 Cb -0.22 -0.19 -0.07 0.00 0.00 0.00 0.00 23.12 22.63 1vpx s ALA 56 CO 0.25 -0.02 0.64 -2.00 0.00 0.00 0.00 175.76 174.63 1vpx s GLU 57 N 0.56 3.84 0.29 0.00 2.12 -1.26 -1.04 118.70 123.21 1vpx s GLU 57 Ca -0.05 0.40 -0.04 0.00 0.36 0.00 0.00 54.97 55.64 1vpx s GLU 57 Cb -0.08 -2.54 -0.05 0.00 0.26 0.00 0.00 34.13 31.72 1vpx s GLU 57 CO -0.01 0.20 0.54 0.14 -0.54 0.00 0.00 175.26 175.59 1vpx s VAL 58 N -1.98 5.05 -0.10 3.70 -7.23 -1.24 -4.91 120.40 113.69 1vpx s VAL 58 Ca 0.50 -0.06 -0.25 0.00 -1.81 0.00 0.00 61.98 60.35 1vpx s VAL 58 Cb -0.11 -3.76 -0.21 0.00 0.56 0.00 0.00 36.38 32.86 1vpx s VAL 58 CO 0.22 -0.36 0.81 0.58 -0.31 0.00 0.00 175.10 176.05 1vpx h VAL 59 N 1.25 1.45 -4.21 1.32 2.07 -1.95 -3.47 116.25 112.70 1vpx h VAL 59 Ca -0.48 -1.86 -0.51 0.00 0.82 0.00 0.00 66.70 64.67 1vpx h VAL 59 Cb 1.19 2.63 0.11 0.00 -1.52 0.00 0.00 31.29 33.71 1vpx h VAL 59 CO 0.65 0.45 0.37 -0.44 0.02 0.00 0.00 177.57 178.62 1vpx s SER 60 N -5.97 4.89 -0.00 0.57 0.01 -1.26 -4.99 113.70 106.95 1vpx s SER 60 Ca -0.16 2.01 0.05 0.00 1.31 0.00 0.00 55.95 59.16 1vpx s SER 60 Cb -0.01 -2.55 -0.06 0.00 0.21 0.00 0.00 66.02 63.61 1vpx s SER 60 CO 0.60 -1.78 0.19 0.18 0.41 0.00 0.00 173.24 172.84 1vpx n LEU 61 N -2.63 0.19 -4.84 2.44 4.77 -1.26 -4.55 117.00 111.12 1vpx n LEU 61 Ca 0.10 -0.42 -0.33 0.00 -0.03 0.00 0.00 56.01 55.34 1vpx n LEU 61 Cb 0.52 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.55 1vpx n LEU 61 CO 0.49 0.05 0.52 1.51 -1.33 0.00 0.00 177.39 178.63 1vpx s ASP 62 N -1.63 6.83 0.15 -1.43 -4.77 -1.26 -4.73 116.67 109.83 1vpx s ASP 62 Ca 0.01 1.46 -0.20 0.00 -3.30 0.00 0.00 52.55 50.52 1vpx s ASP 62 Cb 0.04 -2.45 0.05 0.00 -1.09 0.00 0.00 42.92 39.47 1vpx s ASP 62 CO 0.20 -0.29 1.65 0.22 0.70 0.00 0.00 175.17 177.66 1vpx h TYR 63 N 2.05 -0.41 -0.27 2.11 3.20 -1.95 -0.25 116.97 121.45 1vpx h TYR 63 Ca -0.48 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.42 1vpx h TYR 63 Cb 1.18 0.23 -0.01 0.00 1.54 0.00 0.00 36.73 39.66 1vpx h TYR 63 CO 0.62 -0.24 0.16 0.93 -1.64 0.00 0.00 178.16 177.99 1vpx h GLU 64 N -0.13 0.38 -0.46 1.82 4.39 -1.94 -1.61 114.58 117.03 1vpx h GLU 64 Ca 0.15 -0.04 -0.11 0.00 0.34 0.00 0.00 59.36 59.71 1vpx h GLU 64 Cb 0.36 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 1vpx h GLU 64 CO -0.37 0.31 -0.15 0.78 -1.16 0.00 0.00 179.01 178.42 1vpx h GLY 65 N 0.34 0.94 0.99 -3.84 0.00 -1.91 -0.66 103.07 98.93 1vpx h GLY 65 Ca 0.10 -0.76 -0.00 0.00 0.00 0.00 0.00 47.33 46.67 1vpx h GLY 65 CO -0.02 0.69 0.31 -0.33 0.00 0.00 0.00 176.54 177.20 1vpx h MET 66 N 0.77 0.69 -0.24 4.80 2.86 -0.81 -1.71 114.93 121.28 1vpx h MET 66 Ca 0.12 -0.06 -0.09 0.00 -2.06 0.00 0.00 59.70 57.61 1vpx h MET 66 Cb 0.67 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 32.18 1vpx h MET 66 CO 0.05 0.50 -0.20 0.28 1.06 0.00 0.00 176.91 178.59 1vpx h VAL 67 N 0.68 1.31 -0.46 -2.22 2.07 -1.14 -0.24 116.25 116.26 1vpx h VAL 67 Ca 0.18 -1.34 0.09 0.00 0.82 0.00 0.00 66.70 66.45 1vpx h VAL 67 Cb -0.02 1.64 -0.07 0.00 -1.52 0.00 0.00 31.29 31.32 1vpx h VAL 67 CO -0.04 0.42 0.00 -0.09 0.02 0.00 0.00 177.57 177.89 1vpx h ARG 68 N 0.28 0.11 -0.11 1.57 2.43 -1.06 -1.91 114.38 115.69 1vpx h ARG 68 Ca 0.04 -0.01 -0.18 0.00 -0.81 0.00 0.00 59.98 59.03 1vpx h ARG 68 Cb 0.74 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.26 1vpx h ARG 68 CO 0.05 0.08 -0.69 0.93 -1.51 0.00 0.00 179.97 178.83 1vpx h GLU 69 N 0.12 0.48 -0.63 0.20 5.08 -1.19 -2.92 114.58 115.71 1vpx h GLU 69 Ca 0.23 -0.36 0.02 0.00 -1.00 0.00 0.00 59.36 58.24 1vpx h GLU 69 Cb 0.33 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 1vpx h GLU 69 CO -0.38 0.99 0.40 0.00 -1.00 0.00 0.00 179.01 179.03 1vpx h ALA 70 N 0.91 0.81 -0.40 3.43 0.00 -0.82 -0.41 119.26 122.78 1vpx h ALA 70 Ca -0.02 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1vpx h ALA 70 Cb 1.26 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1vpx h ALA 70 CO 0.12 0.18 0.06 0.00 0.00 0.00 0.00 179.25 179.62 1vpx h ARG 71 N 0.81 0.61 -0.11 0.00 3.08 -1.29 0.54 114.38 118.02 1vpx h ARG 71 Ca 0.24 -0.12 -0.05 0.00 0.07 0.00 0.00 59.98 60.13 1vpx h ARG 71 Cb -0.04 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 29.92 1vpx h ARG 71 CO -0.08 0.58 -0.11 1.49 -1.07 0.00 0.00 179.97 180.78 1vpx h GLU 72 N 0.59 0.27 -0.60 0.04 4.81 -1.26 -2.96 114.58 115.46 1vpx h GLU 72 Ca 0.13 -0.14 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 1vpx h GLU 72 Cb 0.28 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 1vpx h GLU 72 CO 0.00 0.68 0.09 -0.07 -0.73 0.00 0.00 179.01 178.99 1vpx h LEU 73 N -0.13 0.93 -1.84 1.64 3.38 -0.92 -2.96 115.31 115.42 1vpx h LEU 73 Ca 0.02 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1vpx h LEU 73 Cb 0.63 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1vpx h LEU 73 CO 0.03 0.94 -0.12 0.00 0.09 0.00 0.00 178.44 179.38 1vpx h ALA 74 N 1.17 1.68 0.00 1.53 0.00 -0.88 -1.41 119.26 121.35 1vpx h ALA 74 Ca 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1vpx h ALA 74 Cb 0.41 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1vpx h ALA 74 CO 0.01 0.15 0.00 1.96 0.00 0.00 0.00 179.25 181.37 1vpx h GLN 75 N 0.00 0.00 -0.67 0.00 4.20 -1.35 -3.14 115.11 114.16 1vpx h GLN 75 Ca -0.00 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 1vpx h GLN 75 Cb 0.23 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.98 1vpx h GLN 75 CO 0.02 0.00 0.25 0.82 -0.67 0.00 0.00 178.83 179.24 1vpx h ILE 76 N 0.00 1.24 -1.60 2.54 2.04 -1.38 -3.46 117.51 116.89 1vpx h ILE 76 Ca 0.00 -0.79 0.07 0.00 1.00 0.00 0.00 64.86 65.14 1vpx h ILE 76 Cb 0.34 0.51 -0.23 0.00 -0.74 0.00 0.00 36.82 36.69 1vpx h ILE 76 CO 0.00 0.31 0.50 -0.55 0.00 0.00 0.00 178.15 178.41 1vpx s SER 77 N -6.22 -0.41 0.64 1.72 0.15 -1.19 -4.96 113.70 103.43 1vpx s SER 77 Ca -0.13 0.52 0.38 0.00 0.70 0.00 0.00 55.95 57.42 1vpx s SER 77 Cb 0.14 0.43 2.13 0.00 -1.71 0.00 0.00 66.02 67.01 1vpx s SER 77 CO 0.81 -0.33 2.28 1.05 1.20 0.00 0.00 173.24 178.26 1vpx h GLU 78 N 2.91 0.00 0.00 5.44 4.11 -1.90 -2.62 114.58 122.51 1vpx h GLU 78 Ca -0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.22 1vpx h GLU 78 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1vpx h GLU 78 CO 0.28 0.00 -0.31 0.66 0.07 0.00 0.00 179.01 179.71 1vpx n TYR 79 N -3.36 0.75 -1.99 2.06 4.01 -1.26 -4.90 117.16 112.47 1vpx n TYR 79 Ca -0.02 0.22 -0.41 0.00 -0.16 0.00 0.00 57.90 57.52 1vpx n TYR 79 Cb 0.12 -0.80 -0.02 0.00 -0.31 0.00 0.00 39.34 38.32 1vpx n TYR 79 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1vpx s VAL 80 N -3.13 2.61 -0.07 -0.72 1.01 -0.99 -1.43 120.40 117.67 1vpx s VAL 80 Ca 0.08 0.51 0.04 0.00 0.00 0.00 0.00 61.98 62.61 1vpx s VAL 80 Cb 0.13 -3.32 -0.00 0.00 0.00 0.00 0.00 36.38 33.18 1vpx s VAL 80 CO 0.66 0.08 -0.20 -0.69 0.00 0.00 0.00 175.10 174.94 1vpx s VAL 81 N 0.09 1.74 -0.24 2.92 1.01 -0.40 -4.62 120.40 120.90 1vpx s VAL 81 Ca 0.60 -0.85 -0.21 0.00 0.00 0.00 0.00 61.98 61.52 1vpx s VAL 81 Cb -0.42 -1.50 -0.02 0.00 0.00 0.00 0.00 36.38 34.43 1vpx s VAL 81 CO 0.43 0.49 0.66 -0.63 0.00 0.00 0.00 175.10 176.04 1vpx s ILE 82 N 0.25 4.97 -0.13 2.22 -1.09 -0.05 -0.73 121.20 126.64 1vpx s ILE 82 Ca -0.12 1.21 -0.29 0.00 -2.23 0.00 0.00 60.65 59.22 1vpx s ILE 82 Cb -0.15 -3.96 -0.01 0.00 -1.58 0.00 0.00 42.46 36.75 1vpx s ILE 82 CO 0.05 0.04 1.07 -0.54 -1.23 0.00 0.00 174.94 174.33 1vpx s LYS 83 N 2.38 4.36 -0.09 2.79 1.02 -0.21 0.08 119.74 130.07 1vpx s LYS 83 Ca 0.28 1.45 0.03 0.00 0.02 0.00 0.00 55.97 57.75 1vpx s LYS 83 Cb -0.16 -3.59 0.01 0.00 -0.52 0.00 0.00 37.83 33.57 1vpx s LYS 83 CO 0.09 -0.44 -0.19 0.42 -0.92 0.00 0.00 175.35 174.30 1vpx s ILE 84 N 2.45 1.70 0.51 2.17 1.01 0.06 -3.66 121.20 125.44 1vpx s ILE 84 Ca 0.49 -0.81 -0.21 0.00 0.00 0.00 0.00 60.65 60.12 1vpx s ILE 84 Cb -0.19 -1.49 -0.06 0.00 0.01 0.00 0.00 42.46 40.73 1vpx s ILE 84 CO 0.15 0.48 1.16 -2.16 0.00 0.00 0.00 174.94 174.58 1vpx s PRO 85 N 0.47 3.51 -0.86 2.79 0.04 -1.26 -0.84 135.00 138.85 1vpx s PRO 85 Ca -0.17 1.74 -0.25 0.00 0.04 0.00 0.00 61.00 62.36 1vpx s PRO 85 Cb -0.17 -2.20 -0.02 0.00 0.04 0.00 0.00 34.50 32.15 1vpx s PRO 85 CO 0.07 -0.75 1.77 1.41 0.04 0.00 0.00 177.00 179.54 1vpx s MET 86 N -2.99 2.84 0.11 4.56 1.75 -0.38 -4.42 119.30 120.77 1vpx s MET 86 Ca 0.69 -0.28 -0.06 0.00 -1.25 0.00 0.00 55.69 54.78 1vpx s MET 86 Cb -0.27 -4.92 -0.02 0.00 2.84 0.00 0.00 34.83 32.46 1vpx s MET 86 CO 0.32 -2.90 0.15 0.95 -0.65 0.00 0.00 175.02 172.89 1vpx s THR 87 N 8.45 0.13 0.17 10.11 -4.23 -1.26 -5.01 115.64 124.00 1vpx s THR 87 Ca 0.62 -1.50 -0.23 0.00 -1.18 0.00 0.00 61.69 59.39 1vpx s THR 87 Cb -0.07 -1.66 0.06 0.00 1.34 0.00 0.00 72.50 72.17 1vpx s THR 87 CO 0.03 -0.57 1.59 -0.65 -0.54 0.00 0.00 174.62 174.48 1vpx h PRO 88 N 2.78 -0.23 -0.75 3.99 0.11 -1.99 0.85 132.00 136.76 1vpx h PRO 88 Ca -0.34 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 1vpx h PRO 88 Cb 1.20 0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.32 1vpx h PRO 88 CO 0.56 -0.16 0.42 -0.44 -0.21 0.00 0.00 178.00 178.18 1vpx h ASP 89 N -0.24 0.91 -0.85 -2.05 5.19 -1.94 0.30 116.42 117.73 1vpx h ASP 89 Ca 0.18 -0.06 -0.01 0.00 -0.62 0.00 0.00 57.03 56.52 1vpx h ASP 89 Cb 0.55 -0.23 -0.04 0.00 0.18 0.00 0.00 39.33 39.79 1vpx h ASP 89 CO -0.59 0.72 0.51 1.23 -3.12 0.00 0.00 179.24 177.99 1vpx h GLY 90 N 1.07 1.25 1.45 2.75 0.00 -1.56 0.33 103.07 108.36 1vpx h GLY 90 Ca 0.27 -0.53 -0.18 0.00 0.00 0.00 0.00 47.33 46.89 1vpx h GLY 90 CO -0.05 0.51 -0.67 -2.22 0.00 0.00 0.00 176.54 174.11 1vpx h ILE 91 N 1.18 1.33 -0.59 2.60 1.08 0.03 -0.91 117.51 122.24 1vpx h ILE 91 Ca 0.31 -1.98 0.00 0.00 -0.39 0.00 0.00 64.86 62.80 1vpx h ILE 91 Cb -0.03 1.95 -0.03 0.00 -3.07 0.00 0.00 36.82 35.64 1vpx h ILE 91 CO -0.06 0.61 0.37 0.50 -0.69 0.00 0.00 178.15 178.88 1vpx h LYS 92 N 0.39 0.78 -0.68 2.37 3.64 -0.67 -2.02 116.57 120.38 1vpx h LYS 92 Ca -0.02 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.26 1vpx h LYS 92 Cb 1.25 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.87 1vpx h LYS 92 CO 0.13 0.54 0.27 0.00 -2.27 0.00 0.00 179.45 178.12 1vpx h ALA 93 N 1.19 1.18 -0.20 5.00 0.00 -0.69 -2.31 119.26 123.44 1vpx h ALA 93 Ca 0.21 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1vpx h ALA 93 Cb -0.05 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1vpx h ALA 93 CO -0.04 0.59 0.13 0.28 0.00 0.00 0.00 179.25 180.21 1vpx h VAL 94 N 0.99 1.06 -0.42 0.00 2.07 -0.85 0.24 116.25 119.33 1vpx h VAL 94 Ca 0.23 -0.11 0.06 0.00 0.82 0.00 0.00 66.70 67.70 1vpx h VAL 94 Cb 0.20 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 30.69 1vpx h VAL 94 CO -0.02 0.05 0.13 0.50 0.02 0.00 0.00 177.57 178.26 1vpx h LYS 95 N 0.27 0.28 0.16 1.57 3.11 -1.04 0.11 116.57 121.01 1vpx h LYS 95 Ca 0.07 -0.02 -0.01 0.00 -2.81 0.00 0.00 60.65 57.89 1vpx h LYS 95 Cb -0.02 -0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.15 1vpx h LYS 95 CO -0.02 0.19 -0.07 1.15 -2.81 0.00 0.00 179.45 177.89 1vpx h THR 96 N 0.29 0.94 -0.66 1.00 2.02 -1.15 -2.95 112.91 112.40 1vpx h THR 96 Ca 0.20 -0.43 -0.07 0.00 0.77 0.00 0.00 66.41 66.88 1vpx h THR 96 Cb 0.21 1.21 -0.03 0.00 -1.74 0.00 0.00 68.15 67.79 1vpx h THR 96 CO -0.22 0.10 0.14 -0.07 0.37 0.00 0.00 175.52 175.84 1vpx h LEU 97 N -0.41 1.00 -0.74 2.58 3.38 -0.27 -2.46 115.31 118.39 1vpx h LEU 97 Ca -0.02 -0.21 0.04 0.00 0.09 0.00 0.00 57.88 57.78 1vpx h LEU 97 Cb 0.32 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 1vpx h LEU 97 CO 0.03 0.97 0.45 0.28 0.09 0.00 0.00 178.44 180.27 1vpx h SER 98 N 0.99 0.72 0.20 -0.43 0.02 -0.83 -0.69 113.55 113.52 1vpx h SER 98 Ca 0.21 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.15 1vpx h SER 98 Cb 0.38 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.77 1vpx h SER 98 CO 0.00 0.48 -0.08 0.00 -1.14 0.00 0.00 176.83 176.09 1vpx h ALA 99 N 1.34 1.46 -0.62 3.77 0.00 -1.27 -2.48 119.26 121.47 1vpx h ALA 99 Ca 0.31 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 1vpx h ALA 99 Cb 0.09 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1vpx h ALA 99 CO -0.14 0.11 0.06 -0.85 0.00 0.00 0.00 179.25 178.43 1vpx n GLU 100 N -3.86 4.69 -1.43 0.00 0.28 -0.76 -4.95 120.64 114.62 1vpx n GLU 100 Ca -0.02 -3.16 -0.11 0.00 -0.16 0.00 0.00 57.16 53.71 1vpx n GLU 100 Cb 0.18 -2.27 -0.04 0.00 1.43 0.00 0.00 31.44 30.74 1vpx n GLU 100 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1vpx n GLY 101 N 0.47 1.03 3.66 -1.84 0.00 -0.93 -5.00 105.19 102.58 1vpx n GLY 101 Ca 0.31 -0.53 -0.37 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.41 5.31 0.26 -0.61 1.01 -0.34 -5.02 121.20 119.39 1vpx s ILE 102 Ca 0.00 0.36 -0.30 0.00 0.00 0.00 0.00 60.65 60.71 1vpx s ILE 102 Cb 0.00 -3.58 -0.09 0.00 0.01 0.00 0.00 42.46 38.80 1vpx s ILE 102 CO 0.00 0.31 1.02 -0.54 0.00 0.00 0.00 174.94 175.73 1vpx s LYS 103 N 1.14 4.75 0.08 2.79 1.02 -1.26 -3.91 119.74 124.35 1vpx s LYS 103 Ca 0.11 1.64 0.08 0.00 0.02 0.00 0.00 55.97 57.83 1vpx s LYS 103 Cb -0.14 -3.24 -0.03 0.00 -0.52 0.00 0.00 37.83 33.90 1vpx s LYS 103 CO 0.06 0.37 -0.21 0.95 -0.92 0.00 0.00 175.35 175.59 1vpx s THR 104 N -1.17 1.74 -0.25 2.17 -4.23 -1.26 -0.87 115.64 111.77 1vpx s THR 104 Ca 0.43 -1.41 -0.01 0.00 -1.18 0.00 0.00 61.69 59.52 1vpx s THR 104 Cb -0.29 -1.55 0.07 0.00 1.34 0.00 0.00 72.50 72.08 1vpx s THR 104 CO 0.36 0.07 0.03 0.21 -0.54 0.00 0.00 174.62 174.75 1vpx s ASN 105 N -1.60 3.64 -0.19 3.99 3.84 0.11 -0.69 114.94 124.04 1vpx s ASN 105 Ca 0.07 -1.25 -0.26 0.00 0.21 0.00 0.00 52.86 51.63 1vpx s ASN 105 Cb -0.09 -0.90 -0.01 0.00 -0.55 0.00 0.00 41.25 39.69 1vpx s ASN 105 CO 0.03 -0.32 0.87 -0.69 -2.79 0.00 0.00 177.10 174.20 1vpx s VAL 106 N 1.60 4.84 0.47 -5.21 1.01 -0.51 -0.76 120.40 121.84 1vpx s VAL 106 Ca 0.02 1.70 0.05 0.00 0.00 0.00 0.00 61.98 63.74 1vpx s VAL 106 Cb -0.18 -4.17 -0.03 0.00 0.00 0.00 0.00 36.38 32.01 1vpx s VAL 106 CO -0.13 -0.02 0.13 0.28 0.00 0.00 0.00 175.10 175.36 1vpx s THR 107 N 2.41 1.74 -1.19 3.92 -1.32 -0.02 -0.46 115.64 120.71 1vpx s THR 107 Ca 0.39 -1.82 -0.04 0.00 -1.21 0.00 0.00 61.69 59.01 1vpx s THR 107 Cb -0.16 -2.56 0.00 0.00 -1.51 0.00 0.00 72.50 68.27 1vpx s THR 107 CO 0.11 0.00 1.02 0.18 -2.21 0.00 0.00 174.62 173.72 1vpx n LEU 108 N -1.29 -3.58 -4.58 9.08 4.77 -1.25 -1.24 117.00 118.90 1vpx n LEU 108 Ca -0.08 -0.54 -0.37 0.00 -0.03 0.00 0.00 56.01 54.99 1vpx n LEU 108 Cb 0.66 -2.90 -0.11 0.00 -2.33 0.00 0.00 43.42 38.74 1vpx n LEU 108 CO 0.43 0.49 -0.19 -0.69 -1.33 0.00 0.00 177.39 176.09 1vpx s VAL 109 N -3.31 5.11 0.00 4.08 1.01 -1.21 -4.56 120.40 121.52 1vpx s VAL 109 Ca 0.29 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.37 1vpx s VAL 109 Cb -0.13 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.84 1vpx s VAL 109 CO 0.68 0.29 0.72 0.49 0.00 0.00 0.00 175.10 177.28 1vpx n PHE 110 N 4.82 0.00 -3.84 5.22 3.72 -1.26 -1.58 117.46 124.55 1vpx n PHE 110 Ca -0.15 -0.26 -0.10 0.00 -0.05 0.00 0.00 57.45 56.90 1vpx n PHE 110 Cb 0.52 -0.03 -0.08 0.00 -0.94 0.00 0.00 39.48 38.96 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 -0.52 0.04 0.44 4.37 1.04 -1.26 -5.02 113.70 112.79 1vpx s SER 111 Ca 0.00 -0.45 0.18 0.00 0.48 0.00 0.00 55.95 56.16 1vpx s SER 111 Cb 0.00 0.32 1.01 0.00 0.10 0.00 0.00 66.02 67.45 1vpx s SER 111 CO 0.00 -0.63 1.94 -0.65 0.98 0.00 0.00 173.24 174.89 1vpx h PRO 112 N 3.17 0.00 -0.45 4.02 0.11 -1.96 -2.79 132.00 134.09 1vpx h PRO 112 Ca -0.33 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.71 1vpx h PRO 112 Cb 1.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1vpx h PRO 112 CO 0.51 0.24 0.01 0.00 -0.21 0.00 0.00 178.00 178.55 1vpx h ALA 113 N 1.76 0.61 -0.52 -0.75 0.00 -1.99 -1.99 119.26 116.37 1vpx h ALA 113 Ca -0.00 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.65 1vpx h ALA 113 Cb 0.47 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1vpx h ALA 113 CO 0.03 0.39 0.34 1.96 0.00 0.00 0.00 179.25 181.97 1vpx h GLN 114 N 0.64 0.67 -0.16 0.00 4.20 -1.94 -2.74 115.11 115.77 1vpx h GLN 114 Ca 0.13 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 1vpx h GLN 114 Cb 0.48 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 1vpx h GLN 114 CO 0.02 0.44 0.01 0.00 -0.67 0.00 0.00 178.83 178.63 1vpx h ALA 115 N 1.20 1.72 -0.10 3.87 0.00 -1.29 -1.36 119.26 123.29 1vpx h ALA 115 Ca 0.20 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1vpx h ALA 115 Cb -0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1vpx h ALA 115 CO -0.06 0.22 0.02 0.82 0.00 0.00 0.00 179.25 180.25 1vpx h ILE 116 N 0.22 1.22 -0.75 0.00 2.04 -1.08 -2.46 117.51 116.71 1vpx h ILE 116 Ca 0.05 -0.68 0.03 0.00 1.00 0.00 0.00 64.86 65.26 1vpx h ILE 116 Cb 0.15 1.48 -0.05 0.00 -0.74 0.00 0.00 36.82 37.66 1vpx h ILE 116 CO 0.00 0.20 0.47 -0.07 0.00 0.00 0.00 178.15 178.75 1vpx h LEU 117 N -0.06 0.78 -0.32 1.44 3.38 -1.20 0.54 115.31 119.88 1vpx h LEU 117 Ca 0.03 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.03 1vpx h LEU 117 Cb 0.29 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1vpx h LEU 117 CO 0.00 0.54 0.14 0.00 0.09 0.00 0.00 178.44 179.21 1vpx h ALA 118 N 1.31 0.38 -0.49 1.53 0.00 -1.19 -0.48 119.26 120.32 1vpx h ALA 118 Ca 0.30 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 1vpx h ALA 118 Cb 0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1vpx h ALA 118 CO -0.11 -0.25 0.07 0.00 0.00 0.00 0.00 179.25 178.97 1vpx h ALA 119 N 1.18 0.65 -0.33 0.00 0.00 -0.94 -1.81 119.26 118.01 1vpx h ALA 119 Ca 0.14 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1vpx h ALA 119 Cb 0.07 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1vpx h ALA 119 CO -0.11 0.39 -0.01 0.87 0.00 0.00 0.00 179.25 180.39 1vpx h LYS 120 N 0.69 0.51 0.00 0.00 1.57 -0.51 -1.98 116.57 116.86 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 0.41 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1vpx h LYS 120 CO 0.01 0.54 0.00 0.00 -0.57 0.00 0.00 179.45 179.44 1vpx n ALA 121 N -2.48 1.96 0.00 3.86 0.00 -0.22 -4.90 120.51 118.73 1vpx n ALA 121 Ca 0.01 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1vpx n ALA 121 Cb 0.25 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.28 1vpx n ALA 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vpx n GLY 122 N 0.64 1.71 3.77 0.00 0.00 -0.74 -3.52 105.19 107.05 1vpx n GLY 122 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1vpx n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vpx s ALA 123 N -2.00 3.43 0.06 4.61 0.00 -0.70 -4.82 121.76 122.34 1vpx s ALA 123 Ca 0.00 1.45 -0.19 0.00 0.00 0.00 0.00 51.96 53.23 1vpx s ALA 123 Cb 0.00 -3.57 -0.13 0.00 0.00 0.00 0.00 23.12 19.42 1vpx s ALA 123 CO 0.00 -1.00 1.35 1.15 0.00 0.00 0.00 175.76 177.25 1vpx h THR 124 N 2.74 1.34 -3.68 0.00 2.02 -1.67 -3.36 112.91 110.31 1vpx h THR 124 Ca -0.50 -1.42 -0.40 0.00 0.77 0.00 0.00 66.41 64.85 1vpx h THR 124 Cb 1.25 1.85 -0.19 0.00 -1.74 0.00 0.00 68.15 69.32 1vpx h THR 124 CO 0.63 0.43 -0.76 -0.31 0.37 0.00 0.00 175.52 175.88 1vpx s TYR 125 N -4.22 1.31 0.01 3.16 2.02 0.13 -0.98 117.35 118.79 1vpx s TYR 125 Ca -0.13 -0.55 0.07 0.00 -0.37 0.00 0.00 57.07 56.08 1vpx s TYR 125 Cb 0.06 -0.70 -0.02 0.00 -0.40 0.00 0.00 41.96 40.90 1vpx s TYR 125 CO 0.78 0.10 -0.21 0.54 -1.57 0.00 0.00 175.55 175.20 1vpx s VAL 126 N -2.02 1.66 -0.54 0.71 0.11 -0.35 -1.42 120.40 118.56 1vpx s VAL 126 Ca 0.06 -1.04 0.04 0.00 -2.93 0.00 0.00 61.98 58.11 1vpx s VAL 126 Cb -0.06 -1.41 0.14 0.00 -1.53 0.00 0.00 36.38 33.52 1vpx s VAL 126 CO 0.02 0.35 0.30 -0.44 -3.33 0.00 0.00 175.10 172.00 1vpx s SER 127 N -0.82 4.20 0.22 3.54 0.01 0.39 -0.07 113.70 121.17 1vpx s SER 127 Ca 0.08 -3.10 -0.30 0.00 1.31 0.00 0.00 55.95 53.94 1vpx s SER 127 Cb -0.08 -1.48 -0.09 0.00 0.21 0.00 0.00 66.02 64.57 1vpx s SER 127 CO 0.00 -0.21 1.32 -2.84 0.41 0.00 0.00 173.24 171.92 1vpx s PRO 128 N -0.37 4.38 -0.77 12.44 0.02 -1.22 -3.30 135.00 146.18 1vpx s PRO 128 Ca 0.19 2.09 -0.17 0.00 0.02 0.00 0.00 61.00 63.13 1vpx s PRO 128 Cb -0.21 -3.17 0.15 0.00 0.02 0.00 0.00 34.50 31.29 1vpx s PRO 128 CO -0.04 -0.25 0.84 -0.06 -0.33 0.00 0.00 177.00 177.17 1vpx s PHE 129 N -0.08 3.32 -0.01 6.54 0.40 -0.61 -1.33 117.98 126.20 1vpx s PHE 129 Ca 0.56 -1.47 -0.22 0.00 -0.60 0.00 0.00 56.93 55.19 1vpx s PHE 129 Cb -0.37 -4.02 -0.15 0.00 0.51 0.00 0.00 43.02 38.99 1vpx s PHE 129 CO 0.40 -1.23 1.01 0.28 0.70 0.00 0.00 175.22 176.38 1vpx h VAL 130 N 5.49 0.52 -0.40 -0.44 2.07 -1.44 -3.12 116.25 118.92 1vpx h VAL 130 Ca -0.02 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 1vpx h VAL 130 Cb 1.05 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1vpx h VAL 130 CO 0.98 0.11 0.19 1.23 0.02 0.00 0.00 177.57 180.09 1vpx h GLY 131 N -0.92 0.59 1.44 2.17 0.00 -0.99 -0.61 103.07 104.76 1vpx h GLY 131 Ca -0.05 -0.26 -0.15 0.00 0.00 0.00 0.00 47.33 46.88 1vpx h GLY 131 CO 0.08 0.25 -0.46 3.21 0.00 0.00 0.00 176.54 179.62 1vpx h ARG 132 N 0.55 0.60 -0.37 4.80 3.08 -1.78 -2.22 114.38 119.05 1vpx h ARG 132 Ca 0.14 -0.33 -0.07 0.00 0.07 0.00 0.00 59.98 59.79 1vpx h ARG 132 Cb 0.06 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1vpx h ARG 132 CO -0.02 0.93 -0.05 0.52 -1.07 0.00 0.00 179.97 180.28 1vpx h MET 133 N 0.48 0.68 -0.93 0.04 2.86 -1.37 -3.02 114.93 113.67 1vpx h MET 133 Ca 0.03 -0.24 0.16 0.00 -2.06 0.00 0.00 59.70 57.59 1vpx h MET 133 Cb 0.98 -0.05 -0.10 0.00 0.06 0.00 0.00 31.60 32.50 1vpx h MET 133 CO 0.09 0.82 0.53 -0.44 1.06 0.00 0.00 176.91 178.96 1vpx h ASP 134 N 0.48 0.68 0.43 1.22 5.19 -1.04 -1.69 116.42 121.70 1vpx h ASP 134 Ca 0.10 0.09 -0.04 0.00 -0.62 0.00 0.00 57.03 56.56 1vpx h ASP 134 Cb 0.54 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.01 1vpx h ASP 134 CO 0.03 0.28 -0.17 0.44 -3.12 0.00 0.00 179.24 176.70 1vpx h ASP 135 N 0.73 0.00 0.13 6.45 3.32 -1.27 0.13 116.42 125.90 1vpx h ASP 135 Ca 0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.56 1vpx h ASP 135 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1vpx h ASP 135 CO -0.35 0.17 -0.02 0.18 -1.72 0.00 0.00 179.24 177.49 1vpx n LEU 136 N -3.71 0.40 -1.51 1.55 4.77 -0.65 -4.92 117.00 112.94 1vpx n LEU 136 Ca -0.02 -0.07 -0.19 0.00 -0.03 0.00 0.00 56.01 55.71 1vpx n LEU 136 Cb 0.28 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.24 1vpx n LEU 136 CO 0.32 0.07 -0.18 -1.20 -1.33 0.00 0.00 177.39 175.06 1vpx n SER 137 N -0.78 -5.25 -1.46 -1.43 7.64 0.03 -4.88 113.62 107.48 1vpx n SER 137 Ca 0.20 0.40 0.11 0.00 1.01 0.00 0.00 58.87 60.58 1vpx n SER 137 Cb 0.21 -4.38 0.34 0.00 -1.01 0.00 0.00 64.21 59.37 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 -1.06 4.30 -2.28 6.43 5.03 -1.13 -5.03 115.26 121.52 1vpx n ASN 138 Ca -0.19 -2.21 -0.02 0.00 0.87 0.00 0.00 54.58 53.03 1vpx n ASN 138 Cb 0.62 -0.53 0.00 0.00 -1.02 0.00 0.00 39.78 38.85 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 1.39 -5.74 0.14 6.41 -0.08 -1.25 -4.84 116.55 112.59 1vpx n ASP 139 Ca 0.25 0.71 -0.01 0.00 -1.51 0.00 0.00 54.79 54.23 1vpx n ASP 139 Cb 0.74 -3.72 0.19 0.00 2.34 0.00 0.00 41.12 40.67 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 1.69 0.00 1.73 0.27 0.00 -1.76 -2.93 103.07 102.06 1vpx h GLY 140 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 1vpx h GLY 140 CO 0.08 0.00 -0.37 1.98 0.00 0.00 0.00 176.54 178.24 1vpx h MET 141 N 0.00 0.30 -0.39 4.80 1.85 -1.93 -1.08 114.93 118.49 1vpx h MET 141 Ca -0.01 -0.13 -0.13 0.00 -0.61 0.00 0.00 59.70 58.82 1vpx h MET 141 Cb 1.06 -0.01 -0.01 0.00 0.43 0.00 0.00 31.60 33.07 1vpx h MET 141 CO 0.08 0.63 -0.25 -0.09 -0.40 0.00 0.00 176.91 176.88 1vpx h ARG 142 N 0.26 0.86 -0.18 0.39 9.65 -1.89 -0.23 114.38 123.24 1vpx h ARG 142 Ca 0.03 -0.40 -0.12 0.00 -1.10 0.00 0.00 59.98 58.39 1vpx h ARG 142 Cb 0.77 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.33 1vpx h ARG 142 CO 0.06 1.04 -0.42 0.00 2.80 0.00 0.00 179.97 183.45 1vpx h MET 143 N 0.67 0.42 -0.65 0.20 -0.00 -1.33 -1.76 114.93 112.48 1vpx h MET 143 Ca 0.08 -0.21 -0.06 0.00 -0.00 0.00 0.00 59.70 59.51 1vpx h MET 143 Cb 0.82 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 32.39 1vpx h MET 143 CO 0.07 0.77 0.18 1.25 -0.00 0.00 0.00 176.91 179.18 1vpx h LEU 144 N 0.35 0.96 -1.51 -0.10 5.85 -1.05 -2.28 115.31 117.52 1vpx h LEU 144 Ca 0.03 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.51 1vpx h LEU 144 Cb 0.89 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 1vpx h LEU 144 CO 0.07 0.93 0.10 1.23 -0.34 0.00 0.00 178.44 180.44 1vpx h GLY 145 N 0.95 0.46 1.32 3.75 0.00 -0.65 -0.90 103.07 107.99 1vpx h GLY 145 Ca 0.21 -0.21 -0.15 0.00 0.00 0.00 0.00 47.33 47.18 1vpx h GLY 145 CO -0.00 0.20 -0.41 0.83 0.00 0.00 0.00 176.54 177.16 1vpx h GLU 146 N 0.43 0.74 -0.12 4.80 5.08 -0.96 -1.88 114.58 122.67 1vpx h GLU 146 Ca 0.11 -0.39 -0.05 0.00 -1.00 0.00 0.00 59.36 58.02 1vpx h GLU 146 Cb 0.12 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1vpx h GLU 146 CO -0.01 1.01 -0.12 0.82 -1.00 0.00 0.00 179.01 179.71 1vpx h ILE 147 N 0.61 1.36 -0.55 3.13 2.04 -1.00 -2.01 117.51 121.08 1vpx h ILE 147 Ca 0.05 -1.29 0.09 0.00 1.00 0.00 0.00 64.86 64.71 1vpx h ILE 147 Cb 0.96 1.94 -0.07 0.00 -0.74 0.00 0.00 36.82 38.91 1vpx h ILE 147 CO 0.09 0.37 0.15 0.58 0.00 0.00 0.00 178.15 179.34 1vpx h VAL 148 N -0.11 0.73 -0.32 1.67 2.07 -1.16 0.52 116.25 119.65 1vpx h VAL 148 Ca 0.02 -0.10 0.04 0.00 0.82 0.00 0.00 66.70 67.47 1vpx h VAL 148 Cb 0.65 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 1vpx h VAL 148 CO 0.03 0.06 0.10 -0.08 0.02 0.00 0.00 177.57 177.70 1vpx h GLU 149 N 0.31 0.23 -0.28 1.57 4.57 -1.27 0.11 114.58 119.82 1vpx h GLU 149 Ca 0.28 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.42 1vpx h GLU 149 Cb 0.37 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 1vpx h GLU 149 CO -0.33 0.15 0.07 0.82 -1.18 0.00 0.00 179.01 178.55 1vpx h ILE 150 N 0.24 1.21 -0.45 2.32 2.04 -0.86 -1.05 117.51 120.96 1vpx h ILE 150 Ca 0.15 -0.69 -0.06 0.00 1.00 0.00 0.00 64.86 65.26 1vpx h ILE 150 Cb 0.13 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 1vpx h ILE 150 CO -0.16 0.22 0.04 1.88 0.00 0.00 0.00 178.15 180.13 1vpx h TYR 151 N 0.28 0.75 -0.78 1.37 -1.99 -0.63 -1.66 116.97 114.31 1vpx h TYR 151 Ca 0.09 -0.08 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 1vpx h TYR 151 Cb 0.27 -0.21 -0.04 0.00 2.00 0.00 0.00 36.73 38.75 1vpx h TYR 151 CO 0.01 0.68 0.43 -0.91 -0.00 0.00 0.00 178.16 178.37 1vpx h ASN 152 N 0.68 0.96 0.01 3.88 2.35 -0.47 0.82 115.58 123.82 1vpx h ASN 152 Ca 0.14 -0.09 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 1vpx h ASN 152 Cb 0.37 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 1vpx h ASN 152 CO 0.01 0.78 -0.04 0.78 -1.65 0.00 0.00 177.43 177.31 1vpx h ASN 153 N 1.07 0.08 -0.00 5.81 2.35 -0.25 -3.25 115.58 121.39 1vpx h ASN 153 Ca 0.27 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1vpx h ASN 153 Cb 0.02 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1vpx h ASN 153 CO -0.05 0.15 -0.04 -1.22 -1.65 0.00 0.00 177.43 174.62 1vpx n TYR 154 N -4.43 0.00 -3.45 1.19 4.01 -1.00 -5.03 117.16 108.45 1vpx n TYR 154 Ca -0.02 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.47 1vpx n TYR 154 Cb 0.16 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.23 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 0.61 -0.52 3.69 2.72 0.00 0.27 -4.92 105.19 107.03 1vpx n GLY 155 Ca 0.01 0.19 -0.44 0.00 0.00 0.00 0.00 46.02 45.78 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 -4.68 2.27 0.27 1.61 3.72 -1.23 -4.87 117.46 114.54 1vpx n PHE 156 Ca -0.03 0.44 0.16 0.00 -0.05 0.00 0.00 57.45 57.97 1vpx n PHE 156 Cb 0.57 -2.46 0.70 0.00 -0.94 0.00 0.00 39.48 37.35 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 3.86 0.00 -6.41 -1.08 5.08 -1.91 -3.44 114.58 110.68 1vpx h GLU 157 Ca -0.45 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.28 1vpx h GLU 157 Cb 1.27 0.00 0.07 0.00 0.50 0.00 0.00 28.75 30.59 1vpx h GLU 157 CO 0.73 0.07 0.47 2.41 -1.00 0.00 0.00 179.01 181.69 1vpx n THR 158 N -3.24 0.59 -3.99 1.13 -1.04 -1.26 -4.97 114.28 101.50 1vpx n THR 158 Ca -0.00 -0.15 -0.36 0.00 -2.04 0.00 0.00 64.05 61.50 1vpx n THR 158 Cb 0.30 -1.10 -0.07 0.00 -1.82 0.00 0.00 70.33 67.64 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 -0.02 3.33 -0.19 -2.82 2.02 -0.16 -4.94 118.70 115.92 1vpx s GLU 159 Ca 0.75 -0.22 -0.21 0.00 0.02 0.00 0.00 54.97 55.32 1vpx s GLU 159 Cb -0.80 -3.09 -0.03 0.00 0.10 0.00 0.00 34.13 30.32 1vpx s GLU 159 CO 0.48 0.75 0.62 0.42 0.02 0.00 0.00 175.26 177.55 1vpx s ILE 160 N -1.03 5.03 -0.48 -1.63 1.01 -1.26 -1.21 121.20 121.63 1vpx s ILE 160 Ca 0.16 1.16 -0.16 0.00 0.00 0.00 0.00 60.65 61.82 1vpx s ILE 160 Cb -0.12 -3.93 0.08 0.00 0.01 0.00 0.00 42.46 38.49 1vpx s ILE 160 CO 0.05 0.13 0.41 -0.63 0.00 0.00 0.00 174.94 174.90 1vpx s ILE 161 N 1.81 5.23 -0.15 2.92 1.01 0.89 -1.13 121.20 131.78 1vpx s ILE 161 Ca 0.28 -1.08 -0.29 0.00 0.00 0.00 0.00 60.65 59.57 1vpx s ILE 161 Cb -0.16 -4.14 -0.06 0.00 0.01 0.00 0.00 42.46 38.11 1vpx s ILE 161 CO 0.11 -0.60 2.12 0.00 0.00 0.00 0.00 174.94 176.56 1vpx s ALA 162 N 1.65 2.99 0.49 9.38 0.00 0.11 -3.42 121.76 132.96 1vpx s ALA 162 Ca 0.04 0.91 0.04 0.00 0.00 0.00 0.00 51.96 52.95 1vpx s ALA 162 Cb -0.25 -4.00 -0.02 0.00 0.00 0.00 0.00 23.12 18.85 1vpx s ALA 162 CO 0.06 -2.42 0.13 0.00 0.00 0.00 0.00 175.76 173.53 1vpx s ALA 163 N 7.10 3.97 -1.34 0.00 0.00 -0.44 -1.77 121.76 129.27 1vpx s ALA 163 Ca 0.96 -1.17 -0.04 0.00 0.00 0.00 0.00 51.96 51.70 1vpx s ALA 163 Cb -0.35 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.58 1vpx s ALA 163 CO 0.37 -0.16 0.91 0.45 0.00 0.00 0.00 175.76 177.32 1vpx n SER 164 N -1.34 -2.95 -4.71 0.00 2.88 -1.26 -1.49 113.62 104.75 1vpx n SER 164 Ca -0.10 -0.72 -0.39 0.00 -1.33 0.00 0.00 58.87 56.34 1vpx n SER 164 Cb 0.66 -4.44 -0.05 0.00 -0.75 0.00 0.00 64.21 59.62 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 -3.46 5.11 -0.02 2.46 -1.09 -1.26 -0.56 121.20 122.38 1vpx s ILE 165 Ca 0.23 1.16 0.04 0.00 -2.23 0.00 0.00 60.65 59.86 1vpx s ILE 165 Cb -0.11 -3.92 -0.06 0.00 -1.58 0.00 0.00 42.46 36.79 1vpx s ILE 165 CO 0.78 0.27 0.06 0.54 -1.23 0.00 0.00 174.94 175.36 1vpx n ARG 166 N 3.93 1.64 -3.55 2.79 5.12 -1.26 -4.42 116.66 120.91 1vpx n ARG 166 Ca -0.04 -0.02 -0.09 0.00 -1.93 0.00 0.00 57.85 55.77 1vpx n ARG 166 Cb 0.51 -1.11 -0.02 0.00 -1.16 0.00 0.00 32.46 30.69 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 -2.21 -0.36 0.37 -1.55 -3.43 -1.26 -4.93 115.29 101.91 1vpx s HIS 167 Ca -0.02 0.15 0.15 0.00 -0.80 0.00 0.00 55.06 54.53 1vpx s HIS 167 Cb 0.02 0.58 1.00 0.00 -1.43 0.00 0.00 32.58 32.75 1vpx s HIS 167 CO 0.18 -0.75 1.77 -1.35 -2.00 0.00 0.00 174.74 172.59 1vpx h PRO 168 N 2.00 0.48 0.00 -0.38 0.11 -1.98 -2.40 132.00 129.82 1vpx h PRO 168 Ca -0.26 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.73 1vpx h PRO 168 Cb 1.26 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1vpx h PRO 168 CO 0.32 0.32 -0.42 0.52 -0.21 0.00 0.00 178.00 178.52 1vpx h MET 169 N 0.49 0.00 -0.57 1.05 2.86 -1.99 -1.37 114.93 115.41 1vpx h MET 169 Ca 0.59 0.00 0.09 0.00 -2.06 0.00 0.00 59.70 58.32 1vpx h MET 169 Cb 1.33 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.92 1vpx h MET 169 CO -0.34 0.42 0.20 0.45 1.06 0.00 0.00 176.91 178.71 1vpx h HIS 170 N 0.00 0.35 -0.20 -0.22 3.86 -1.85 0.63 115.15 117.72 1vpx h HIS 170 Ca -0.00 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.21 1vpx h HIS 170 Cb 0.86 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 29.26 1vpx h HIS 170 CO 0.00 0.09 0.02 0.28 0.86 0.00 0.00 177.93 179.19 1vpx h VAL 171 N 0.38 1.23 -0.26 2.45 2.07 -1.32 -0.35 116.25 120.45 1vpx h VAL 171 Ca 0.28 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 1vpx h VAL 171 Cb 0.34 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 1vpx h VAL 171 CO -0.29 0.24 0.07 0.58 0.02 0.00 0.00 177.57 178.18 1vpx h VAL 172 N 0.12 1.21 -0.35 2.57 2.07 -1.17 0.55 116.25 121.25 1vpx h VAL 172 Ca 0.06 -0.69 -0.10 0.00 0.82 0.00 0.00 66.70 66.80 1vpx h VAL 172 Cb 0.33 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1vpx h VAL 172 CO 0.01 0.22 -0.18 -0.33 0.02 0.00 0.00 177.57 177.30 1vpx h GLU 173 N 0.25 0.64 -0.64 1.57 5.08 -0.85 0.39 114.58 121.03 1vpx h GLU 173 Ca 0.08 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.16 1vpx h GLU 173 Cb 0.28 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1vpx h GLU 173 CO 0.00 0.79 0.20 0.00 -1.00 0.00 0.00 179.01 179.00 1vpx h ALA 174 N 1.22 0.84 -0.75 3.43 0.00 -0.86 -2.61 119.26 120.54 1vpx h ALA 174 Ca 0.09 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1vpx h ALA 174 Cb 0.64 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1vpx h ALA 174 CO 0.05 0.52 0.32 0.00 0.00 0.00 0.00 179.25 180.13 1vpx h ALA 175 N 1.08 0.97 -0.09 0.00 0.00 -0.44 -1.56 119.26 119.23 1vpx h ALA 175 Ca 0.21 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1vpx h ALA 175 Cb 0.30 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1vpx h ALA 175 CO -0.01 0.58 -0.17 -0.07 0.00 0.00 0.00 179.25 179.58 1vpx h LEU 176 N 1.07 0.13 0.00 0.00 3.38 -0.80 -1.97 115.31 117.12 1vpx h LEU 176 Ca 0.25 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1vpx h LEU 176 Cb 0.18 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1vpx h LEU 176 CO -0.02 0.31 -0.22 0.24 0.09 0.00 0.00 178.44 178.84 1vpx h MET 177 N 0.13 0.00 -0.52 1.13 2.86 -1.20 -3.48 114.93 113.85 1vpx h MET 177 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1vpx h MET 177 Cb 0.38 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.04 1vpx h MET 177 CO 0.02 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.40 1vpx n GLY 178 N 1.14 0.91 3.73 8.32 0.00 -0.65 -4.99 105.19 113.65 1vpx n GLY 178 Ca 0.03 -0.56 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.52 2.14 0.05 1.61 1.01 -0.83 -4.94 120.40 116.94 1vpx s VAL 179 Ca 0.00 0.09 -0.19 0.00 0.00 0.00 0.00 61.98 61.87 1vpx s VAL 179 Cb 0.00 -2.97 -0.13 0.00 0.00 0.00 0.00 36.38 33.28 1vpx s VAL 179 CO 0.00 -0.02 1.39 0.44 0.00 0.00 0.00 175.10 176.90 1vpx h ASP 180 N 0.45 0.43 -4.17 3.32 3.32 -1.91 -3.46 116.42 114.39 1vpx h ASP 180 Ca -0.50 -0.45 -0.20 0.00 0.02 0.00 0.00 57.03 55.90 1vpx h ASP 180 Cb 1.33 -0.12 -0.25 0.00 0.22 0.00 0.00 39.33 40.50 1vpx h ASP 180 CO 0.53 0.78 -0.67 -0.63 -1.72 0.00 0.00 179.24 177.53 1vpx s ILE 181 N -4.44 0.04 -0.09 0.35 1.01 -0.28 -1.78 121.20 116.00 1vpx s ILE 181 Ca -0.14 -0.30 0.04 0.00 0.00 0.00 0.00 60.65 60.26 1vpx s ILE 181 Cb 0.06 -0.15 -0.00 0.00 0.01 0.00 0.00 42.46 42.38 1vpx s ILE 181 CO 0.76 -0.16 -0.24 -0.69 0.00 0.00 0.00 174.94 174.61 1vpx s VAL 182 N -0.48 2.09 -0.14 2.92 1.01 -0.55 -0.71 120.40 124.54 1vpx s VAL 182 Ca -0.05 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 60.90 1vpx s VAL 182 Cb -0.03 -1.79 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 1vpx s VAL 182 CO -0.00 0.56 -0.10 0.28 0.00 0.00 0.00 175.10 175.84 1vpx s THR 183 N 0.26 3.34 -0.04 3.92 -1.32 -0.73 -0.87 115.64 120.20 1vpx s THR 183 Ca -0.16 -0.56 -0.11 0.00 -1.21 0.00 0.00 61.69 59.65 1vpx s THR 183 Cb -0.17 -2.42 0.02 0.00 -1.51 0.00 0.00 72.50 68.41 1vpx s THR 183 CO 0.08 0.52 0.25 0.00 -2.21 0.00 0.00 174.62 173.26 1vpx s MET 184 N 0.33 0.51 0.65 7.08 0.23 -0.66 -4.24 119.30 123.20 1vpx s MET 184 Ca -0.08 -0.07 -0.17 0.00 -1.03 0.00 0.00 55.69 54.33 1vpx s MET 184 Cb -0.15 0.23 -0.03 0.00 -1.53 0.00 0.00 34.83 33.35 1vpx s MET 184 CO 0.05 -0.12 0.99 -2.30 -2.03 0.00 0.00 175.02 171.61 1vpx n PRO 185 N 1.84 0.77 -0.36 3.16 -0.02 -1.26 -1.43 135.00 137.70 1vpx n PRO 185 Ca -0.19 0.31 0.01 0.00 -2.02 0.00 0.00 63.50 61.61 1vpx n PRO 185 Cb 0.56 -2.22 0.16 0.00 -0.02 0.00 0.00 33.50 31.98 1vpx n PRO 185 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1vpx h PHE 186 N 0.21 1.19 -0.68 6.00 3.57 -1.96 -1.78 116.94 123.49 1vpx h PHE 186 Ca -0.48 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.12 1vpx h PHE 186 Cb 1.35 -0.39 -0.04 0.00 2.79 0.00 0.00 35.95 39.66 1vpx h PHE 186 CO 0.38 0.64 0.45 0.00 -2.23 0.00 0.00 178.31 177.55 1vpx h ALA 187 N 1.43 1.81 -0.24 2.41 0.00 -1.97 0.07 119.26 122.77 1vpx h ALA 187 Ca 0.41 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.24 1vpx h ALA 187 Cb 0.10 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1vpx h ALA 187 CO -0.15 0.07 -0.12 0.28 0.00 0.00 0.00 179.25 179.32 1vpx h VAL 188 N 0.63 1.30 -0.46 0.00 2.07 -1.70 -2.91 116.25 115.19 1vpx h VAL 188 Ca 0.30 -1.21 0.03 0.00 0.82 0.00 0.00 66.70 66.65 1vpx h VAL 188 Cb 0.36 1.58 -0.04 0.00 -1.52 0.00 0.00 31.29 31.67 1vpx h VAL 188 CO -0.10 0.37 0.24 0.25 0.02 0.00 0.00 177.57 178.36 1vpx h LEU 189 N 0.22 0.37 -0.74 2.57 5.85 -0.86 -1.89 115.31 120.83 1vpx h LEU 189 Ca 0.05 0.02 0.12 0.00 0.84 0.00 0.00 57.88 58.91 1vpx h LEU 189 Cb 0.63 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.52 1vpx h LEU 189 CO 0.04 0.26 0.33 -0.33 -0.34 0.00 0.00 178.44 178.40 1vpx h GLU 190 N 0.49 0.51 -0.51 1.25 5.08 -1.04 -1.73 114.58 118.63 1vpx h GLU 190 Ca 0.19 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1vpx h GLU 190 Cb 0.07 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1vpx h GLU 190 CO -0.12 0.34 0.32 0.87 -1.00 0.00 0.00 179.01 179.42 1vpx h LYS 191 N 0.53 0.68 -0.17 2.33 1.57 -1.15 -2.90 116.57 117.46 1vpx h LYS 191 Ca 0.39 -0.05 0.05 0.00 -1.87 0.00 0.00 60.65 59.17 1vpx h LYS 191 Cb 0.50 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1vpx h LYS 191 CO -0.34 0.47 0.14 -0.07 -0.57 0.00 0.00 179.45 179.08 1vpx h LEU 192 N 0.70 0.00 -1.22 2.94 4.07 -0.81 -1.35 115.31 119.64 1vpx h LEU 192 Ca 0.19 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 58.07 1vpx h LEU 192 Cb -0.04 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.69 1vpx h LEU 192 CO -0.04 0.00 -0.35 -0.26 -1.08 0.00 0.00 178.44 176.71 1vpx h PHE 193 N 0.00 0.00 -3.12 1.13 -1.00 -1.56 -3.47 116.94 108.92 1vpx h PHE 193 Ca 0.08 0.00 -0.59 0.00 2.81 0.00 0.00 57.97 60.27 1vpx h PHE 193 Cb 0.35 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 39.87 1vpx h PHE 193 CO 0.00 0.35 -0.21 0.15 -1.61 0.00 0.00 178.31 176.99 1vpx s LYS 194 N -3.94 3.82 -0.27 1.51 1.02 -0.51 -5.08 119.74 116.29 1vpx s LYS 194 Ca -0.02 0.27 -0.20 0.00 0.02 0.00 0.00 55.97 56.04 1vpx s LYS 194 Cb 0.13 -3.03 0.07 0.00 -0.52 0.00 0.00 37.83 34.48 1vpx s LYS 194 CO 0.69 0.57 0.70 -1.58 -0.92 0.00 0.00 175.35 174.81 1vpx s HIS 195 N -1.35 -0.92 0.49 3.18 2.46 -1.26 -5.05 115.29 112.84 1vpx s HIS 195 Ca 0.32 2.02 0.21 0.00 0.47 0.00 0.00 55.06 58.07 1vpx s HIS 195 Cb -0.15 0.45 1.32 0.00 -0.13 0.00 0.00 32.58 34.08 1vpx s HIS 195 CO 0.17 -0.45 2.10 -1.00 -2.47 0.00 0.00 174.74 173.09 1vpx h PRO 196 N 6.03 0.00 -0.09 2.88 0.13 -2.00 -1.87 132.00 137.08 1vpx h PRO 196 Ca -0.30 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.66 1vpx h PRO 196 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1vpx h PRO 196 CO 0.11 0.10 -0.67 0.52 -0.23 0.00 0.00 178.00 177.83 1vpx h MET 197 N 0.00 0.39 -0.59 0.86 2.86 -1.98 -1.88 114.93 114.58 1vpx h MET 197 Ca -0.00 -0.29 -0.01 0.00 -2.06 0.00 0.00 59.70 57.34 1vpx h MET 197 Cb 0.19 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.88 1vpx h MET 197 CO 0.01 0.92 0.33 1.15 1.06 0.00 0.00 176.91 180.38 1vpx h THR 198 N 0.28 1.19 -0.64 2.22 2.02 -1.76 0.19 112.91 116.40 1vpx h THR 198 Ca -0.02 -0.46 -0.04 0.00 0.77 0.00 0.00 66.41 66.67 1vpx h THR 198 Cb 1.22 0.42 -0.03 0.00 -1.74 0.00 0.00 68.15 68.02 1vpx h THR 198 CO 0.11 0.20 0.24 0.44 0.37 0.00 0.00 175.52 176.88 1vpx h ASP 199 N 0.80 0.89 -0.40 4.18 3.32 -1.35 -1.18 116.42 122.68 1vpx h ASP 199 Ca 0.21 -0.18 -0.13 0.00 0.02 0.00 0.00 57.03 56.94 1vpx h ASP 199 Cb 0.02 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1vpx h ASP 199 CO -0.04 0.83 -0.26 -0.07 -1.72 0.00 0.00 179.24 177.99 1vpx h LEU 200 N 0.90 0.95 -0.79 1.55 3.38 -1.25 -1.91 115.31 118.15 1vpx h LEU 200 Ca 0.21 -0.37 0.02 0.00 0.09 0.00 0.00 57.88 57.83 1vpx h LEU 200 Cb 0.23 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 1vpx h LEU 200 CO -0.01 1.15 0.51 1.23 0.09 0.00 0.00 178.44 181.41 1vpx h GLY 201 N 0.89 1.13 1.09 0.83 0.00 -0.66 -0.68 103.07 105.67 1vpx h GLY 201 Ca 0.10 -0.40 -0.11 0.00 0.00 0.00 0.00 47.33 46.91 1vpx h GLY 201 CO 0.07 0.37 -0.11 -2.22 0.00 0.00 0.00 176.54 174.65 1vpx h ILE 202 N 1.03 1.27 -0.83 2.60 2.04 -1.03 -0.49 117.51 122.08 1vpx h ILE 202 Ca 0.30 -1.26 -0.03 0.00 1.00 0.00 0.00 64.86 64.87 1vpx h ILE 202 Cb -0.06 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 1vpx h ILE 202 CO -0.09 0.45 0.42 -0.33 0.00 0.00 0.00 178.15 178.60 1vpx h GLU 203 N 0.90 1.19 -0.15 2.37 5.08 -1.09 -1.49 114.58 121.38 1vpx h GLU 203 Ca 0.14 -0.17 -0.14 0.00 -1.00 0.00 0.00 59.36 58.20 1vpx h GLU 203 Cb 0.67 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1vpx h GLU 203 CO 0.05 0.91 -0.49 -0.09 -1.00 0.00 0.00 179.01 178.39 1vpx h ARG 204 N 1.18 0.40 0.00 2.33 9.65 -0.87 -2.51 114.38 124.57 1vpx h ARG 204 Ca 0.29 -0.23 0.00 0.00 -1.10 0.00 0.00 59.98 58.94 1vpx h ARG 204 Cb 0.09 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 1vpx h ARG 204 CO -0.04 0.80 -0.29 0.74 2.80 0.00 0.00 179.97 183.98 1vpx h PHE 205 N 0.32 0.00 0.37 2.20 0.04 -0.94 -3.28 116.94 115.66 1vpx h PHE 205 Ca 0.02 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.77 1vpx h PHE 205 Cb 0.97 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.13 1vpx h PHE 205 CO 0.03 0.00 -0.18 0.52 -0.60 0.00 0.00 178.31 178.08 1vpx h MET 206 N 0.00 -0.48 -1.34 1.51 2.86 -1.16 -3.19 114.93 113.13 1vpx h MET 206 Ca 0.00 0.03 0.42 0.00 -2.06 0.00 0.00 59.70 58.10 1vpx h MET 206 Cb 0.86 0.11 -0.12 0.00 0.06 0.00 0.00 31.60 32.52 1vpx h MET 206 CO 0.00 -0.19 0.88 1.05 1.06 0.00 0.00 176.91 179.71 1vpx h GLU 207 N -0.99 0.10 0.00 1.72 4.11 -1.54 -3.52 114.58 114.46 1vpx h GLU 207 Ca -0.05 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.37 1vpx h GLU 207 Cb 0.52 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1vpx h GLU 207 CO 0.08 0.07 0.00 -0.25 0.07 0.00 0.00 179.01 178.98