#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vdm s VAL 2 N 0.00 3.11 -0.20 6.31 1.01 -1.26 -4.24 120.40 125.13 2vdm s VAL 2 Ca 0.00 0.72 -0.13 0.00 0.00 0.00 0.00 61.98 62.57 2vdm s VAL 2 Cb 0.00 -3.46 0.06 0.00 0.00 0.00 0.00 36.38 32.98 2vdm s VAL 2 CO 0.00 0.03 0.51 -1.58 0.00 0.00 0.00 175.10 174.06 2vdm s GLN 3 N 1.64 0.52 -0.30 2.72 0.74 -0.67 -5.04 119.66 119.27 2vdm s GLN 3 Ca 0.68 0.88 -0.08 0.00 0.05 0.00 0.00 55.36 56.88 2vdm s GLN 3 Cb -0.39 0.10 -0.00 0.00 1.10 0.00 0.00 33.01 33.82 2vdm s GLN 3 CO 0.30 -0.13 0.12 -0.51 -0.55 0.00 0.00 175.29 174.52 2vdm s LEU 4 N 1.17 4.00 -0.36 3.68 1.02 -1.26 -1.31 118.68 125.62 2vdm s LEU 4 Ca -0.07 -0.59 -0.10 0.00 0.02 0.00 0.00 54.13 53.39 2vdm s LEU 4 Cb -0.06 -1.95 0.02 0.00 0.02 0.00 0.00 46.19 44.22 2vdm s LEU 4 CO -0.11 -0.19 0.19 -1.10 0.02 0.00 0.00 176.35 175.16 2vdm s GLN 5 N 1.57 2.90 0.23 1.70 -0.21 -0.53 -4.06 119.66 121.26 2vdm s GLN 5 Ca 0.04 -1.03 -0.02 0.00 0.02 0.00 0.00 55.36 54.37 2vdm s GLN 5 Cb -0.17 -3.68 -0.05 0.00 1.00 0.00 0.00 33.01 30.12 2vdm s GLN 5 CO 0.05 -0.65 0.45 -0.65 -2.12 0.00 0.00 175.29 172.37 2vdm s GLN 6 N 1.55 3.56 0.84 2.91 -0.21 -1.26 -0.92 119.66 126.13 2vdm s GLN 6 Ca 0.02 -0.21 -0.11 0.00 0.02 0.00 0.00 55.36 55.08 2vdm s GLN 6 Cb -0.19 -2.77 0.10 0.00 1.00 0.00 0.00 33.01 31.15 2vdm s GLN 6 CO 0.06 0.33 1.09 -1.54 -2.12 0.00 0.00 175.29 173.12 2vdm s SER 7 N -3.15 3.98 1.18 5.90 1.04 -0.80 -4.98 113.70 116.86 2vdm s SER 7 Ca 0.40 1.55 -0.19 0.00 0.48 0.00 0.00 55.95 58.20 2vdm s SER 7 Cb -0.11 -2.25 0.28 0.00 0.10 0.00 0.00 66.02 64.04 2vdm s SER 7 CO 0.29 -2.33 1.14 -0.83 0.98 0.00 0.00 173.24 172.49 2vdm s GLY 8 N -3.50 1.61 0.61 7.32 0.00 -1.26 -4.68 107.32 107.41 2vdm s GLY 8 Ca 0.62 -0.99 -0.20 0.00 0.00 0.00 0.00 44.72 44.16 2vdm s GLY 8 CO 0.56 -0.11 1.33 0.00 0.00 0.00 0.00 173.10 174.88 2vdm s ALA 9 N -3.12 2.57 -0.10 3.20 0.00 -1.26 -4.71 121.76 118.34 2vdm s ALA 9 Ca 0.71 1.29 0.03 0.00 0.00 0.00 0.00 51.96 53.99 2vdm s ALA 9 Cb -0.09 -3.57 0.01 0.00 0.00 0.00 0.00 23.12 19.47 2vdm s ALA 9 CO 0.56 -1.53 -0.20 -1.21 0.00 0.00 0.00 175.76 173.38 2vdm s GLU 10 N -3.18 2.65 -0.36 0.00 0.41 0.47 -4.98 118.70 113.71 2vdm s GLU 10 Ca 0.78 -0.74 -0.04 0.00 -0.41 0.00 0.00 54.97 54.56 2vdm s GLU 10 Cb -0.39 -2.06 0.07 0.00 -1.78 0.00 0.00 34.13 29.97 2vdm s GLU 10 CO 0.44 0.10 0.13 -1.17 -0.49 0.00 0.00 175.26 174.27 2vdm s LEU 11 N 0.52 4.65 0.20 1.80 2.96 -1.26 -0.91 118.68 126.63 2vdm s LEU 11 Ca -0.16 -1.55 0.10 0.00 -0.22 0.00 0.00 54.13 52.30 2vdm s LEU 11 Cb -0.17 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.65 2vdm s LEU 11 CO 0.06 -0.42 -0.20 0.68 -1.32 0.00 0.00 176.35 175.15 2vdm s VAL 12 N 1.27 2.12 0.06 1.68 -7.23 -0.52 -5.00 120.40 112.77 2vdm s VAL 12 Ca 0.01 -2.08 -0.08 0.00 -1.81 0.00 0.00 61.98 58.02 2vdm s VAL 12 Cb -0.21 -2.05 -0.05 0.00 0.56 0.00 0.00 36.38 34.63 2vdm s VAL 12 CO -0.01 -0.29 0.34 -0.54 -0.31 0.00 0.00 175.10 174.29 2vdm s LYS 13 N -2.98 3.67 0.46 4.82 1.02 -1.26 -1.58 119.74 123.89 2vdm s LYS 13 Ca 0.21 0.05 -0.25 0.00 0.02 0.00 0.00 55.97 56.00 2vdm s LYS 13 Cb -0.06 -3.02 -0.08 0.00 -0.52 0.00 0.00 37.83 34.15 2vdm s LYS 13 CO 0.09 0.59 1.39 -0.35 -0.92 0.00 0.00 175.35 176.15 2vdm n PRO 14 N 0.90 2.11 0.00 -1.68 -0.04 -1.26 -1.85 135.00 133.18 2vdm n PRO 14 Ca -0.09 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.13 2vdm n PRO 14 Cb 0.52 -2.57 0.00 0.00 -0.04 0.00 0.00 33.50 31.41 2vdm n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2vdm n GLY 15 N 0.65 2.95 3.24 0.55 0.00 0.59 -4.90 105.19 108.27 2vdm n GLY 15 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 2vdm n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vdm n ALA 16 N -0.41 -1.76 -2.50 4.61 0.00 -0.77 -4.18 120.51 115.50 2vdm n ALA 16 Ca 0.00 -1.47 -0.25 0.00 0.00 0.00 0.00 53.44 51.73 2vdm n ALA 16 Cb 0.00 -0.08 -0.10 0.00 0.00 0.00 0.00 19.45 19.27 2vdm n ALA 16 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2vdm s SER 17 N -4.88 3.58 -0.01 0.00 0.01 -1.26 -1.46 113.70 109.69 2vdm s SER 17 Ca 0.64 -1.12 -0.07 0.00 1.31 0.00 0.00 55.95 56.71 2vdm s SER 17 Cb -0.03 -0.31 0.00 0.00 0.21 0.00 0.00 66.02 65.89 2vdm s SER 17 CO 0.46 -0.10 0.14 0.54 0.41 0.00 0.00 173.24 174.69 2vdm s VAL 18 N -2.60 0.07 -0.24 3.43 0.11 -0.49 -4.97 120.40 115.72 2vdm s VAL 18 Ca 0.31 -0.60 -0.00 0.00 -2.93 0.00 0.00 61.98 58.76 2vdm s VAL 18 Cb -0.01 -0.40 0.07 0.00 -1.53 0.00 0.00 36.38 34.50 2vdm s VAL 18 CO 0.15 -0.33 -0.01 -0.75 -3.33 0.00 0.00 175.10 170.84 2vdm s LYS 19 N -1.19 1.25 0.38 1.54 2.20 -1.26 -0.81 119.74 121.85 2vdm s LYS 19 Ca -0.13 -0.90 -0.08 0.00 -0.36 0.00 0.00 55.97 54.50 2vdm s LYS 19 Cb -0.07 -2.42 -0.06 0.00 -1.51 0.00 0.00 37.83 33.77 2vdm s LYS 19 CO 0.01 -0.68 0.70 -0.51 -0.36 0.00 0.00 175.35 174.52 2vdm s LEU 20 N 1.52 3.88 0.14 5.43 1.43 0.11 -4.92 118.68 126.26 2vdm s LEU 20 Ca -0.02 0.97 0.05 0.00 -1.03 0.00 0.00 54.13 54.10 2vdm s LEU 20 Cb -0.18 -3.83 -0.04 0.00 0.03 0.00 0.00 46.19 42.16 2vdm s LEU 20 CO -0.09 -0.36 -0.12 -0.94 0.23 0.00 0.00 176.35 175.08 2vdm s SER 21 N -3.29 1.86 -0.26 2.29 1.04 -1.26 -1.52 113.70 112.56 2vdm s SER 21 Ca 0.48 -0.92 -0.01 0.00 0.48 0.00 0.00 55.95 55.98 2vdm s SER 21 Cb -0.10 -0.03 0.13 0.00 0.10 0.00 0.00 66.02 66.11 2vdm s SER 21 CO 0.33 -0.25 0.34 0.00 0.98 0.00 0.00 173.24 174.64 2vdm s THR 23 N 2.46 4.53 0.40 0.00 2.01 -0.10 -0.95 115.64 124.00 2vdm s THR 23 Ca 0.10 -0.12 -0.26 0.00 0.31 0.00 0.00 61.69 61.72 2vdm s THR 23 Cb -0.14 -3.04 -0.08 0.00 0.01 0.00 0.00 72.50 69.24 2vdm s THR 23 CO -0.23 0.45 1.22 0.00 -0.69 0.00 0.00 174.62 175.38 2vdm s ALA 24 N 0.50 3.19 -0.05 7.40 0.00 -0.38 -1.46 121.76 130.96 2vdm s ALA 24 Ca 0.02 1.07 -0.02 0.00 0.00 0.00 0.00 51.96 53.02 2vdm s ALA 24 Cb -0.13 -3.42 0.04 0.00 0.00 0.00 0.00 23.12 19.60 2vdm s ALA 24 CO 0.01 -0.64 0.10 0.45 0.00 0.00 0.00 175.76 175.68 2vdm s SER 25 N -0.98 0.46 -0.17 0.00 0.15 -0.43 -4.78 113.70 107.94 2vdm s SER 25 Ca 0.57 0.19 0.00 0.00 0.70 0.00 0.00 55.95 57.41 2vdm s SER 25 Cb -0.33 0.07 0.00 0.00 -1.71 0.00 0.00 66.02 64.04 2vdm s SER 25 CO 0.42 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.28 2vdm n GLY 26 N 4.76 0.52 3.74 9.45 0.00 -1.26 -1.67 105.19 120.72 2vdm n GLY 26 Ca -0.16 -0.33 -0.03 0.00 0.00 0.00 0.00 46.02 45.50 2vdm n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2vdm s PHE 27 N -1.93 -0.13 -0.13 1.61 -0.71 -1.26 -4.50 117.98 110.92 2vdm s PHE 27 Ca 0.00 -0.16 -0.11 0.00 -1.04 0.00 0.00 56.93 55.62 2vdm s PHE 27 Cb 0.00 0.63 -0.05 0.00 -1.21 0.00 0.00 43.02 42.40 2vdm s PHE 27 CO 0.00 -0.79 0.22 -0.80 -1.34 0.00 0.00 175.22 172.51 2vdm s ASN 28 N -2.93 6.42 0.61 1.98 -0.87 -1.26 -4.78 114.94 114.11 2vdm s ASN 28 Ca 0.12 0.50 0.33 0.00 -1.57 0.00 0.00 52.86 52.24 2vdm s ASN 28 Cb -0.01 -2.14 1.95 0.00 -0.02 0.00 0.00 41.25 41.03 2vdm s ASN 28 CO 0.02 0.25 2.27 -0.29 -2.57 0.00 0.00 177.10 176.78 2vdm h ILE 29 N 4.32 0.40 0.00 0.60 6.09 -1.93 -0.76 117.51 126.23 2vdm h ILE 29 Ca -0.47 -0.03 0.00 0.00 -1.37 0.00 0.00 64.86 62.99 2vdm h ILE 29 Cb 1.19 1.02 0.00 0.00 0.47 0.00 0.00 36.82 39.50 2vdm h ILE 29 CO 0.68 0.01 0.00 2.29 -3.07 0.00 0.00 178.15 178.06 2vdm n LYS 30 N -3.65 0.70 0.17 2.19 2.85 -1.26 -4.06 118.16 115.09 2vdm n LYS 30 Ca -0.03 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.27 2vdm n LYS 30 Cb 0.09 -1.50 0.42 0.00 -0.65 0.00 0.00 35.03 33.39 2vdm n LYS 30 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 2vdm h ASP 31 N 0.00 0.10 -5.26 -5.58 3.32 -1.55 -3.39 116.42 104.06 2vdm h ASP 31 Ca 0.00 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.96 2vdm h ASP 31 Cb 0.15 -0.03 -0.09 0.00 0.22 0.00 0.00 39.33 39.58 2vdm h ASP 31 CO 0.00 0.31 -0.12 0.42 -1.72 0.00 0.00 179.24 178.13 2vdm s THR 32 N -4.58 0.00 0.41 0.35 -4.23 -1.26 -5.13 115.64 101.20 2vdm s THR 32 Ca -0.04 -1.42 -0.25 0.00 -1.18 0.00 0.00 61.69 58.80 2vdm s THR 32 Cb 0.15 -2.25 -0.11 0.00 1.34 0.00 0.00 72.50 71.64 2vdm s THR 32 CO 0.72 0.00 1.11 -1.22 -0.54 0.00 0.00 174.62 174.69 2vdm n TYR 33 N -0.39 1.57 -4.98 3.99 0.53 -1.26 -4.48 117.16 112.13 2vdm n TYR 33 Ca -0.02 0.55 -0.32 0.00 -1.02 0.00 0.00 57.90 57.10 2vdm n TYR 33 Cb 0.62 -2.29 -0.17 0.00 -1.03 0.00 0.00 39.34 36.47 2vdm n TYR 33 CO 0.00 0.00 0.00 0.08 -1.02 0.00 0.00 176.86 175.92 2vdm s VAL 34 N -1.22 2.03 0.33 -0.72 1.01 -0.59 -4.46 120.40 116.77 2vdm s VAL 34 Ca 0.62 -0.99 0.08 0.00 0.00 0.00 0.00 61.98 61.69 2vdm s VAL 34 Cb -0.55 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 2vdm s VAL 34 CO 0.58 0.55 0.21 -1.00 0.00 0.00 0.00 175.10 175.44 2vdm s HIS 35 N 0.54 2.84 -0.07 5.22 3.76 0.88 -1.10 115.29 127.36 2vdm s HIS 35 Ca -0.14 -0.31 0.03 0.00 -0.15 0.00 0.00 55.06 54.49 2vdm s HIS 35 Cb -0.17 -1.67 0.01 0.00 1.11 0.00 0.00 32.58 31.85 2vdm s HIS 35 CO 0.04 0.29 -0.15 -1.58 -0.85 0.00 0.00 174.74 172.49 2vdm s TRP 36 N -2.34 1.71 0.03 1.40 0.52 -0.69 -0.88 118.94 118.68 2vdm s TRP 36 Ca 0.38 -0.62 0.06 0.00 0.02 0.00 0.00 56.10 55.95 2vdm s TRP 36 Cb -0.05 -1.20 -0.02 0.00 -1.15 0.00 0.00 33.47 31.05 2vdm s TRP 36 CO 0.25 -0.28 -0.19 0.08 0.02 0.00 0.00 176.95 176.83 2vdm s VAL 37 N 0.46 1.53 -0.12 4.03 1.01 0.13 -1.10 120.40 126.33 2vdm s VAL 37 Ca -0.13 -1.05 -0.03 0.00 0.00 0.00 0.00 61.98 60.77 2vdm s VAL 37 Cb -0.15 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 2vdm s VAL 37 CO 0.04 0.24 -0.01 -0.75 0.00 0.00 0.00 175.10 174.63 2vdm s LYS 38 N -0.95 3.35 -0.02 2.72 2.20 0.10 -0.28 119.74 126.86 2vdm s LYS 38 Ca 0.07 -0.44 0.05 0.00 -0.36 0.00 0.00 55.97 55.28 2vdm s LYS 38 Cb -0.08 -2.88 -0.01 0.00 -1.51 0.00 0.00 37.83 33.34 2vdm s LYS 38 CO 0.01 0.48 -0.17 -1.14 -0.36 0.00 0.00 175.35 174.17 2vdm s GLN 39 N -0.27 1.47 0.03 4.03 0.74 -0.04 -0.11 119.66 125.51 2vdm s GLN 39 Ca 0.06 -0.60 -0.02 0.00 0.05 0.00 0.00 55.36 54.85 2vdm s GLN 39 Cb -0.12 -1.38 -0.02 0.00 1.10 0.00 0.00 33.01 32.59 2vdm s GLN 39 CO 0.02 0.33 0.00 1.03 -0.55 0.00 0.00 175.29 176.12 2vdm s ARG 40 N -0.28 0.42 0.18 1.67 0.52 -0.84 -1.70 118.95 118.93 2vdm s ARG 40 Ca 0.04 -0.73 -0.13 0.00 -0.52 0.00 0.00 55.73 54.39 2vdm s ARG 40 Cb -0.08 0.15 0.09 0.00 0.52 0.00 0.00 34.95 35.63 2vdm s ARG 40 CO 0.00 -0.08 1.83 -1.35 0.02 0.00 0.00 175.30 175.72 2vdm h PRO 41 N 4.20 0.80 0.00 3.54 0.11 -1.95 -0.67 132.00 138.03 2vdm h PRO 41 Ca -0.32 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.68 2vdm h PRO 41 Cb 1.19 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 2vdm h PRO 41 CO 0.47 0.56 -0.31 1.49 -0.21 0.00 0.00 178.00 179.99 2vdm h GLU 42 N 0.81 0.00 0.00 1.05 4.81 -2.02 -3.39 114.58 115.84 2vdm h GLU 42 Ca 0.22 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.34 2vdm h GLU 42 Cb -0.05 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 2vdm h GLU 42 CO -0.04 0.64 -0.51 1.96 -0.73 0.00 0.00 179.01 180.32 2vdm h GLN 43 N -1.00 0.00 0.00 1.92 7.50 -1.99 -3.49 115.11 118.04 2vdm h GLN 43 Ca -0.07 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.08 2vdm h GLN 43 Cb 0.76 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.29 2vdm h GLN 43 CO -0.04 0.51 0.00 0.41 -1.50 0.00 0.00 178.83 178.21 2vdm n GLY 44 N 1.23 -0.42 3.71 3.46 0.00 -0.26 -4.89 105.19 108.02 2vdm n GLY 44 Ca 0.02 -1.47 -0.39 0.00 0.00 0.00 0.00 46.02 44.18 2vdm n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vdm s LEU 45 N 0.00 4.27 -0.06 0.99 1.43 -1.26 -1.98 118.68 122.08 2vdm s LEU 45 Ca 0.00 0.95 0.03 0.00 -1.03 0.00 0.00 54.13 54.08 2vdm s LEU 45 Cb 0.00 -2.86 0.01 0.00 0.03 0.00 0.00 46.19 43.37 2vdm s LEU 45 CO 0.00 -0.07 -0.14 -1.61 0.23 0.00 0.00 176.35 174.76 2vdm s GLU 46 N 0.85 1.70 -0.18 1.70 2.02 0.84 -4.97 118.70 120.66 2vdm s GLU 46 Ca 0.30 -0.48 -0.28 0.00 0.02 0.00 0.00 54.97 54.54 2vdm s GLU 46 Cb -0.16 -1.43 -0.00 0.00 0.10 0.00 0.00 34.13 32.64 2vdm s GLU 46 CO 0.13 0.11 0.96 -0.46 0.02 0.00 0.00 175.26 176.02 2vdm s TRP 47 N 0.40 3.41 -0.18 1.61 -0.00 -1.26 0.01 118.94 122.94 2vdm s TRP 47 Ca -0.10 1.43 -0.21 0.00 -0.00 0.00 0.00 56.10 57.21 2vdm s TRP 47 Cb -0.14 -3.16 -0.18 0.00 -0.00 0.00 0.00 33.47 29.99 2vdm s TRP 47 CO 0.03 -0.34 0.31 0.82 -0.00 0.00 0.00 176.95 177.78 2vdm h ILE 48 N 5.28 1.01 0.00 5.86 2.04 -1.48 -3.41 117.51 126.81 2vdm h ILE 48 Ca -0.26 -2.03 0.00 0.00 1.00 0.00 0.00 64.86 63.57 2vdm h ILE 48 Cb 1.11 2.18 0.00 0.00 -0.74 0.00 0.00 36.82 39.37 2vdm h ILE 48 CO 0.90 0.34 0.00 0.61 0.00 0.00 0.00 178.15 180.00 2vdm n GLY 49 N 1.52 -1.33 3.29 5.37 0.00 -1.21 -1.85 105.19 110.99 2vdm n GLY 49 Ca -0.21 -0.95 -0.10 0.00 0.00 0.00 0.00 46.02 44.76 2vdm n GLY 49 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2vdm s ARG 50 N -0.78 1.14 0.01 1.61 1.70 -0.29 -1.71 118.95 120.63 2vdm s ARG 50 Ca 0.00 -1.31 -0.01 0.00 -0.47 0.00 0.00 55.73 53.94 2vdm s ARG 50 Cb 0.00 0.34 -0.01 0.00 -0.57 0.00 0.00 34.95 34.70 2vdm s ARG 50 CO 0.00 -0.40 -0.00 -1.50 -1.08 0.00 0.00 175.30 172.32 2vdm s ILE 51 N -4.02 0.09 -0.60 4.99 2.07 -0.26 -1.89 121.20 121.58 2vdm s ILE 51 Ca 0.22 -0.71 -0.11 0.00 -1.41 0.00 0.00 60.65 58.64 2vdm s ILE 51 Cb 0.05 -0.23 0.15 0.00 0.13 0.00 0.00 42.46 42.56 2vdm s ILE 51 CO 0.03 -0.39 0.50 -0.62 -1.91 0.00 0.00 174.94 172.55 2vdm s ASP 52 N -1.16 6.03 0.35 4.50 2.15 -0.33 -1.55 116.67 126.66 2vdm s ASP 52 Ca -0.13 -2.21 0.25 0.00 0.43 0.00 0.00 52.55 50.88 2vdm s ASP 52 Cb -0.08 -2.09 1.29 0.00 -0.30 0.00 0.00 42.92 41.74 2vdm s ASP 52 CO -0.01 -0.66 1.75 -0.65 -0.17 0.00 0.00 175.17 175.44 2vdm h PRO 53 N 8.19 0.00 -0.28 4.34 0.11 -1.81 0.28 132.00 142.83 2vdm h PRO 53 Ca -0.12 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.96 2vdm h PRO 53 Cb 1.05 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 2vdm h PRO 53 CO 0.86 0.00 0.05 0.00 -0.21 0.00 0.00 178.00 178.69 2vdm h ALA 54 N 2.03 1.55 0.00 -0.75 0.00 -1.88 -3.37 119.26 116.85 2vdm h ALA 54 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2vdm h ALA 54 Cb 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2vdm h ALA 54 CO 0.00 0.33 0.00 0.27 0.00 0.00 0.00 179.25 179.85 2vdm n ASN 55 N -4.36 0.14 0.00 0.00 0.23 -0.24 -5.05 115.26 105.98 2vdm n ASN 55 Ca 0.01 -0.87 0.00 0.00 -0.53 0.00 0.00 54.58 53.19 2vdm n ASN 55 Cb 0.18 0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.91 2vdm n ASN 55 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2vdm n GLY 56 N 0.02 2.68 3.77 4.83 0.00 0.83 -5.01 105.19 112.31 2vdm n GLY 56 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2vdm n GLY 56 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vdm s TYR 57 N -2.10 2.76 0.19 1.61 2.02 -1.25 -4.67 117.35 115.90 2vdm s TYR 57 Ca 0.00 1.09 0.06 0.00 -0.37 0.00 0.00 57.07 57.85 2vdm s TYR 57 Cb 0.00 -3.95 -0.05 0.00 -0.40 0.00 0.00 41.96 37.56 2vdm s TYR 57 CO 0.00 -2.92 -0.10 0.95 -1.57 0.00 0.00 175.55 171.91 2vdm s THR 58 N -0.70 1.43 0.05 -0.71 -4.23 -1.26 -1.19 115.64 109.02 2vdm s THR 58 Ca 0.56 -2.13 0.03 0.00 -1.18 0.00 0.00 61.69 58.97 2vdm s THR 58 Cb -0.45 -2.05 -0.02 0.00 1.34 0.00 0.00 72.50 71.32 2vdm s THR 58 CO 0.55 -0.59 -0.10 -0.54 -0.54 0.00 0.00 174.62 173.40 2vdm s LYS 59 N -3.72 0.66 0.02 3.99 -0.14 -0.79 -4.97 119.74 114.79 2vdm s LYS 59 Ca 0.22 -0.77 0.01 0.00 -1.36 0.00 0.00 55.97 54.06 2vdm s LYS 59 Cb 0.02 -0.55 -0.02 0.00 -1.68 0.00 0.00 37.83 35.60 2vdm s LYS 59 CO 0.05 0.12 -0.05 0.71 -0.76 0.00 0.00 175.35 175.42 2vdm s TYR 60 N -1.18 0.43 0.05 3.18 2.02 -1.26 -1.14 117.35 119.44 2vdm s TYR 60 Ca -0.05 -0.37 -0.31 0.00 -0.37 0.00 0.00 57.07 55.97 2vdm s TYR 60 Cb -0.09 -0.27 -0.07 0.00 -0.40 0.00 0.00 41.96 41.13 2vdm s TYR 60 CO 0.01 -0.09 1.41 0.34 -1.57 0.00 0.00 175.55 175.65 2vdm s ASP 61 N -1.08 6.83 0.52 2.29 -1.08 -0.77 -4.91 116.67 118.48 2vdm s ASP 61 Ca -0.08 2.21 0.41 0.00 -0.52 0.00 0.00 52.55 54.57 2vdm s ASP 61 Cb -0.07 -2.57 1.60 0.00 -1.46 0.00 0.00 42.92 40.42 2vdm s ASP 61 CO -0.00 -0.70 1.65 -0.65 0.52 0.00 0.00 175.17 176.00 2vdm h PRO 62 N 7.47 0.03 -0.65 4.34 0.11 -1.96 0.17 132.00 141.51 2vdm h PRO 62 Ca -0.40 -0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.81 2vdm h PRO 62 Cb 1.19 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 2vdm h PRO 62 CO 0.89 0.02 0.43 0.87 -0.21 0.00 0.00 178.00 180.00 2vdm h LYS 63 N 0.03 0.48 -0.16 1.05 1.57 -1.96 -2.74 116.57 114.85 2vdm h LYS 63 Ca 0.80 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.55 2vdm h LYS 63 Cb 3.03 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 35.23 2vdm h LYS 63 CO -0.11 0.32 0.00 1.19 -0.57 0.00 0.00 179.45 180.27 2vdm n PHE 64 N -4.48 0.19 -1.86 -1.35 3.72 0.58 -4.91 117.46 109.36 2vdm n PHE 64 Ca 0.11 -0.13 -0.42 0.00 -0.05 0.00 0.00 57.45 56.95 2vdm n PHE 64 Cb 0.36 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.87 2vdm n PHE 64 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 2vdm s GLN 65 N -1.30 4.18 0.00 -1.08 2.00 -1.03 -1.01 119.66 121.42 2vdm s GLN 65 Ca 0.24 2.45 0.00 0.00 -2.00 0.00 0.00 55.36 56.05 2vdm s GLN 65 Cb 0.15 -3.14 0.00 0.00 0.80 0.00 0.00 33.01 30.82 2vdm s GLN 65 CO 0.22 -0.67 0.00 0.41 -0.50 0.00 0.00 175.29 174.75 2vdm n GLY 66 N 3.85 2.75 0.13 2.59 0.00 -1.26 -4.74 105.19 108.51 2vdm n GLY 66 Ca 0.15 -0.67 -0.13 0.00 0.00 0.00 0.00 46.02 45.37 2vdm n GLY 66 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2vdm h LYS 67 N 0.00 -0.22 -5.70 1.61 3.64 -1.84 -3.45 116.57 110.61 2vdm h LYS 67 Ca 0.00 0.02 -0.60 0.00 -1.27 0.00 0.00 60.65 58.80 2vdm h LYS 67 Cb 0.00 0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 31.79 2vdm h LYS 67 CO 0.00 0.16 -0.26 0.00 -2.27 0.00 0.00 179.45 177.08 2vdm s ALA 68 N -4.45 3.61 -0.19 5.00 0.00 -0.18 -1.90 121.76 123.66 2vdm s ALA 68 Ca -0.14 -0.34 -0.01 0.00 0.00 0.00 0.00 51.96 51.46 2vdm s ALA 68 Cb 0.02 -2.43 0.05 0.00 0.00 0.00 0.00 23.12 20.77 2vdm s ALA 68 CO 0.57 0.21 -0.00 0.99 0.00 0.00 0.00 175.76 177.52 2vdm s THR 69 N -0.00 0.86 -0.09 0.00 2.01 -0.15 -4.80 115.64 113.47 2vdm s THR 69 Ca 0.21 -0.68 -0.17 0.00 0.31 0.00 0.00 61.69 61.35 2vdm s THR 69 Cb -0.14 -1.23 -0.05 0.00 0.01 0.00 0.00 72.50 71.09 2vdm s THR 69 CO 0.08 -0.09 0.46 -0.63 -0.69 0.00 0.00 174.62 173.75 2vdm s ILE 70 N 1.71 5.14 0.22 1.82 1.01 -1.26 -1.39 121.20 128.45 2vdm s ILE 70 Ca -0.01 0.92 0.01 0.00 0.00 0.00 0.00 60.65 61.56 2vdm s ILE 70 Cb -0.17 -3.79 -0.05 0.00 0.01 0.00 0.00 42.46 38.47 2vdm s ILE 70 CO -0.07 0.39 0.09 0.42 0.00 0.00 0.00 174.94 175.77 2vdm s THR 71 N 0.18 0.38 0.08 2.92 -4.23 -0.78 -4.99 115.64 109.21 2vdm s THR 71 Ca 0.25 -1.99 -0.12 0.00 -1.18 0.00 0.00 61.69 58.65 2vdm s THR 71 Cb -0.16 -2.46 0.02 0.00 1.34 0.00 0.00 72.50 71.24 2vdm s THR 71 CO 0.11 -0.12 0.29 0.00 -0.54 0.00 0.00 174.62 174.36 2vdm s ALA 72 N -3.88 -0.58 -0.22 3.99 0.00 -1.26 0.47 121.76 120.28 2vdm s ALA 72 Ca 0.35 -0.24 -0.04 0.00 0.00 0.00 0.00 51.96 52.02 2vdm s ALA 72 Cb 0.07 0.48 0.09 0.00 0.00 0.00 0.00 23.12 23.77 2vdm s ALA 72 CO 0.11 -0.51 0.17 0.34 0.00 0.00 0.00 175.76 175.87 2vdm s ASP 73 N -2.56 2.14 0.50 0.00 3.68 0.50 -4.99 116.67 115.93 2vdm s ASP 73 Ca 0.01 -0.62 0.29 0.00 2.13 0.00 0.00 52.55 54.35 2vdm s ASP 73 Cb 0.02 0.06 1.19 0.00 -1.45 0.00 0.00 42.92 42.74 2vdm s ASP 73 CO -0.09 -0.36 1.93 0.71 0.13 0.00 0.00 175.17 177.49 2vdm h THR 74 N 6.36 0.32 0.08 1.71 1.35 -1.86 -0.31 112.91 120.55 2vdm h THR 74 Ca -0.17 -0.78 -0.00 0.00 -0.55 0.00 0.00 66.41 64.91 2vdm h THR 74 Cb 1.11 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 2vdm h THR 74 CO 0.32 0.11 -0.04 0.28 -0.25 0.00 0.00 175.52 175.95 2vdm h SER 75 N 0.00 -0.09 0.13 5.36 0.02 -1.95 -3.00 113.55 114.01 2vdm h SER 75 Ca -0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 2vdm h SER 75 Cb 0.59 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.15 2vdm h SER 75 CO 0.02 0.04 -0.09 -1.54 -1.14 0.00 0.00 176.83 174.12 2vdm n SER 76 N -5.09 1.00 -3.70 3.07 3.41 -1.10 -4.95 113.62 106.26 2vdm n SER 76 Ca -0.08 -1.10 -0.25 0.00 -0.26 0.00 0.00 58.87 57.18 2vdm n SER 76 Cb 0.11 0.02 0.05 0.00 -0.26 0.00 0.00 64.21 64.14 2vdm n SER 76 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2vdm n ASN 77 N -0.39 -4.30 -4.05 4.04 3.02 -0.18 -4.84 115.26 108.56 2vdm n ASN 77 Ca 0.17 -0.68 -0.17 0.00 -0.03 0.00 0.00 54.58 53.87 2vdm n ASN 77 Cb 0.31 -4.49 -0.13 0.00 -0.61 0.00 0.00 39.78 34.86 2vdm n ASN 77 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2vdm s THR 78 N -3.38 0.69 0.08 3.41 2.01 -0.88 -1.25 115.64 116.33 2vdm s THR 78 Ca 0.43 -0.69 0.06 0.00 0.31 0.00 0.00 61.69 61.80 2vdm s THR 78 Cb -0.20 -0.64 -0.04 0.00 0.01 0.00 0.00 72.50 71.63 2vdm s THR 78 CO 0.78 -0.03 -0.07 0.00 -0.69 0.00 0.00 174.62 174.61 2vdm s ALA 79 N -0.67 3.04 0.08 7.40 0.00 -0.12 -0.37 121.76 131.12 2vdm s ALA 79 Ca -0.01 -1.18 0.07 0.00 0.00 0.00 0.00 51.96 50.84 2vdm s ALA 79 Cb -0.06 -1.00 -0.03 0.00 0.00 0.00 0.00 23.12 22.03 2vdm s ALA 79 CO 0.00 0.65 -0.18 0.71 0.00 0.00 0.00 175.76 176.94 2vdm s TYR 80 N -1.20 1.56 -0.19 0.00 2.02 0.18 -0.85 117.35 118.87 2vdm s TYR 80 Ca 0.22 -0.42 0.01 0.00 -0.37 0.00 0.00 57.07 56.50 2vdm s TYR 80 Cb -0.11 -0.87 0.03 0.00 -0.40 0.00 0.00 41.96 40.61 2vdm s TYR 80 CO 0.14 0.14 -0.16 -1.17 -1.57 0.00 0.00 175.55 172.92 2vdm s LEU 81 N -1.74 2.24 -0.20 -1.29 2.96 -0.57 -1.86 118.68 118.22 2vdm s LEU 81 Ca 0.03 -0.76 -0.07 0.00 -0.22 0.00 0.00 54.13 53.12 2vdm s LEU 81 Cb -0.10 -1.39 -0.03 0.00 0.50 0.00 0.00 46.19 45.17 2vdm s LEU 81 CO 0.03 -0.06 0.04 -1.58 -1.32 0.00 0.00 176.35 173.46 2vdm s GLN 82 N 1.32 3.82 -0.19 1.98 0.74 -0.49 0.05 119.66 126.89 2vdm s GLN 82 Ca 0.02 -0.42 -0.02 0.00 0.05 0.00 0.00 55.36 54.99 2vdm s GLN 82 Cb -0.14 -3.18 -0.01 0.00 1.10 0.00 0.00 33.01 30.78 2vdm s GLN 82 CO -0.11 0.13 -0.09 -0.51 -0.55 0.00 0.00 175.29 174.16 2vdm s LEU 83 N 0.72 2.72 0.37 3.68 1.43 0.01 -0.98 118.68 126.63 2vdm s LEU 83 Ca 0.02 -0.42 0.07 0.00 -1.03 0.00 0.00 54.13 52.78 2vdm s LEU 83 Cb -0.14 -1.66 -0.01 0.00 0.03 0.00 0.00 46.19 44.41 2vdm s LEU 83 CO 0.02 0.04 0.43 -0.94 0.23 0.00 0.00 176.35 176.13 2vdm s SER 84 N 1.12 5.57 -1.29 2.29 1.04 -0.80 -1.40 113.70 120.23 2vdm s SER 84 Ca 0.01 -0.42 -0.05 0.00 0.48 0.00 0.00 55.95 55.97 2vdm s SER 84 Cb -0.14 -0.92 -0.00 0.00 0.10 0.00 0.00 66.02 65.05 2vdm s SER 84 CO -0.02 -0.52 0.62 -0.24 0.98 0.00 0.00 173.24 174.05 2vdm n SER 85 N -1.60 -2.00 -4.69 7.02 2.88 -1.17 -4.81 113.62 109.24 2vdm n SER 85 Ca 0.02 -0.93 -0.44 0.00 -1.33 0.00 0.00 58.87 56.19 2vdm n SER 85 Cb 0.59 -3.56 -0.04 0.00 -0.75 0.00 0.00 64.21 60.46 2vdm n SER 85 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2vdm n LEU 86 N -4.27 3.59 -4.72 2.46 4.77 -0.53 -4.67 117.00 113.63 2vdm n LEU 86 Ca -0.25 1.06 -0.31 0.00 -0.03 0.00 0.00 56.01 56.48 2vdm n LEU 86 Cb 0.66 -1.50 -0.09 0.00 -2.33 0.00 0.00 43.42 40.16 2vdm n LEU 86 CO 0.70 -0.03 -0.26 0.42 -1.33 0.00 0.00 177.39 176.89 2vdm s THR 87 N 1.25 1.45 0.36 -5.08 -4.23 -1.26 -0.30 115.64 107.83 2vdm s THR 87 Ca 0.78 -1.99 0.30 0.00 -1.18 0.00 0.00 61.69 59.60 2vdm s THR 87 Cb -0.59 -2.44 0.32 0.00 1.34 0.00 0.00 72.50 71.14 2vdm s THR 87 CO 0.36 0.00 2.06 0.77 -0.54 0.00 0.00 174.62 177.27 2vdm h SER 88 N 1.47 0.00 0.70 3.99 4.64 -1.95 -1.90 113.55 120.50 2vdm h SER 88 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2vdm h SER 88 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 2vdm h SER 88 CO 0.76 0.10 0.00 -0.62 -0.87 0.00 0.00 176.83 176.20 2vdm n GLU 89 N -3.45 0.15 0.00 4.77 1.02 -1.26 -2.46 120.64 119.41 2vdm n GLU 89 Ca -0.01 0.38 0.13 0.00 -0.02 0.00 0.00 57.16 57.64 2vdm n GLU 89 Cb 0.25 -1.79 0.42 0.00 -0.02 0.00 0.00 31.44 30.30 2vdm n GLU 89 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2vdm n ASP 90 N -2.08 0.63 -4.61 1.62 8.00 -0.71 -4.79 116.55 114.60 2vdm n ASP 90 Ca 0.02 -0.48 -0.43 0.00 0.71 0.00 0.00 54.79 54.62 2vdm n ASP 90 Cb 0.22 0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.36 2vdm n ASP 90 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2vdm s THR 91 N -2.70 3.32 0.06 -3.53 2.01 -1.03 -4.84 115.64 108.92 2vdm s THR 91 Ca 0.20 0.34 -0.28 0.00 0.31 0.00 0.00 61.69 62.26 2vdm s THR 91 Cb 0.19 -3.38 0.10 0.00 0.01 0.00 0.00 72.50 69.41 2vdm s THR 91 CO 0.57 -0.21 1.15 0.00 -0.69 0.00 0.00 174.62 175.44 2vdm s ALA 92 N 6.77 -2.00 -0.17 7.40 0.00 -0.86 -4.93 121.76 127.96 2vdm s ALA 92 Ca 0.86 0.38 -0.11 0.00 0.00 0.00 0.00 51.96 53.09 2vdm s ALA 92 Cb -0.29 0.51 -0.05 0.00 0.00 0.00 0.00 23.12 23.30 2vdm s ALA 92 CO 0.34 -1.06 0.19 0.08 0.00 0.00 0.00 175.76 175.31 2vdm s VAL 93 N -2.69 5.38 -0.14 0.00 1.01 -0.69 -1.31 120.40 121.96 2vdm s VAL 93 Ca 0.15 0.32 -0.01 0.00 0.00 0.00 0.00 61.98 62.44 2vdm s VAL 93 Cb 0.02 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.86 2vdm s VAL 93 CO -0.01 0.45 -0.12 -0.31 0.00 0.00 0.00 175.10 175.11 2vdm s TYR 94 N 0.21 2.84 0.04 5.22 1.51 0.11 -0.86 117.35 126.42 2vdm s TYR 94 Ca 0.12 -0.63 0.07 0.00 -1.01 0.00 0.00 57.07 55.62 2vdm s TYR 94 Cb -0.12 -1.87 -0.03 0.00 -0.11 0.00 0.00 41.96 39.83 2vdm s TYR 94 CO 0.01 -0.21 -0.17 0.71 -1.11 0.00 0.00 175.55 174.78 2vdm s TYR 95 N 0.41 2.59 -0.05 2.71 1.51 0.61 -0.18 117.35 124.96 2vdm s TYR 95 Ca -0.09 -0.23 -0.04 0.00 -1.01 0.00 0.00 57.07 55.70 2vdm s TYR 95 Cb -0.16 -1.47 -0.04 0.00 -0.11 0.00 0.00 41.96 40.18 2vdm s TYR 95 CO 0.05 0.27 0.13 0.00 -1.11 0.00 0.00 175.55 174.89 2vdm s VAL 97 N -1.15 0.36 0.05 0.00 1.01 -0.06 -1.25 120.40 119.36 2vdm s VAL 97 Ca 0.21 -0.56 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 2vdm s VAL 97 Cb -0.12 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 2vdm s VAL 97 CO 0.11 -0.14 0.02 0.00 0.00 0.00 0.00 175.10 175.09 2vdm s ARG 98 N -0.76 0.60 0.62 2.72 1.70 -0.08 -0.09 118.95 123.66 2vdm s ARG 98 Ca -0.05 -1.04 -0.10 0.00 -0.47 0.00 0.00 55.73 54.08 2vdm s ARG 98 Cb -0.05 0.22 -0.02 0.00 -0.57 0.00 0.00 34.95 34.52 2vdm s ARG 98 CO -0.00 -0.13 1.00 -1.25 -1.08 0.00 0.00 175.30 173.84 2vdm s PRO 99 N -3.41 3.38 -0.02 3.89 0.04 -1.23 0.03 135.00 137.68 2vdm s PRO 99 Ca 0.02 0.56 -0.00 0.00 0.04 0.00 0.00 61.00 61.62 2vdm s PRO 99 Cb 0.04 -2.12 -0.00 0.00 0.04 0.00 0.00 34.50 32.46 2vdm s PRO 99 CO -0.08 -0.63 -0.01 1.25 0.04 0.00 0.00 177.00 177.57 2vdm h LEU 100 N -0.31 0.00 0.00 -3.56 5.85 -1.93 -3.44 115.31 111.93 2vdm h LEU 100 Ca -0.45 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.24 2vdm h LEU 100 Cb 1.21 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.24 2vdm h LEU 100 CO 0.62 0.11 -0.54 -1.22 -0.34 0.00 0.00 178.44 177.07 2vdm n TYR 101 N -2.57 0.00 -1.65 1.25 4.01 -1.26 -5.01 117.16 111.93 2vdm n TYR 101 Ca -0.00 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.31 2vdm n TYR 101 Cb 0.01 -0.15 -0.03 0.00 -0.31 0.00 0.00 39.34 38.86 2vdm n TYR 101 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2vdm n ASP 102 N -3.61 3.99 -0.32 7.72 4.64 -1.26 -4.86 116.55 122.86 2vdm n ASP 102 Ca -0.06 0.83 0.20 0.00 -1.38 0.00 0.00 54.79 54.39 2vdm n ASP 102 Cb 0.25 -1.51 0.38 0.00 -1.04 0.00 0.00 41.12 39.20 2vdm n ASP 102 CO 0.00 0.00 0.00 -1.22 -0.82 0.00 0.00 177.20 175.16 2vdm n TYR 103 N 7.91 0.79 0.98 -0.67 4.02 -1.26 -1.78 117.16 127.15 2vdm n TYR 103 Ca 0.22 1.12 0.12 0.00 -0.01 0.00 0.00 57.90 59.35 2vdm n TYR 103 Cb 0.40 -1.33 0.27 0.00 -0.02 0.00 0.00 39.34 38.66 2vdm n TYR 103 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2vdm n TYR 104 N -5.28 0.16 -2.03 -0.72 4.01 -1.26 -4.75 117.16 107.29 2vdm n TYR 104 Ca 0.27 -0.08 -0.28 0.00 -0.16 0.00 0.00 57.90 57.65 2vdm n TYR 104 Cb 0.91 0.00 0.12 0.00 -0.31 0.00 0.00 39.34 40.07 2vdm n TYR 104 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2vdm s ALA 105 N -1.84 2.67 -0.49 -0.72 0.00 -0.73 -5.02 121.76 115.63 2vdm s ALA 105 Ca 0.34 -1.01 0.06 0.00 0.00 0.00 0.00 51.96 51.35 2vdm s ALA 105 Cb 0.20 -2.74 0.22 0.00 0.00 0.00 0.00 23.12 20.80 2vdm s ALA 105 CO 0.31 -1.88 0.51 -1.33 0.00 0.00 0.00 175.76 173.37 2vdm n MET 106 N -3.38 1.09 -0.10 0.00 2.81 -1.26 -3.56 117.12 112.72 2vdm n MET 106 Ca 0.11 -3.68 -0.22 0.00 -1.81 0.00 0.00 57.70 52.10 2vdm n MET 106 Cb 0.60 -1.70 -0.07 0.00 -0.71 0.00 0.00 33.22 31.34 2vdm n MET 106 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2vdm n ASP 107 N 1.77 1.46 -4.83 7.83 8.00 -0.89 -4.95 116.55 124.94 2vdm n ASP 107 Ca 0.25 0.25 -0.37 0.00 0.71 0.00 0.00 54.79 55.63 2vdm n ASP 107 Cb 0.47 -0.61 -0.06 0.00 -0.02 0.00 0.00 41.12 40.90 2vdm n ASP 107 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2vdm s TYR 108 N -2.38 3.63 0.05 1.24 2.02 0.10 -4.96 117.35 117.06 2vdm s TYR 108 Ca -0.29 0.77 0.04 0.00 -0.37 0.00 0.00 57.07 57.22 2vdm s TYR 108 Cb 0.11 -2.19 -0.02 0.00 -0.40 0.00 0.00 41.96 39.45 2vdm s TYR 108 CO 0.36 0.59 -0.12 -1.58 -1.57 0.00 0.00 175.55 173.23 2vdm s TRP 109 N -0.72 1.02 1.06 2.71 0.52 -1.26 -0.90 118.94 121.36 2vdm s TRP 109 Ca 0.20 -0.42 -0.16 0.00 0.02 0.00 0.00 56.10 55.74 2vdm s TRP 109 Cb -0.14 -0.60 0.22 0.00 -1.15 0.00 0.00 33.47 31.80 2vdm s TRP 109 CO 0.08 0.01 1.16 0.20 0.02 0.00 0.00 176.95 178.42 2vdm s GLY 110 N -1.42 1.62 0.00 0.98 0.00 -0.38 -4.63 107.32 103.49 2vdm s GLY 110 Ca -0.03 -0.84 0.25 0.00 0.00 0.00 0.00 44.72 44.11 2vdm s GLY 110 CO 0.01 -0.08 1.82 0.61 0.00 0.00 0.00 173.10 175.46 2vdm n GLN 111 N -4.25 0.07 0.00 2.90 0.00 -1.26 -4.86 117.38 109.98 2vdm n GLN 111 Ca 0.11 0.06 0.00 0.00 0.00 0.00 0.00 57.00 57.17 2vdm n GLN 111 Cb 0.59 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.33 2vdm n GLN 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2vdm n GLY 112 N 1.06 0.69 2.99 2.61 0.00 -1.26 -5.03 105.19 106.25 2vdm n GLY 112 Ca 0.07 -1.65 -0.27 0.00 0.00 0.00 0.00 46.02 44.18 2vdm n GLY 112 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vdm s THR 113 N -2.71 1.21 0.01 2.61 2.01 0.75 -4.90 115.64 114.62 2vdm s THR 113 Ca 0.00 -0.46 -0.25 0.00 0.31 0.00 0.00 61.69 61.29 2vdm s THR 113 Cb 0.00 -1.14 -0.05 0.00 0.01 0.00 0.00 72.50 71.32 2vdm s THR 113 CO 0.00 0.39 0.77 -0.55 -0.69 0.00 0.00 174.62 174.54 2vdm s SER 114 N 1.17 7.17 -0.12 3.53 0.15 -1.26 0.04 113.70 124.37 2vdm s SER 114 Ca -0.04 1.40 0.00 0.00 0.70 0.00 0.00 55.95 58.01 2vdm s SER 114 Cb -0.14 -2.46 0.02 0.00 -1.71 0.00 0.00 66.02 61.73 2vdm s SER 114 CO -0.03 -0.05 -0.10 -0.69 1.20 0.00 0.00 173.24 173.57 2vdm s VAL 115 N 0.28 1.24 -0.27 4.45 1.01 -0.43 -0.39 120.40 126.29 2vdm s VAL 115 Ca 0.40 -0.43 -0.03 0.00 0.00 0.00 0.00 61.98 61.92 2vdm s VAL 115 Cb -0.20 -1.21 0.03 0.00 0.00 0.00 0.00 36.38 35.00 2vdm s VAL 115 CO 0.22 0.40 -0.03 -0.89 0.00 0.00 0.00 175.10 174.81 2vdm s THR 116 N 1.57 3.08 -0.19 3.92 2.01 -0.09 -2.04 115.64 123.91 2vdm s THR 116 Ca 0.04 -1.03 -0.19 0.00 0.31 0.00 0.00 61.69 60.81 2vdm s THR 116 Cb -0.13 -2.61 -0.03 0.00 0.01 0.00 0.00 72.50 69.74 2vdm s THR 116 CO -0.08 0.12 0.56 -0.69 -0.69 0.00 0.00 174.62 173.84 2vdm s VAL 117 N 1.34 5.08 -0.18 3.82 1.01 -1.26 -1.44 120.40 128.76 2vdm s VAL 117 Ca -0.00 1.06 -0.28 0.00 0.00 0.00 0.00 61.98 62.76 2vdm s VAL 117 Cb -0.17 -3.89 0.08 0.00 0.00 0.00 0.00 36.38 32.40 2vdm s VAL 117 CO -0.03 0.16 0.75 -0.55 0.00 0.00 0.00 175.10 175.44 2vdm s SER 118 N 1.12 -0.67 0.00 3.32 0.15 -0.62 -4.83 113.70 112.18 2vdm s SER 118 Ca 0.26 1.07 0.24 0.00 0.70 0.00 0.00 55.95 58.22 2vdm s SER 118 Cb -0.16 1.01 0.30 0.00 -1.71 0.00 0.00 66.02 65.45 2vdm s SER 118 CO 0.10 -0.38 1.28 -1.20 1.20 0.00 0.00 173.24 174.24 2vdm n SER 119 N 1.88 1.65 -4.78 5.45 7.64 -1.26 -4.26 113.62 119.93 2vdm n SER 119 Ca -0.15 -1.28 -0.41 0.00 1.01 0.00 0.00 58.87 58.03 2vdm n SER 119 Cb 0.56 0.34 -0.01 0.00 -1.01 0.00 0.00 64.21 64.09 2vdm n SER 119 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2vdm s ALA 120 N -2.48 3.55 0.55 -0.43 0.00 -1.26 -5.02 121.76 116.67 2vdm s ALA 120 Ca 0.21 1.47 -0.06 0.00 0.00 0.00 0.00 51.96 53.58 2vdm s ALA 120 Cb 0.19 -3.57 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 2vdm s ALA 120 CO 0.55 -0.92 0.87 0.15 0.00 0.00 0.00 175.76 176.41 2vdm s LYS 121 N -1.95 3.19 0.18 0.00 1.02 -1.26 -5.02 119.74 115.90 2vdm s LYS 121 Ca 0.52 0.12 -0.31 0.00 0.02 0.00 0.00 55.97 56.31 2vdm s LYS 121 Cb -0.44 -2.30 -0.10 0.00 -0.52 0.00 0.00 37.83 34.47 2vdm s LYS 121 CO 0.59 -0.51 1.51 0.99 -0.92 0.00 0.00 175.35 177.01 2vdm s THR 122 N -2.91 2.71 -0.05 2.17 2.01 -1.26 -4.68 115.64 113.64 2vdm s THR 122 Ca 0.52 0.54 -0.02 0.00 0.31 0.00 0.00 61.69 63.04 2vdm s THR 122 Cb -0.10 -3.34 0.04 0.00 0.01 0.00 0.00 72.50 69.10 2vdm s THR 122 CO 0.46 0.05 0.09 -0.89 -0.69 0.00 0.00 174.62 173.65 2vdm s THR 123 N 0.80 -0.07 0.37 -0.82 2.01 -0.09 -4.93 115.64 112.92 2vdm s THR 123 Ca 0.66 0.21 -0.25 0.00 0.31 0.00 0.00 61.69 62.63 2vdm s THR 123 Cb -0.42 -0.17 -0.09 0.00 0.01 0.00 0.00 72.50 71.82 2vdm s THR 123 CO 0.35 0.09 1.02 0.00 -0.69 0.00 0.00 174.62 175.38 2vdm s ALA 124 N 1.22 3.14 0.40 7.40 0.00 -1.26 -1.22 121.76 131.44 2vdm s ALA 124 Ca -0.08 0.64 -0.24 0.00 0.00 0.00 0.00 51.96 52.28 2vdm s ALA 124 Cb -0.12 -3.24 -0.09 0.00 0.00 0.00 0.00 23.12 19.67 2vdm s ALA 124 CO -0.05 -0.07 1.07 -1.25 0.00 0.00 0.00 175.76 175.46 2vdm s PRO 125 N -2.32 4.14 -0.20 0.00 0.04 -1.26 -4.54 135.00 130.85 2vdm s PRO 125 Ca 0.55 1.56 -0.22 0.00 0.04 0.00 0.00 61.00 62.92 2vdm s PRO 125 Cb -0.21 -2.55 -0.02 0.00 0.04 0.00 0.00 34.50 31.76 2vdm s PRO 125 CO 0.27 -0.17 0.69 -1.12 0.04 0.00 0.00 177.00 176.70 2vdm s SER 126 N -1.51 6.74 -0.24 6.66 0.01 -0.14 -4.89 113.70 120.33 2vdm s SER 126 Ca 0.58 0.91 -0.05 0.00 1.31 0.00 0.00 55.95 58.69 2vdm s SER 126 Cb -0.23 -2.38 -0.02 0.00 0.21 0.00 0.00 66.02 63.61 2vdm s SER 126 CO 0.29 -0.33 0.01 -0.69 0.41 0.00 0.00 173.24 172.93 2vdm s VAL 127 N 2.11 3.81 -0.10 3.43 1.01 -1.26 -1.14 120.40 128.26 2vdm s VAL 127 Ca 0.31 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.95 2vdm s VAL 127 Cb -0.16 -2.76 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 2vdm s VAL 127 CO 0.10 0.37 -0.16 -0.31 0.00 0.00 0.00 175.10 175.10 2vdm s TYR 128 N 1.54 2.71 0.33 5.22 2.02 0.62 -4.97 117.35 124.81 2vdm s TYR 128 Ca 0.06 -0.59 -0.26 0.00 -0.37 0.00 0.00 57.07 55.91 2vdm s TYR 128 Cb -0.15 -1.74 -0.10 0.00 -0.40 0.00 0.00 41.96 39.57 2vdm s TYR 128 CO -0.00 -0.14 0.98 -1.25 -1.57 0.00 0.00 175.55 173.56 2vdm s PRO 129 N 0.02 4.53 -0.47 -1.71 0.04 -1.26 -0.90 135.00 135.25 2vdm s PRO 129 Ca -0.06 1.41 0.04 0.00 0.04 0.00 0.00 61.00 62.44 2vdm s PRO 129 Cb -0.15 -2.82 0.12 0.00 0.04 0.00 0.00 34.50 31.70 2vdm s PRO 129 CO 0.05 0.21 0.21 -0.51 0.04 0.00 0.00 177.00 176.99 2vdm s LEU 130 N -2.05 4.25 0.39 -3.56 1.43 0.21 -4.91 118.68 114.44 2vdm s LEU 130 Ca 0.50 -2.76 -0.11 0.00 -1.03 0.00 0.00 54.13 50.73 2vdm s LEU 130 Cb -0.21 -1.58 -0.07 0.00 0.03 0.00 0.00 46.19 44.37 2vdm s LEU 130 CO 0.26 -0.27 0.76 0.00 0.23 0.00 0.00 176.35 177.33 2vdm s ALA 131 N 0.06 3.36 0.99 4.21 0.00 -1.26 -1.90 121.76 127.22 2vdm s ALA 131 Ca 0.16 -0.19 -0.12 0.00 0.00 0.00 0.00 51.96 51.80 2vdm s ALA 131 Cb -0.24 -2.69 0.18 0.00 0.00 0.00 0.00 23.12 20.37 2vdm s ALA 131 CO -0.02 0.04 1.08 -2.14 0.00 0.00 0.00 175.76 174.72 2vdm s PRO 132 N -3.74 0.51 0.87 0.00 0.02 -1.26 -4.96 135.00 126.45 2vdm s PRO 132 Ca 0.51 0.69 -0.10 0.00 0.02 0.00 0.00 61.00 62.13 2vdm s PRO 132 Cb -0.10 -1.73 0.19 0.00 0.02 0.00 0.00 34.50 32.88 2vdm s PRO 132 CO 0.30 -2.72 1.19 0.28 -0.33 0.00 0.00 177.00 175.72 2vdm n VAL 133 N -4.19 0.00 -2.65 3.83 0.31 -1.26 -4.57 118.33 109.80 2vdm n VAL 133 Ca 0.06 -1.23 -0.37 0.00 -0.01 0.00 0.00 64.34 62.78 2vdm n VAL 133 Cb 0.56 -1.25 -0.05 0.00 -0.91 0.00 0.00 33.84 32.19 2vdm n VAL 133 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2vdm s THR 137 N -1.57 2.15 -0.01 0.00 -4.23 -1.26 -5.16 115.64 105.56 2vdm s THR 137 Ca 0.52 -0.16 -0.22 0.00 -1.18 0.00 0.00 61.69 60.66 2vdm s THR 137 Cb -0.22 -2.99 -0.05 0.00 1.34 0.00 0.00 72.50 70.58 2vdm s THR 137 CO 0.27 0.00 0.64 -0.89 -0.54 0.00 0.00 174.62 174.10 2vdm s THR 138 N -3.41 4.92 0.00 3.99 2.01 -1.26 -5.08 115.64 116.81 2vdm s THR 138 Ca 0.62 1.33 0.00 0.00 0.31 0.00 0.00 61.69 63.95 2vdm s THR 138 Cb -0.10 -3.98 0.00 0.00 0.01 0.00 0.00 72.50 68.43 2vdm s THR 138 CO 0.47 0.38 0.00 0.61 -0.69 0.00 0.00 174.62 175.38 2vdm n GLY 139 N 2.59 1.24 0.06 4.40 0.00 -1.26 -5.01 105.19 107.22 2vdm n GLY 139 Ca -0.05 -1.68 -0.07 0.00 0.00 0.00 0.00 46.02 44.22 2vdm n GLY 139 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2vdm h SER 140 N 0.00 0.00 -3.18 1.61 4.64 -1.98 -3.45 113.55 111.19 2vdm h SER 140 Ca 0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 2vdm h SER 140 Cb 0.00 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 61.95 2vdm h SER 140 CO 0.00 0.99 -0.59 -0.44 -0.87 0.00 0.00 176.83 175.92 2vdm s SER 141 N -6.68 2.46 -0.10 4.97 0.01 -1.26 -2.05 113.70 111.04 2vdm s SER 141 Ca 0.01 -1.42 -0.05 0.00 1.31 0.00 0.00 55.95 55.80 2vdm s SER 141 Cb 0.10 0.01 0.05 0.00 0.21 0.00 0.00 66.02 66.39 2vdm s SER 141 CO 0.82 -0.66 0.24 0.54 0.41 0.00 0.00 173.24 174.59 2vdm s VAL 142 N -3.28 -0.12 -0.17 3.43 0.11 0.63 -4.68 120.40 116.31 2vdm s VAL 142 Ca 0.34 0.19 -0.07 0.00 -2.93 0.00 0.00 61.98 59.51 2vdm s VAL 142 Cb 0.08 -0.37 -0.04 0.00 -1.53 0.00 0.00 36.38 34.51 2vdm s VAL 142 CO 0.15 0.08 0.06 -0.89 -3.33 0.00 0.00 175.10 171.17 2vdm s THR 143 N 1.51 4.80 0.50 5.04 2.01 -1.26 -1.48 115.64 126.77 2vdm s THR 143 Ca -0.07 -0.03 0.05 0.00 0.31 0.00 0.00 61.69 61.95 2vdm s THR 143 Cb -0.11 -3.15 0.00 0.00 0.01 0.00 0.00 72.50 69.25 2vdm s THR 143 CO -0.08 0.48 0.24 -0.76 -0.69 0.00 0.00 174.62 173.80 2vdm s LEU 144 N 0.22 2.69 0.24 4.42 1.43 0.83 -4.58 118.68 123.93 2vdm s LEU 144 Ca 0.04 -1.32 -0.20 0.00 -1.03 0.00 0.00 54.13 51.63 2vdm s LEU 144 Cb -0.12 -1.13 0.03 0.00 0.03 0.00 0.00 46.19 44.99 2vdm s LEU 144 CO 0.00 -0.89 0.63 -0.83 0.23 0.00 0.00 176.35 175.49 2vdm s GLY 145 N -4.08 -0.11 -0.02 -3.19 0.00 -0.80 -1.98 107.32 97.15 2vdm s GLY 145 Ca 0.28 -0.22 -0.00 0.00 0.00 0.00 0.00 44.72 44.77 2vdm s GLY 145 CO 0.16 -0.15 0.03 0.00 0.00 0.00 0.00 173.10 173.15 2vdm s LEU 147 N 1.18 3.16 -0.26 0.00 2.96 -0.08 -1.13 118.68 124.51 2vdm s LEU 147 Ca -0.08 -0.19 0.02 0.00 -0.22 0.00 0.00 54.13 53.66 2vdm s LEU 147 Cb -0.13 -1.77 0.05 0.00 0.50 0.00 0.00 46.19 44.85 2vdm s LEU 147 CO -0.03 0.13 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.35 2vdm s VAL 148 N 0.56 2.36 -0.03 1.68 1.01 0.72 -0.28 120.40 126.43 2vdm s VAL 148 Ca -0.03 -1.51 0.06 0.00 0.00 0.00 0.00 61.98 60.50 2vdm s VAL 148 Cb -0.14 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.88 2vdm s VAL 148 CO 0.03 0.00 -0.20 -0.54 0.00 0.00 0.00 175.10 174.39 2vdm s LYS 149 N 1.15 1.78 -0.39 2.72 1.02 -0.29 -0.46 119.74 125.27 2vdm s LYS 149 Ca -0.07 -0.72 -0.01 0.00 0.02 0.00 0.00 55.97 55.18 2vdm s LYS 149 Cb -0.19 -1.65 0.00 0.00 -0.52 0.00 0.00 37.83 35.47 2vdm s LYS 149 CO -0.05 0.40 0.33 0.41 -0.92 0.00 0.00 175.35 175.52 2vdm n GLY 150 N 2.73 0.34 3.54 -3.33 0.00 -0.62 -0.97 105.19 106.89 2vdm n GLY 150 Ca -0.16 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.24 2vdm n GLY 150 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2vdm s TYR 151 N -3.10 2.60 -0.25 1.61 -0.85 -0.94 -4.47 117.35 111.94 2vdm s TYR 151 Ca 0.09 -0.23 -0.22 0.00 -0.52 0.00 0.00 57.07 56.19 2vdm s TYR 151 Cb -0.04 -1.31 0.07 0.00 0.38 0.00 0.00 41.96 41.06 2vdm s TYR 151 CO 0.22 0.47 0.66 0.12 -1.52 0.00 0.00 175.55 175.51 2vdm s PHE 152 N -1.51 -0.77 0.43 -3.49 5.36 -0.36 -0.40 117.98 117.25 2vdm s PHE 152 Ca 0.23 1.81 0.01 0.00 -0.96 0.00 0.00 56.93 58.02 2vdm s PHE 152 Cb -0.09 0.29 0.08 0.00 -0.34 0.00 0.00 43.02 42.96 2vdm s PHE 152 CO 0.13 -0.37 0.59 -0.35 -1.46 0.00 0.00 175.22 173.76 2vdm n PRO 153 N 2.93 0.29 -1.64 10.12 -0.04 -1.26 -0.91 135.00 144.49 2vdm n PRO 153 Ca -0.15 -1.71 -0.34 0.00 -0.04 0.00 0.00 63.50 61.27 2vdm n PRO 153 Cb 0.56 -0.35 0.07 0.00 -0.04 0.00 0.00 33.50 33.73 2vdm n PRO 153 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2vdm s GLU 154 N -3.96 2.51 0.39 0.54 2.02 -1.26 -4.71 118.70 114.23 2vdm s GLU 154 Ca 0.40 1.62 0.08 0.00 0.02 0.00 0.00 54.97 57.08 2vdm s GLU 154 Cb -0.02 -1.89 -0.01 0.00 0.10 0.00 0.00 34.13 32.31 2vdm s GLU 154 CO 0.26 -1.52 0.45 -1.25 0.02 0.00 0.00 175.26 173.22 2vdm s PRO 155 N -3.90 2.78 0.17 0.39 0.04 -1.26 -5.01 135.00 128.21 2vdm s PRO 155 Ca 0.72 -1.29 0.09 0.00 0.04 0.00 0.00 61.00 60.55 2vdm s PRO 155 Cb -0.26 -2.62 -0.04 0.00 0.04 0.00 0.00 34.50 31.62 2vdm s PRO 155 CO 0.42 -0.13 -0.11 0.14 0.04 0.00 0.00 177.00 177.36 2vdm s VAL 156 N -2.35 3.13 -0.20 -0.36 -7.23 -1.26 -4.47 120.40 107.66 2vdm s VAL 156 Ca 0.49 -1.64 -0.00 0.00 -1.81 0.00 0.00 61.98 59.02 2vdm s VAL 156 Cb -0.07 -2.53 0.02 0.00 0.56 0.00 0.00 36.38 34.35 2vdm s VAL 156 CO 0.30 -0.08 -0.15 0.42 -0.31 0.00 0.00 175.10 175.29 2vdm s THR 157 N -1.62 2.42 -0.14 5.32 -4.23 -0.38 -4.96 115.64 112.05 2vdm s THR 157 Ca 0.24 -0.92 -0.01 0.00 -1.18 0.00 0.00 61.69 59.82 2vdm s THR 157 Cb -0.09 -2.10 -0.02 0.00 1.34 0.00 0.00 72.50 71.63 2vdm s THR 157 CO 0.14 0.43 -0.10 -0.22 -0.54 0.00 0.00 174.62 174.34 2vdm s LEU 158 N 1.32 2.91 0.12 4.79 0.20 -1.26 -1.64 118.68 125.11 2vdm s LEU 158 Ca 0.04 -0.25 0.01 0.00 0.69 0.00 0.00 54.13 54.62 2vdm s LEU 158 Cb -0.14 -1.67 -0.04 0.00 -0.43 0.00 0.00 46.19 43.90 2vdm s LEU 158 CO -0.09 0.17 -0.04 0.42 -0.29 0.00 0.00 176.35 176.52 2vdm s THR 159 N 0.32 0.63 -0.12 3.68 -4.23 -0.35 -5.00 115.64 110.56 2vdm s THR 159 Ca -0.08 -1.94 -0.02 0.00 -1.18 0.00 0.00 61.69 58.47 2vdm s THR 159 Cb -0.15 -1.81 -0.03 0.00 1.34 0.00 0.00 72.50 71.85 2vdm s THR 159 CO 0.05 -0.75 -0.05 0.26 -0.54 0.00 0.00 174.62 173.58 2vdm s TRP 160 N -3.67 2.98 -1.54 3.99 0.52 -1.26 -0.40 118.94 119.56 2vdm s TRP 160 Ca 0.15 -0.22 -0.11 0.00 0.02 0.00 0.00 56.10 55.94 2vdm s TRP 160 Cb 0.06 -1.87 0.08 0.00 -1.15 0.00 0.00 33.47 30.60 2vdm s TRP 160 CO -0.02 0.08 0.79 0.09 0.02 0.00 0.00 176.95 177.90 2vdm n ASN 161 N 3.08 -3.12 -3.45 2.95 3.02 -0.75 -1.14 115.26 115.86 2vdm n ASN 161 Ca -0.18 -0.90 -0.25 0.00 -0.03 0.00 0.00 54.58 53.22 2vdm n ASN 161 Cb 0.53 -3.39 0.03 0.00 -0.61 0.00 0.00 39.78 36.34 2vdm n ASN 161 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2vdm n SER 162 N -2.83 -5.35 0.00 6.41 7.64 -1.26 -2.01 113.62 116.22 2vdm n SER 162 Ca -0.05 -0.49 0.00 0.00 1.01 0.00 0.00 58.87 59.34 2vdm n SER 162 Cb 0.56 -4.30 0.00 0.00 -1.01 0.00 0.00 64.21 59.46 2vdm n SER 162 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vdm n GLY 163 N -1.60 0.82 0.16 0.23 0.00 -0.29 -4.93 105.19 99.58 2vdm n GLY 163 Ca -0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.95 2vdm n GLY 163 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2vdm h SER 164 N 0.00 0.20 -3.53 1.61 0.02 -1.17 -3.36 113.55 107.32 2vdm h SER 164 Ca 0.00 -0.12 -0.76 0.00 -0.84 0.00 0.00 61.79 60.07 2vdm h SER 164 Cb 0.00 -0.06 -0.31 0.00 0.14 0.00 0.00 62.40 62.18 2vdm h SER 164 CO 0.00 0.78 0.20 -0.22 -1.14 0.00 0.00 176.83 176.45 2vdm s LEU 165 N -7.79 6.06 -0.15 5.07 2.96 -1.06 -4.82 118.68 118.95 2vdm s LEU 165 Ca -0.03 -3.54 0.09 0.00 -0.22 0.00 0.00 54.13 50.43 2vdm s LEU 165 Cb 0.12 -2.09 -0.23 0.00 0.50 0.00 0.00 46.19 44.49 2vdm s LEU 165 CO 0.79 -0.28 0.25 -1.54 -1.32 0.00 0.00 176.35 174.26 2vdm n SER 166 N 2.71 1.00 -4.76 3.68 3.41 -1.26 -4.39 113.62 114.01 2vdm n SER 166 Ca 0.21 0.14 -0.40 0.00 -0.26 0.00 0.00 58.87 58.57 2vdm n SER 166 Cb 0.39 0.09 -0.06 0.00 -0.26 0.00 0.00 64.21 64.37 2vdm n SER 166 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2vdm s SER 167 N -6.13 7.53 -0.42 4.04 0.15 -1.26 -3.63 113.70 113.97 2vdm s SER 167 Ca -0.15 2.00 -0.00 0.00 0.70 0.00 0.00 55.95 58.50 2vdm s SER 167 Cb 0.07 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 2vdm s SER 167 CO 0.78 0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.90 2vdm n GLY 168 N 1.32 0.17 3.58 9.45 0.00 -1.26 -4.80 105.19 113.65 2vdm n GLY 168 Ca -0.01 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 2vdm n GLY 168 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vdm s VAL 169 N -2.26 3.43 -0.39 1.61 1.01 -1.24 -1.58 120.40 120.99 2vdm s VAL 169 Ca 0.00 -1.07 0.01 0.00 0.00 0.00 0.00 61.98 60.92 2vdm s VAL 169 Cb -0.00 -2.55 0.14 0.00 0.00 0.00 0.00 36.38 33.97 2vdm s VAL 169 CO 0.00 0.24 0.23 -1.00 0.00 0.00 0.00 175.10 174.57 2vdm s HIS 170 N -1.11 1.15 -0.35 5.22 3.76 0.18 -4.97 115.29 119.16 2vdm s HIS 170 Ca 0.19 -1.92 -0.23 0.00 -0.15 0.00 0.00 55.06 52.95 2vdm s HIS 170 Cb -0.11 -1.22 0.01 0.00 1.11 0.00 0.00 32.58 32.36 2vdm s HIS 170 CO 0.11 -0.81 0.78 0.99 -0.85 0.00 0.00 174.74 174.96 2vdm s THR 171 N 0.77 4.75 0.35 1.30 2.01 -1.26 -1.40 115.64 122.16 2vdm s THR 171 Ca 0.19 0.94 -0.18 0.00 0.31 0.00 0.00 61.69 62.95 2vdm s THR 171 Cb -0.21 -4.19 -0.10 0.00 0.01 0.00 0.00 72.50 68.01 2vdm s THR 171 CO -0.01 -0.39 0.82 -0.36 -0.69 0.00 0.00 174.62 173.99 2vdm s PHE 172 N 3.06 3.40 0.49 4.92 0.08 0.20 -4.99 117.98 125.14 2vdm s PHE 172 Ca 0.31 1.39 -0.23 0.00 0.12 0.00 0.00 56.93 58.52 2vdm s PHE 172 Cb -0.13 -2.67 -0.07 0.00 -0.57 0.00 0.00 43.02 39.58 2vdm s PHE 172 CO 0.16 0.06 1.33 -1.25 -0.10 0.00 0.00 175.22 175.42 2vdm s PRO 173 N -2.90 3.49 0.48 0.24 0.04 -1.26 -4.38 135.00 130.71 2vdm s PRO 173 Ca 0.55 2.19 -0.23 0.00 0.04 0.00 0.00 61.00 63.55 2vdm s PRO 173 Cb -0.11 -2.45 -0.07 0.00 0.04 0.00 0.00 34.50 31.92 2vdm s PRO 173 CO 0.17 -0.90 1.25 0.00 0.04 0.00 0.00 177.00 177.56 2vdm s ALA 174 N -1.31 2.96 0.10 8.56 0.00 -1.26 -4.84 121.76 125.97 2vdm s ALA 174 Ca 0.66 1.12 0.09 0.00 0.00 0.00 0.00 51.96 53.83 2vdm s ALA 174 Cb -0.39 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.23 2vdm s ALA 174 CO 0.48 -0.93 -0.23 0.08 0.00 0.00 0.00 175.76 175.15 2vdm s VAL 175 N -1.42 1.93 -0.06 0.00 1.01 -0.01 -4.94 120.40 116.92 2vdm s VAL 175 Ca 0.65 -1.57 -0.14 0.00 0.00 0.00 0.00 61.98 60.92 2vdm s VAL 175 Cb -0.34 -1.72 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 2vdm s VAL 175 CO 0.41 0.05 0.36 -0.22 0.00 0.00 0.00 175.10 175.70 2vdm s LEU 176 N -1.83 4.40 -0.12 3.92 2.96 -1.26 -0.44 118.68 126.30 2vdm s LEU 176 Ca 0.10 0.79 -0.06 0.00 -0.22 0.00 0.00 54.13 54.74 2vdm s LEU 176 Cb -0.10 -2.49 0.05 0.00 0.50 0.00 0.00 46.19 44.16 2vdm s LEU 176 CO 0.04 0.26 0.28 0.00 -1.32 0.00 0.00 176.35 175.61 2vdm s GLN 177 N -0.59 0.22 -1.00 1.98 0.00 -0.38 -4.97 119.66 114.92 2vdm s GLN 177 Ca 0.21 0.64 -0.13 0.00 -0.00 0.00 0.00 55.36 56.09 2vdm s GLN 177 Cb -0.15 -0.07 -0.01 0.00 0.00 0.00 0.00 33.01 32.79 2vdm s GLN 177 CO 0.10 -0.20 0.74 -1.13 0.00 0.00 0.00 175.29 174.80 2vdm n SER 178 N 4.58 -5.71 0.00 12.60 3.41 -1.26 -2.77 113.62 124.47 2vdm n SER 178 Ca -0.19 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.58 2vdm n SER 178 Cb 0.52 -3.42 0.00 0.00 -0.26 0.00 0.00 64.21 61.06 2vdm n SER 178 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2vdm n ASP 179 N -2.50 0.00 -4.40 4.04 10.43 -1.26 -4.93 116.55 117.93 2vdm n ASP 179 Ca -0.12 0.00 -0.26 0.00 2.57 0.00 0.00 54.79 56.98 2vdm n ASP 179 Cb 0.59 -0.54 -0.12 0.00 1.84 0.00 0.00 41.12 42.89 2vdm n ASP 179 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2vdm s LEU 180 N 0.00 2.41 0.20 0.64 1.43 -1.11 -4.79 118.68 117.46 2vdm s LEU 180 Ca 0.00 -0.84 -0.07 0.00 -1.03 0.00 0.00 54.13 52.19 2vdm s LEU 180 Cb 0.00 -1.12 -0.06 0.00 0.03 0.00 0.00 46.19 45.04 2vdm s LEU 180 CO 0.00 0.11 0.48 -0.31 0.23 0.00 0.00 176.35 176.86 2vdm s TYR 181 N -1.59 3.45 0.03 0.29 2.02 0.47 -1.24 117.35 120.76 2vdm s TYR 181 Ca 0.18 0.73 0.04 0.00 -0.37 0.00 0.00 57.07 57.65 2vdm s TYR 181 Cb -0.08 -2.15 -0.02 0.00 -0.40 0.00 0.00 41.96 39.32 2vdm s TYR 181 CO 0.09 0.33 -0.11 0.99 -1.57 0.00 0.00 175.55 175.28 2vdm s THR 182 N -1.77 0.84 0.01 -0.71 2.01 0.42 -1.59 115.64 114.85 2vdm s THR 182 Ca 0.45 -0.81 -0.07 0.00 0.31 0.00 0.00 61.69 61.57 2vdm s THR 182 Cb -0.12 -0.77 -0.00 0.00 0.01 0.00 0.00 72.50 71.62 2vdm s THR 182 CO 0.23 -0.02 0.13 -0.22 -0.69 0.00 0.00 174.62 174.05 2vdm s LEU 183 N -0.93 1.59 0.03 4.42 0.20 0.40 -0.83 118.68 123.55 2vdm s LEU 183 Ca -0.00 -0.28 -0.00 0.00 0.69 0.00 0.00 54.13 54.53 2vdm s LEU 183 Cb -0.07 0.68 -0.02 0.00 -0.43 0.00 0.00 46.19 46.35 2vdm s LEU 183 CO 0.01 -0.41 -0.03 -0.94 -0.29 0.00 0.00 176.35 174.68 2vdm s SER 184 N -1.58 0.32 0.05 3.68 1.04 -1.26 -0.20 113.70 115.75 2vdm s SER 184 Ca -0.12 -0.59 0.03 0.00 0.48 0.00 0.00 55.95 55.75 2vdm s SER 184 Cb -0.06 0.11 -0.03 0.00 0.10 0.00 0.00 66.02 66.15 2vdm s SER 184 CO 0.00 -0.34 -0.09 -0.55 0.98 0.00 0.00 173.24 173.24 2vdm s SER 185 N -1.72 1.00 0.02 7.02 0.15 -0.28 -0.63 113.70 119.26 2vdm s SER 185 Ca -0.12 -0.59 0.04 0.00 0.70 0.00 0.00 55.95 55.99 2vdm s SER 185 Cb -0.07 0.03 -0.02 0.00 -1.71 0.00 0.00 66.02 64.25 2vdm s SER 185 CO -0.02 -0.20 -0.13 -0.94 1.20 0.00 0.00 173.24 173.15 2vdm s SER 186 N -1.69 1.49 -0.01 5.45 1.04 -0.49 -0.41 113.70 119.08 2vdm s SER 186 Ca -0.07 -0.38 0.02 0.00 0.48 0.00 0.00 55.95 55.99 2vdm s SER 186 Cb -0.09 -0.11 -0.00 0.00 0.10 0.00 0.00 66.02 65.92 2vdm s SER 186 CO 0.00 0.05 -0.07 0.54 0.98 0.00 0.00 173.24 174.74 2vdm s VAL 187 N -0.71 0.57 0.00 5.02 0.11 -0.84 0.47 120.40 125.03 2vdm s VAL 187 Ca 0.02 -0.28 0.08 0.00 -2.93 0.00 0.00 61.98 58.86 2vdm s VAL 187 Cb -0.07 -0.50 -0.02 0.00 -1.53 0.00 0.00 36.38 34.26 2vdm s VAL 187 CO 0.01 0.17 -0.24 -0.89 -3.33 0.00 0.00 175.10 170.82 2vdm s THR 188 N -0.00 1.91 0.23 5.04 2.01 -0.61 -0.12 115.64 124.10 2vdm s THR 188 Ca 0.00 -1.12 -0.02 0.00 0.31 0.00 0.00 61.69 60.87 2vdm s THR 188 Cb -0.05 -1.60 -0.03 0.00 0.01 0.00 0.00 72.50 70.83 2vdm s THR 188 CO -0.00 0.46 0.22 0.68 -0.69 0.00 0.00 174.62 175.29 2vdm s VAL 189 N -0.64 0.00 0.51 3.82 -7.23 -0.55 -4.77 120.40 111.55 2vdm s VAL 189 Ca 0.09 -1.89 -0.19 0.00 -1.81 0.00 0.00 61.98 58.19 2vdm s VAL 189 Cb -0.09 -2.47 -0.07 0.00 0.56 0.00 0.00 36.38 34.31 2vdm s VAL 189 CO 0.00 0.00 1.04 0.42 -0.31 0.00 0.00 175.10 176.25 2vdm s THR 190 N -3.97 3.86 0.54 5.32 -4.23 -1.26 -0.27 115.64 115.63 2vdm s THR 190 Ca 0.36 1.07 0.30 0.00 -1.18 0.00 0.00 61.69 62.25 2vdm s THR 190 Cb 0.05 -3.45 0.34 0.00 1.34 0.00 0.00 72.50 70.78 2vdm s THR 190 CO 0.14 -0.33 2.21 0.28 -0.54 0.00 0.00 174.62 176.38 2vdm h SER 191 N 1.28 0.00 0.68 3.99 0.02 -1.69 -0.21 113.55 117.63 2vdm h SER 191 Ca -0.49 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.43 2vdm h SER 191 Cb 1.22 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 2vdm h SER 191 CO 0.59 0.04 -0.17 0.77 -1.14 0.00 0.00 176.83 176.91 2vdm h SER 192 N 0.00 0.00 0.06 3.07 4.64 -1.93 -3.27 113.55 116.13 2vdm h SER 192 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2vdm h SER 192 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2vdm h SER 192 CO 0.00 0.17 -0.03 0.74 -0.87 0.00 0.00 176.83 176.85 2vdm h THR 193 N 0.00 1.27 -4.42 2.95 2.02 -1.40 -3.42 112.91 109.91 2vdm h THR 193 Ca -0.00 -1.47 -0.70 0.00 0.77 0.00 0.00 66.41 65.01 2vdm h THR 193 Cb 0.56 2.18 -0.28 0.00 -1.74 0.00 0.00 68.15 68.88 2vdm h THR 193 CO 0.02 0.35 -0.86 0.86 0.37 0.00 0.00 175.52 176.26 2vdm s TRP 194 N -3.32 2.41 -2.07 3.16 -0.00 -1.22 -0.16 118.94 117.75 2vdm s TRP 194 Ca -0.15 -0.38 0.12 0.00 -0.00 0.00 0.00 56.10 55.69 2vdm s TRP 194 Cb -0.00 -1.50 0.44 0.00 -0.00 0.00 0.00 33.47 32.41 2vdm s TRP 194 CO 0.59 0.04 1.33 -0.35 -0.00 0.00 0.00 176.95 178.56 2vdm n PRO 195 N 2.25 1.58 -0.25 5.86 -0.04 -1.26 -4.70 135.00 138.44 2vdm n PRO 195 Ca -0.16 -0.89 0.06 0.00 -0.04 0.00 0.00 63.50 62.46 2vdm n PRO 195 Cb 0.51 -1.26 0.30 0.00 -0.04 0.00 0.00 33.50 33.01 2vdm n PRO 195 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2vdm h SER 196 N 1.55 0.79 -3.50 3.54 4.64 -1.79 -3.40 113.55 115.39 2vdm h SER 196 Ca 0.00 0.01 -0.66 0.00 -0.47 0.00 0.00 61.79 60.66 2vdm h SER 196 Cb 0.35 -0.16 -0.15 0.00 -0.31 0.00 0.00 62.40 62.13 2vdm h SER 196 CO 0.00 0.50 -0.69 -1.10 -0.87 0.00 0.00 176.83 174.67 2vdm s GLN 197 N -5.79 2.49 0.20 4.77 -0.21 0.78 -5.11 119.66 116.79 2vdm s GLN 197 Ca -0.11 -0.80 -0.30 0.00 0.02 0.00 0.00 55.36 54.17 2vdm s GLN 197 Cb 0.20 -2.49 -0.08 0.00 1.00 0.00 0.00 33.01 31.63 2vdm s GLN 197 CO 0.79 0.57 0.99 0.45 -2.12 0.00 0.00 175.29 175.97 2vdm s SER 198 N -1.84 7.50 -0.17 5.90 0.15 -1.26 -4.55 113.70 119.42 2vdm s SER 198 Ca 0.21 1.97 -0.01 0.00 0.70 0.00 0.00 55.95 58.82 2vdm s SER 198 Cb -0.11 -2.61 0.05 0.00 -1.71 0.00 0.00 66.02 61.64 2vdm s SER 198 CO 0.12 -0.00 -0.02 -0.63 1.20 0.00 0.00 173.24 173.91 2vdm s ILE 199 N -0.71 0.92 0.04 6.45 1.01 -1.26 -5.00 121.20 122.65 2vdm s ILE 199 Ca 0.44 -0.59 0.07 0.00 0.00 0.00 0.00 60.65 60.58 2vdm s ILE 199 Cb -0.27 -1.19 -0.03 0.00 0.01 0.00 0.00 42.46 40.99 2vdm s ILE 199 CO 0.33 0.03 -0.18 -0.89 0.00 0.00 0.00 174.94 174.23 2vdm s THR 200 N 1.71 2.78 -0.17 2.92 2.01 -1.26 -1.33 115.64 122.29 2vdm s THR 200 Ca 0.00 -1.17 -0.15 0.00 0.31 0.00 0.00 61.69 60.68 2vdm s THR 200 Cb -0.16 -2.16 -0.04 0.00 0.01 0.00 0.00 72.50 70.15 2vdm s THR 200 CO -0.07 0.35 0.37 0.00 -0.69 0.00 0.00 174.62 174.58 2vdm s ASN 202 N 0.77 5.02 -0.11 0.00 0.02 0.46 -0.79 114.94 120.32 2vdm s ASN 202 Ca 0.19 -1.42 -0.02 0.00 -1.02 0.00 0.00 52.86 50.60 2vdm s ASN 202 Cb -0.14 -1.76 -0.03 0.00 0.02 0.00 0.00 41.25 39.34 2vdm s ASN 202 CO 0.07 -0.33 -0.04 -0.69 0.02 0.00 0.00 177.10 176.13 2vdm s VAL 203 N 1.25 3.89 -0.08 1.60 1.01 -0.59 -1.21 120.40 126.27 2vdm s VAL 203 Ca -0.02 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 2vdm s VAL 203 Cb -0.20 -2.65 0.03 0.00 0.00 0.00 0.00 36.38 33.55 2vdm s VAL 203 CO -0.01 0.55 -0.02 0.00 0.00 0.00 0.00 175.10 175.62 2vdm s ALA 204 N -0.30 0.83 -0.45 5.51 0.00 -0.65 -1.33 121.76 125.36 2vdm s ALA 204 Ca 0.05 -0.21 0.04 0.00 0.00 0.00 0.00 51.96 51.84 2vdm s ALA 204 Cb -0.12 -0.73 0.12 0.00 0.00 0.00 0.00 23.12 22.39 2vdm s ALA 204 CO 0.02 -0.37 0.19 -1.58 0.00 0.00 0.00 175.76 174.02 2vdm s HIS 205 N 1.74 3.25 0.50 0.00 2.46 -0.21 -1.25 115.29 121.77 2vdm s HIS 205 Ca 0.02 -3.04 0.15 0.00 0.47 0.00 0.00 55.06 52.67 2vdm s HIS 205 Cb -0.13 -2.77 1.20 0.00 -0.13 0.00 0.00 32.58 30.76 2vdm s HIS 205 CO -0.05 -0.81 2.11 -1.35 -2.47 0.00 0.00 174.74 172.17 2vdm h PRO 206 N 6.90 0.11 -0.89 2.88 0.11 -1.81 -2.36 132.00 136.94 2vdm h PRO 206 Ca -0.06 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.06 2vdm h PRO 206 Cb 0.94 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 31.98 2vdm h PRO 206 CO 0.62 0.07 0.59 0.00 -0.21 0.00 0.00 178.00 179.07 2vdm h ALA 207 N 1.92 1.39 -0.06 -0.75 0.00 -1.91 -2.51 119.26 117.34 2vdm h ALA 207 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2vdm h ALA 207 Cb 0.11 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2vdm h ALA 207 CO -0.01 0.55 0.00 -1.13 0.00 0.00 0.00 179.25 178.66 2vdm n SER 208 N -4.41 2.69 -3.63 0.00 3.41 -0.93 -4.98 113.62 105.77 2vdm n SER 208 Ca 0.11 -1.89 -0.20 0.00 -0.26 0.00 0.00 58.87 56.62 2vdm n SER 208 Cb 0.05 -0.02 0.05 0.00 -0.26 0.00 0.00 64.21 64.02 2vdm n SER 208 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2vdm n SER 209 N 1.09 -1.53 -4.04 4.04 7.64 -0.95 -4.98 113.62 114.90 2vdm n SER 209 Ca 0.15 -0.78 -0.25 0.00 1.01 0.00 0.00 58.87 59.01 2vdm n SER 209 Cb 0.54 -4.30 -0.16 0.00 -1.01 0.00 0.00 64.21 59.28 2vdm n SER 209 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2vdm s THR 210 N -3.59 1.19 -0.10 0.44 -4.23 -1.07 -5.04 115.64 103.24 2vdm s THR 210 Ca 0.02 -0.52 0.01 0.00 -1.18 0.00 0.00 61.69 60.01 2vdm s THR 210 Cb -0.00 -1.08 0.02 0.00 1.34 0.00 0.00 72.50 72.78 2vdm s THR 210 CO 0.79 0.37 -0.11 -0.54 -0.54 0.00 0.00 174.62 174.59 2vdm s LYS 211 N 0.56 1.78 -0.03 3.99 1.02 -1.26 -1.05 119.74 124.74 2vdm s LYS 211 Ca -0.13 -0.39 0.05 0.00 0.02 0.00 0.00 55.97 55.53 2vdm s LYS 211 Cb -0.15 -1.64 -0.01 0.00 -0.52 0.00 0.00 37.83 35.51 2vdm s LYS 211 CO 0.04 -0.14 -0.18 0.08 -0.92 0.00 0.00 175.35 174.22 2vdm s VAL 212 N 1.25 1.49 -0.13 3.17 1.01 -0.44 -5.02 120.40 121.73 2vdm s VAL 212 Ca -0.03 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.18 2vdm s VAL 212 Cb -0.14 -1.26 -0.00 0.00 0.00 0.00 0.00 36.38 34.98 2vdm s VAL 212 CO -0.04 0.42 -0.17 -1.81 0.00 0.00 0.00 175.10 173.50 2vdm s ASP 213 N -0.23 3.56 -0.26 3.32 -0.00 -1.26 -1.54 116.67 120.26 2vdm s ASP 213 Ca 0.02 -0.47 0.01 0.00 -0.00 0.00 0.00 52.55 52.12 2vdm s ASP 213 Cb -0.09 -1.53 0.07 0.00 -0.00 0.00 0.00 42.92 41.37 2vdm s ASP 213 CO 0.01 0.13 -0.02 -0.54 -0.00 0.00 0.00 175.17 174.74 2vdm s LYS 214 N 0.57 1.48 0.01 8.23 -0.14 0.03 -4.94 119.74 124.98 2vdm s LYS 214 Ca -0.10 -1.13 -0.30 0.00 -1.36 0.00 0.00 55.97 53.07 2vdm s LYS 214 Cb -0.16 -2.60 -0.06 0.00 -1.68 0.00 0.00 37.83 33.33 2vdm s LYS 214 CO 0.04 -0.70 1.45 0.21 -0.76 0.00 0.00 175.35 175.58 2vdm s LYS 215 N 1.35 4.26 -0.22 1.68 2.20 -1.26 -0.19 119.74 127.56 2vdm s LYS 215 Ca -0.01 2.03 -0.29 0.00 -0.36 0.00 0.00 55.97 57.33 2vdm s LYS 215 Cb -0.19 -3.60 -0.01 0.00 -1.51 0.00 0.00 37.83 32.52 2vdm s LYS 215 CO -0.09 -0.61 1.38 0.42 -0.36 0.00 0.00 175.35 176.09 2vdm s ILE 216 N 2.53 4.05 -0.04 5.43 -1.09 -0.44 -4.94 121.20 126.69 2vdm s ILE 216 Ca 0.66 1.22 0.01 0.00 -2.23 0.00 0.00 60.65 60.31 2vdm s ILE 216 Cb -0.33 -3.95 -0.03 0.00 -1.58 0.00 0.00 42.46 36.57 2vdm s ILE 216 CO 0.27 -0.29 -0.05 -1.61 -1.23 0.00 0.00 174.94 172.04 2vdm s GLU 217 N 4.04 2.73 0.42 2.79 0.41 -1.26 -4.70 118.70 123.13 2vdm s GLU 217 Ca 0.60 -0.59 -0.26 0.00 -0.41 0.00 0.00 54.97 54.32 2vdm s GLU 217 Cb -0.22 -2.61 -0.08 0.00 -1.78 0.00 0.00 34.13 29.44 2vdm s GLU 217 CO 0.22 0.65 1.33 -2.14 -0.49 0.00 0.00 175.26 174.83 2vdm s PRO 218 N -1.12 3.86 0.13 0.39 0.02 -1.26 -4.66 135.00 132.36 2vdm s PRO 218 Ca 0.15 2.22 -0.30 0.00 0.02 0.00 0.00 61.00 63.08 2vdm s PRO 218 Cb -0.11 -2.71 -0.07 0.00 0.02 0.00 0.00 34.50 31.63 2vdm s PRO 218 CO 0.05 -0.60 1.19 1.03 -0.33 0.00 0.00 177.00 178.34 2vdm s ARG 219 N -2.33 4.47 0.12 5.54 0.52 -1.26 -5.04 118.95 120.98 2vdm s ARG 219 Ca 0.59 1.81 0.02 0.00 -0.52 0.00 0.00 55.73 57.63 2vdm s ARG 219 Cb -0.39 -3.29 0.02 0.00 0.52 0.00 0.00 34.95 31.80 2vdm s ARG 219 CO 0.50 -0.15 0.15 0.41 0.02 0.00 0.00 175.30 176.22 2vdm n GLY 220 N 2.68 2.24 0.00 -3.53 0.00 -1.26 -5.00 105.19 100.32 2vdm n GLY 220 Ca 0.06 -2.16 0.06 0.00 0.00 0.00 0.00 46.02 43.98 2vdm n GLY 220 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27