#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ash s PHE 3 N 0.00 -0.21 -0.03 4.31 5.36 -1.26 -1.01 117.98 125.14 2ash s PHE 3 Ca 0.00 0.52 -0.01 0.00 -0.96 0.00 0.00 56.93 56.48 2ash s PHE 3 Cb 0.00 0.04 0.03 0.00 -0.34 0.00 0.00 43.02 42.75 2ash s PHE 3 CO 0.00 -0.13 0.05 -2.00 -1.46 0.00 0.00 175.22 171.68 2ash s GLU 4 N 0.45 -0.05 -0.33 10.12 2.12 -0.62 -4.87 118.70 125.52 2ash s GLU 4 Ca -0.03 0.28 -0.27 0.00 0.36 0.00 0.00 54.97 55.31 2ash s GLU 4 Cb -0.04 -0.35 0.01 0.00 0.26 0.00 0.00 34.13 34.01 2ash s GLU 4 CO -0.02 -0.24 1.00 0.08 -0.54 0.00 0.00 175.26 175.54 2ash s VAL 5 N 1.54 4.57 -0.00 3.70 1.01 -1.26 -1.15 120.40 128.81 2ash s VAL 5 Ca -0.03 1.52 0.01 0.00 0.00 0.00 0.00 61.98 63.48 2ash s VAL 5 Cb -0.13 -4.36 -0.26 0.00 0.00 0.00 0.00 36.38 31.64 2ash s VAL 5 CO -0.03 -0.46 0.83 0.11 0.00 0.00 0.00 175.10 175.55 2ash h LYS 6 N 8.20 0.17 -2.50 2.72 1.57 0.37 -3.48 116.57 123.61 2ash h LYS 6 Ca -0.22 -0.29 -0.08 0.00 -1.87 0.00 0.00 60.65 58.20 2ash h LYS 6 Cb 1.07 0.11 -0.18 0.00 0.08 0.00 0.00 32.23 33.30 2ash h LYS 6 CO 1.00 0.98 0.02 0.21 -0.57 0.00 0.00 179.45 181.09 2ash s LYS 7 N -2.62 0.95 0.10 3.15 2.20 -0.99 -5.00 119.74 117.53 2ash s LYS 7 Ca -0.08 -0.00 0.08 0.00 -0.36 0.00 0.00 55.97 55.61 2ash s LYS 7 Cb 0.07 0.44 -0.03 0.00 -1.51 0.00 0.00 37.83 36.80 2ash s LYS 7 CO 0.84 -0.30 -0.21 0.95 -0.36 0.00 0.00 175.35 176.26 2ash s THR 8 N -1.59 1.71 -0.29 3.43 -4.23 -1.26 -0.43 115.64 112.98 2ash s THR 8 Ca -0.10 -1.53 -0.01 0.00 -1.18 0.00 0.00 61.69 58.87 2ash s THR 8 Cb -0.02 -1.55 0.09 0.00 1.34 0.00 0.00 72.50 72.36 2ash s THR 8 CO 0.05 -0.04 0.09 0.12 -0.54 0.00 0.00 174.62 174.29 2ash s PHE 9 N -1.14 1.61 0.00 3.99 5.36 0.42 -4.99 117.98 123.23 2ash s PHE 9 Ca 0.06 -1.61 0.00 0.00 -0.96 0.00 0.00 56.93 54.42 2ash s PHE 9 Cb -0.10 -1.61 0.00 0.00 -0.34 0.00 0.00 43.02 40.97 2ash s PHE 9 CO 0.04 -0.84 0.00 0.41 -1.46 0.00 0.00 175.22 173.37 2ash n GLY 10 N 4.88 3.72 0.01 13.12 0.00 -1.26 -1.82 105.19 123.83 2ash n GLY 10 Ca -0.03 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.07 2ash n GLY 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ash n LYS 11 N 13.76 0.05 -2.15 1.61 5.02 -1.26 -4.90 118.16 130.27 2ash n LYS 11 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 2ash n LYS 11 Cb 0.00 -1.52 -0.03 0.00 -0.02 0.00 0.00 35.03 33.46 2ash n LYS 11 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ash s ALA 12 N -3.03 3.60 -0.12 7.82 0.00 -0.76 -3.68 121.76 125.60 2ash s ALA 12 Ca 0.09 1.11 -0.00 0.00 0.00 0.00 0.00 51.96 53.16 2ash s ALA 12 Cb 0.17 -3.55 -0.02 0.00 0.00 0.00 0.00 23.12 19.71 2ash s ALA 12 CO 0.74 -0.67 -0.11 1.03 0.00 0.00 0.00 175.76 176.75 2ash s ARG 13 N 1.30 3.26 -0.29 0.00 0.52 -1.26 -0.44 118.95 122.04 2ash s ARG 13 Ca 0.65 -0.65 -0.14 0.00 -0.52 0.00 0.00 55.73 55.07 2ash s ARG 13 Cb -0.37 -2.64 -0.03 0.00 0.52 0.00 0.00 34.95 32.43 2ash s ARG 13 CO 0.30 0.31 0.33 -1.17 0.02 0.00 0.00 175.30 175.09 2ash s LEU 14 N 0.11 4.11 0.30 2.53 2.96 0.43 -3.86 118.68 125.27 2ash s LEU 14 Ca -0.05 0.12 0.04 0.00 -0.22 0.00 0.00 54.13 54.02 2ash s LEU 14 Cb -0.15 -2.35 -0.03 0.00 0.50 0.00 0.00 46.19 44.16 2ash s LEU 14 CO 0.04 -0.19 0.21 -0.83 -1.32 0.00 0.00 176.35 174.27 2ash s GLY 15 N 1.68 2.07 -0.08 7.98 0.00 -0.59 0.11 107.32 118.49 2ash s GLY 15 Ca 0.13 -1.89 -0.04 0.00 0.00 0.00 0.00 44.72 42.92 2ash s GLY 15 CO 0.11 -1.49 0.19 0.54 0.00 0.00 0.00 173.10 172.44 2ash s VAL 16 N -3.64 -0.06 -0.13 1.40 0.11 -0.30 -0.89 120.40 116.88 2ash s VAL 16 Ca 0.39 0.17 -0.07 0.00 -2.93 0.00 0.00 61.98 59.54 2ash s VAL 16 Cb 0.04 -0.30 -0.04 0.00 -1.53 0.00 0.00 36.38 34.55 2ash s VAL 16 CO 0.21 0.07 0.12 -0.04 -3.33 0.00 0.00 175.10 172.14 2ash s MET 17 N 1.26 3.52 -0.32 1.54 -1.94 -0.05 -1.59 119.30 121.72 2ash s MET 17 Ca -0.09 -0.17 -0.05 0.00 -1.71 0.00 0.00 55.69 53.67 2ash s MET 17 Cb -0.11 -3.19 0.04 0.00 2.01 0.00 0.00 34.83 33.58 2ash s MET 17 CO -0.07 0.69 0.06 0.15 -0.01 0.00 0.00 175.02 175.84 2ash s LYS 18 N -0.78 2.63 0.42 2.03 -0.14 -0.18 -0.62 119.74 123.10 2ash s LYS 18 Ca 0.13 -1.16 0.07 0.00 -1.36 0.00 0.00 55.97 53.66 2ash s LYS 18 Cb -0.12 -3.35 -0.03 0.00 -1.68 0.00 0.00 37.83 32.66 2ash s LYS 18 CO 0.03 -0.61 0.32 -0.51 -0.76 0.00 0.00 175.35 173.81 2ash s LEU 19 N 1.37 3.27 0.28 3.17 1.43 0.15 -3.47 118.68 124.87 2ash s LEU 19 Ca -0.02 -0.88 -0.01 0.00 -1.03 0.00 0.00 54.13 52.19 2ash s LEU 19 Cb -0.19 -1.81 0.47 0.00 0.03 0.00 0.00 46.19 44.69 2ash s LEU 19 CO 0.01 -0.64 1.87 -0.74 0.23 0.00 0.00 176.35 177.08 2ash h HIS 20 N 1.14 1.17 -0.65 0.29 -0.00 -1.87 -2.54 115.15 112.69 2ash h HIS 20 Ca -0.42 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 59.99 2ash h HIS 20 Cb 1.26 -0.38 0.00 0.00 -0.00 0.00 0.00 27.41 28.29 2ash h HIS 20 CO 0.57 0.56 0.00 0.72 -0.00 0.00 0.00 177.93 179.78 2ash n HIS 21 N -4.54 1.00 0.00 5.26 8.25 -1.26 -5.02 115.22 118.91 2ash n HIS 21 Ca 0.17 -0.53 0.00 0.00 -0.26 0.00 0.00 57.72 57.10 2ash n HIS 21 Cb 0.25 -0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.30 2ash n HIS 21 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ash n GLY 22 N 1.34 2.70 3.87 -1.41 0.00 -0.96 -4.13 105.19 106.60 2ash n GLY 22 Ca 0.23 -1.21 -0.33 0.00 0.00 0.00 0.00 46.02 44.71 2ash n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ash s ALA 23 N -2.00 3.62 -0.15 4.61 0.00 -1.26 -0.67 121.76 125.91 2ash s ALA 23 Ca 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 51.96 51.67 2ash s ALA 23 Cb 0.00 -2.40 0.04 0.00 0.00 0.00 0.00 23.12 20.76 2ash s ALA 23 CO 0.00 0.52 -0.02 0.08 0.00 0.00 0.00 175.76 176.33 2ash s VAL 24 N -1.61 0.83 0.30 0.00 1.01 0.21 -4.96 120.40 116.18 2ash s VAL 24 Ca 0.41 -0.43 -0.27 0.00 0.00 0.00 0.00 61.98 61.69 2ash s VAL 24 Cb -0.13 -1.05 -0.10 0.00 0.00 0.00 0.00 36.38 35.10 2ash s VAL 24 CO 0.20 0.11 0.95 -1.61 0.00 0.00 0.00 175.10 174.75 2ash s GLU 25 N 1.76 4.65 0.12 2.72 2.02 -1.26 -0.87 118.70 127.84 2ash s GLU 25 Ca 0.02 1.40 0.07 0.00 0.02 0.00 0.00 54.97 56.47 2ash s GLU 25 Cb -0.15 -2.94 -0.04 0.00 0.10 0.00 0.00 34.13 31.10 2ash s GLU 25 CO -0.07 0.33 -0.16 0.95 0.02 0.00 0.00 175.26 176.33 2ash s THR 26 N -1.47 1.49 0.52 3.63 -4.23 -0.07 -4.21 115.64 111.29 2ash s THR 26 Ca 0.48 -1.68 -0.22 0.00 -1.18 0.00 0.00 61.69 59.08 2ash s THR 26 Cb -0.21 -1.56 -0.06 0.00 1.34 0.00 0.00 72.50 72.01 2ash s THR 26 CO 0.27 -0.30 1.31 -2.84 -0.54 0.00 0.00 174.62 172.51 2ash s PRO 27 N -2.45 3.34 -0.01 3.99 0.02 -1.25 -1.55 135.00 137.09 2ash s PRO 27 Ca 0.09 2.12 0.01 0.00 0.02 0.00 0.00 61.00 63.24 2ash s PRO 27 Cb -0.07 -2.33 0.01 0.00 0.02 0.00 0.00 34.50 32.13 2ash s PRO 27 CO 0.04 -0.99 -0.04 0.54 -0.33 0.00 0.00 177.00 176.22 2ash s VAL 28 N -1.36 0.37 -0.22 3.83 0.11 -0.43 -4.74 120.40 117.96 2ash s VAL 28 Ca 0.69 -0.14 -0.10 0.00 -2.93 0.00 0.00 61.98 59.50 2ash s VAL 28 Cb -0.37 -0.35 -0.05 0.00 -1.53 0.00 0.00 36.38 34.07 2ash s VAL 28 CO 0.45 0.13 0.14 0.12 -3.33 0.00 0.00 175.10 172.61 2ash s PHE 29 N 0.26 3.37 -0.33 1.54 5.36 -1.26 -1.53 117.98 125.40 2ash s PHE 29 Ca -0.03 0.28 -0.12 0.00 -0.96 0.00 0.00 56.93 56.11 2ash s PHE 29 Cb -0.06 -2.21 -0.01 0.00 -0.34 0.00 0.00 43.02 40.40 2ash s PHE 29 CO -0.00 0.19 0.20 -1.64 -1.46 0.00 0.00 175.22 172.51 2ash s MET 30 N 0.67 3.42 0.52 10.12 -1.94 0.26 -4.90 119.30 127.45 2ash s MET 30 Ca 0.08 -0.68 -0.22 0.00 -1.71 0.00 0.00 55.69 53.15 2ash s MET 30 Cb -0.12 -3.71 -0.06 0.00 2.01 0.00 0.00 34.83 32.95 2ash s MET 30 CO 0.01 -0.44 1.28 -2.30 -0.01 0.00 0.00 175.02 173.56 2ash n PRO 31 N 5.05 1.64 -4.59 2.03 -0.02 -1.26 -3.77 135.00 134.08 2ash n PRO 31 Ca -0.13 0.60 -0.33 0.00 -2.02 0.00 0.00 63.50 61.62 2ash n PRO 31 Cb 0.49 -2.47 -0.13 0.00 -0.02 0.00 0.00 33.50 31.37 2ash n PRO 31 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ash s VAL 32 N -1.30 3.51 0.24 -1.45 1.01 -1.26 -0.62 120.40 120.53 2ash s VAL 32 Ca 0.70 -0.50 0.11 0.00 0.00 0.00 0.00 61.98 62.28 2ash s VAL 32 Cb -0.44 -2.50 -0.05 0.00 0.00 0.00 0.00 36.38 33.39 2ash s VAL 32 CO 0.51 0.52 -0.15 -0.83 0.00 0.00 0.00 175.10 175.14 2ash s GLY 33 N 0.23 1.77 -0.07 4.51 0.00 -0.19 -4.57 107.32 108.99 2ash s GLY 33 Ca -0.05 -1.71 0.00 0.00 0.00 0.00 0.00 44.72 42.96 2ash s GLY 33 CO 0.04 -1.77 -0.07 2.41 0.00 0.00 0.00 173.10 173.71 2ash n THR 34 N -0.35 0.43 -2.18 0.90 -1.04 -1.19 -1.44 114.28 109.40 2ash n THR 34 Ca -0.08 -0.16 -0.31 0.00 -2.04 0.00 0.00 64.05 61.46 2ash n THR 34 Cb 0.58 -0.79 0.02 0.00 -1.82 0.00 0.00 70.33 68.32 2ash n THR 34 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2ash n ASN 35 N -2.74 5.80 -3.62 8.00 3.02 -1.26 -4.36 115.26 120.11 2ash n ASN 35 Ca -0.13 -3.76 -0.23 0.00 -0.03 0.00 0.00 54.58 50.42 2ash n ASN 35 Cb 0.64 -0.67 0.07 0.00 -0.61 0.00 0.00 39.78 39.21 2ash n ASN 35 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ash n ALA 36 N -0.55 -1.55 -3.58 5.41 0.00 -1.26 -5.00 120.51 113.98 2ash n ALA 36 Ca 0.46 0.20 -0.12 0.00 0.00 0.00 0.00 53.44 53.98 2ash n ALA 36 Cb 0.56 -4.25 -0.06 0.00 0.00 0.00 0.00 19.45 15.71 2ash n ALA 36 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2ash s SER 37 N -3.68 -0.43 -0.30 0.00 1.04 -1.26 -4.71 113.70 104.36 2ash s SER 37 Ca 0.40 0.52 -0.22 0.00 0.48 0.00 0.00 55.95 57.13 2ash s SER 37 Cb -0.18 0.43 -0.00 0.00 0.10 0.00 0.00 66.02 66.36 2ash s SER 37 CO 0.75 -0.36 0.72 -0.69 0.98 0.00 0.00 173.24 174.64 2ash s VAL 38 N -0.94 4.86 0.09 5.02 1.01 -1.26 -3.15 120.40 126.04 2ash s VAL 38 Ca -0.03 1.06 -0.36 0.00 0.00 0.00 0.00 61.98 62.65 2ash s VAL 38 Cb -0.01 -4.08 -0.15 0.00 0.00 0.00 0.00 36.38 32.14 2ash s VAL 38 CO 0.02 -0.19 1.46 0.29 0.00 0.00 0.00 175.10 176.68 2ash n LYS 39 N 6.04 1.54 -0.70 2.72 5.02 -1.26 -1.70 118.16 129.82 2ash n LYS 39 Ca 0.02 0.55 0.00 0.00 -2.02 0.00 0.00 58.31 56.86 2ash n LYS 39 Cb 0.48 -2.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.24 2ash n LYS 39 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2ash n LEU 40 N 3.09 0.26 -4.64 -0.35 4.77 -1.26 -4.99 117.00 113.88 2ash n LEU 40 Ca 0.18 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.82 2ash n LEU 40 Cb 0.23 -0.41 -0.10 0.00 -2.33 0.00 0.00 43.42 40.80 2ash n LEU 40 CO 0.64 -0.13 -0.34 -0.76 -1.33 0.00 0.00 177.39 175.46 2ash s LEU 41 N 0.00 3.38 0.48 2.23 1.43 -0.69 -4.90 118.68 120.62 2ash s LEU 41 Ca 0.00 0.04 -0.05 0.00 -1.03 0.00 0.00 54.13 53.09 2ash s LEU 41 Cb 0.00 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.39 2ash s LEU 41 CO 0.00 0.35 0.78 0.42 0.23 0.00 0.00 176.35 178.13 2ash s THR 42 N -0.89 4.83 0.36 5.49 -4.23 -1.26 -4.55 115.64 115.38 2ash s THR 42 Ca 0.14 0.14 0.12 0.00 -1.18 0.00 0.00 61.69 60.91 2ash s THR 42 Cb -0.11 -3.83 0.34 0.00 1.34 0.00 0.00 72.50 70.24 2ash s THR 42 CO 0.03 -0.80 1.81 -0.65 -0.54 0.00 0.00 174.62 174.47 2ash h PRO 43 N 0.23 0.58 -0.56 3.99 0.11 -1.86 -2.31 132.00 132.18 2ash h PRO 43 Ca -0.47 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 2ash h PRO 43 Cb 1.21 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 2ash h PRO 43 CO 0.61 0.38 0.32 -0.09 -0.21 0.00 0.00 178.00 179.02 2ash h ARG 44 N 0.59 0.77 -0.52 1.05 2.43 -1.94 -0.53 114.38 116.23 2ash h ARG 44 Ca 0.53 -0.08 0.04 0.00 -0.81 0.00 0.00 59.98 59.67 2ash h ARG 44 Cb 1.05 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 30.40 2ash h ARG 44 CO -0.28 0.57 0.27 -0.44 -1.51 0.00 0.00 179.97 178.58 2ash h ASP 45 N 0.75 0.38 -0.38 -3.80 3.32 -1.85 0.02 116.42 114.86 2ash h ASP 45 Ca 0.20 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.28 2ash h ASP 45 Cb 0.01 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 2ash h ASP 45 CO -0.03 0.26 0.24 -0.07 -1.72 0.00 0.00 179.24 177.92 2ash h LEU 46 N 0.52 0.44 -0.36 1.55 3.38 -1.07 -1.00 115.31 118.77 2ash h LEU 46 Ca 0.23 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 2ash h LEU 46 Cb 0.13 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2ash h LEU 46 CO -0.16 0.34 0.19 -0.33 0.09 0.00 0.00 178.44 178.57 2ash h GLU 47 N 0.50 0.50 0.00 1.13 5.08 -0.86 -1.91 114.58 119.02 2ash h GLU 47 Ca 0.14 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 2ash h GLU 47 Cb -0.04 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 2ash h GLU 47 CO -0.03 0.41 -0.25 0.93 -1.00 0.00 0.00 179.01 179.08 2ash h GLU 48 N 0.45 0.00 0.00 2.33 5.08 -0.83 -0.91 114.58 120.69 2ash h GLU 48 Ca 0.13 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 2ash h GLU 48 Cb 0.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2ash h GLU 48 CO -0.02 0.25 -0.04 0.00 -1.00 0.00 0.00 179.01 178.20 2ash h ALA 49 N 1.75 1.02 0.00 3.43 0.00 -0.86 -3.47 119.26 121.13 2ash h ALA 49 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2ash h ALA 49 Cb 0.54 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2ash h ALA 49 CO 0.03 0.05 0.00 0.41 0.00 0.00 0.00 179.25 179.74 2ash n GLY 50 N -0.07 0.85 3.64 0.00 0.00 -0.35 -4.71 105.19 104.55 2ash n GLY 50 Ca 0.00 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 2ash n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ash s ALA 51 N -2.00 3.42 -1.85 4.61 0.00 -0.75 -4.88 121.76 120.32 2ash s ALA 51 Ca 0.00 0.84 0.27 0.00 0.00 0.00 0.00 51.96 53.06 2ash s ALA 51 Cb 0.00 -3.83 0.81 0.00 0.00 0.00 0.00 23.12 20.11 2ash s ALA 51 CO 0.00 -1.73 1.60 0.39 0.00 0.00 0.00 175.76 176.02 2ash n GLU 52 N 7.52 0.94 -3.60 0.00 1.02 -1.26 -4.67 120.64 120.58 2ash n GLU 52 Ca 0.19 -0.54 -0.09 0.00 -0.02 0.00 0.00 57.16 56.70 2ash n GLU 52 Cb 0.43 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.31 2ash n GLU 52 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 2ash s ILE 53 N -2.44 0.00 0.26 -3.67 2.07 -1.26 -3.94 121.20 112.22 2ash s ILE 53 Ca 0.26 0.00 0.05 0.00 -1.41 0.00 0.00 60.65 59.55 2ash s ILE 53 Cb 0.19 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.73 2ash s ILE 53 CO 0.49 0.00 -0.02 0.27 -1.91 0.00 0.00 174.94 173.77 2ash s ILE 54 N -0.61 1.30 -0.12 2.00 -4.36 -1.01 -4.31 121.20 114.09 2ash s ILE 54 Ca 0.01 -2.07 -0.03 0.00 -0.26 0.00 0.00 60.65 58.30 2ash s ILE 54 Cb -0.02 -2.41 -0.03 0.00 1.25 0.00 0.00 42.46 41.25 2ash s ILE 54 CO -0.02 -0.30 -0.02 -0.22 0.24 0.00 0.00 174.94 174.62 2ash s LEU 55 N -3.37 3.42 -0.13 0.37 0.20 0.20 -1.51 118.68 117.87 2ash s LEU 55 Ca 0.29 0.02 0.01 0.00 0.69 0.00 0.00 54.13 55.13 2ash s LEU 55 Cb 0.05 -1.80 -0.01 0.00 -0.43 0.00 0.00 46.19 44.00 2ash s LEU 55 CO 0.10 0.28 -0.16 -0.55 -0.29 0.00 0.00 176.35 175.74 2ash s SER 56 N -0.32 3.78 0.68 3.68 0.15 0.11 -1.02 113.70 120.75 2ash s SER 56 Ca 0.06 -0.39 -0.14 0.00 0.70 0.00 0.00 55.95 56.18 2ash s SER 56 Cb -0.12 -1.56 0.01 0.00 -1.71 0.00 0.00 66.02 62.63 2ash s SER 56 CO 0.02 0.16 1.10 0.20 1.20 0.00 0.00 173.24 175.92 2ash s ASN 57 N 0.40 5.02 0.00 5.45 -0.87 -0.52 -1.93 114.94 122.50 2ash s ASN 57 Ca -0.12 1.94 0.00 0.00 -1.57 0.00 0.00 52.86 53.11 2ash s ASN 57 Cb -0.16 -2.54 0.00 0.00 -0.02 0.00 0.00 41.25 38.52 2ash s ASN 57 CO 0.06 -1.69 0.00 0.35 -2.57 0.00 0.00 177.10 173.25 2ash n THR 58 N -2.64 0.00 0.10 1.60 -2.24 -1.25 -4.66 114.28 105.20 2ash n THR 58 Ca 0.10 -0.27 -0.12 0.00 -2.27 0.00 0.00 64.05 61.49 2ash n THR 58 Cb 0.52 0.78 -0.06 0.00 -2.10 0.00 0.00 70.33 69.47 2ash n THR 58 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2ash h PHE 59 N 0.00 -0.38 -0.02 4.78 3.57 -1.89 -1.24 116.94 121.77 2ash h PHE 59 Ca 0.00 0.01 -0.24 0.00 3.53 0.00 0.00 57.97 61.26 2ash h PHE 59 Cb 0.00 0.15 0.01 0.00 2.79 0.00 0.00 35.95 38.90 2ash h PHE 59 CO 0.00 -0.22 -0.96 0.45 -2.23 0.00 0.00 178.31 175.35 2ash h HIS 60 N -0.30 0.85 -0.38 0.41 3.86 -1.87 -3.22 115.15 114.50 2ash h HIS 60 Ca 0.02 -0.45 0.06 0.00 -1.16 0.00 0.00 60.37 58.84 2ash h HIS 60 Cb 0.30 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 28.65 2ash h HIS 60 CO -0.15 1.27 0.26 -0.07 0.86 0.00 0.00 177.93 180.10 2ash h LEU 61 N 0.34 0.22 -1.35 2.43 3.38 -1.61 0.13 115.31 118.84 2ash h LEU 61 Ca -0.10 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 2ash h LEU 61 Cb 1.60 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 42.29 2ash h LEU 61 CO 0.18 0.14 -0.11 -0.03 0.09 0.00 0.00 178.44 178.71 2ash h MET 62 N 0.25 0.30 0.06 1.13 4.05 -1.23 -0.66 114.93 118.82 2ash h MET 62 Ca 0.17 -0.07 -0.24 0.00 -0.28 0.00 0.00 59.70 59.28 2ash h MET 62 Cb 0.36 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.10 2ash h MET 62 CO -0.03 0.42 -1.27 -0.07 0.23 0.00 0.00 176.91 176.19 2ash h LEU 63 N 0.28 0.18 -7.30 3.39 3.38 -1.36 -3.37 115.31 110.52 2ash h LEU 63 Ca 0.06 -0.74 -0.33 0.00 0.09 0.00 0.00 57.88 56.96 2ash h LEU 63 Cb 0.38 -0.06 -0.37 0.00 0.09 0.00 0.00 40.66 40.70 2ash h LEU 63 CO 0.02 1.53 -0.69 -0.54 0.09 0.00 0.00 178.44 178.85 2ash s LYS 64 N -2.41 -0.02 0.00 1.13 -0.14 0.35 -3.88 119.74 114.77 2ash s LYS 64 Ca -0.24 0.46 0.29 0.00 -1.36 0.00 0.00 55.97 55.12 2ash s LYS 64 Cb 0.04 -0.38 1.20 0.00 -1.68 0.00 0.00 37.83 37.01 2ash s LYS 64 CO 0.68 -0.31 1.88 -0.35 -0.76 0.00 0.00 175.35 176.50 2ash n PRO 65 N 5.24 0.17 0.00 -1.68 -0.04 -1.22 -3.76 135.00 133.71 2ash n PRO 65 Ca -0.05 -0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 2ash n PRO 65 Cb 0.50 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 2ash n PRO 65 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ash n GLY 66 N 1.43 -0.25 0.30 0.55 0.00 -0.26 -4.57 105.19 102.39 2ash n GLY 66 Ca 0.09 -1.68 -0.06 0.00 0.00 0.00 0.00 46.02 44.38 2ash n GLY 66 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2ash h VAL 67 N 0.00 1.25 -0.72 1.61 2.07 -1.76 -3.07 116.25 115.63 2ash h VAL 67 Ca 0.00 -1.01 -0.05 0.00 0.82 0.00 0.00 66.70 66.46 2ash h VAL 67 Cb 0.00 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 2ash h VAL 67 CO 0.00 0.37 0.27 -0.08 0.02 0.00 0.00 177.57 178.15 2ash h GLU 68 N 0.87 1.09 -0.37 1.57 4.81 -1.97 -0.81 114.58 119.78 2ash h GLU 68 Ca 0.17 -0.21 -0.11 0.00 -0.13 0.00 0.00 59.36 59.09 2ash h GLU 68 Cb 0.44 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 2ash h GLU 68 CO 0.02 0.91 -0.20 0.82 -0.73 0.00 0.00 179.01 179.82 2ash h ILE 69 N 1.04 1.27 -0.52 2.32 2.04 -1.78 -2.00 117.51 119.87 2ash h ILE 69 Ca 0.24 -1.28 -0.09 0.00 1.00 0.00 0.00 64.86 64.73 2ash h ILE 69 Cb 0.24 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 2ash h ILE 69 CO -0.02 0.42 -0.04 0.40 0.00 0.00 0.00 178.15 178.92 2ash h ILE 70 N 0.63 1.27 -0.88 -0.67 2.04 -1.43 -2.92 117.51 115.54 2ash h ILE 70 Ca 0.09 -1.15 0.13 0.00 1.00 0.00 0.00 64.86 64.93 2ash h ILE 70 Cb 0.68 0.96 -0.09 0.00 -0.74 0.00 0.00 36.82 37.63 2ash h ILE 70 CO 0.05 0.41 0.49 0.11 0.00 0.00 0.00 178.15 179.21 2ash h LYS 71 N 0.82 0.72 -0.75 2.37 1.57 -0.98 -0.40 116.57 119.92 2ash h LYS 71 Ca 0.14 -0.04 0.21 0.00 -1.87 0.00 0.00 60.65 59.09 2ash h LYS 71 Cb 0.58 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.69 2ash h LYS 71 CO 0.03 0.48 0.54 -0.07 -0.57 0.00 0.00 179.45 179.86 2ash h LEU 72 N 0.74 0.03 -0.83 2.94 3.38 -1.16 0.12 115.31 120.53 2ash h LEU 72 Ca 0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.43 2ash h LEU 72 Cb 0.56 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2ash h LEU 72 CO -0.32 0.01 0.00 1.41 0.09 0.00 0.00 178.44 179.64 2ash n HIS 73 N -4.33 0.04 -3.87 1.13 8.25 -0.31 -4.91 115.22 111.22 2ash n HIS 73 Ca 0.15 -0.02 -0.29 0.00 -0.26 0.00 0.00 57.72 57.30 2ash n HIS 73 Cb 0.80 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.94 2ash n HIS 73 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2ash n ARG 74 N 0.01 -5.57 0.00 -0.41 1.74 0.42 -4.57 116.66 108.27 2ash n ARG 74 Ca 0.19 0.61 0.00 0.00 -0.77 0.00 0.00 57.85 57.88 2ash n ARG 74 Cb 0.31 -5.46 0.00 0.00 -1.02 0.00 0.00 32.46 26.28 2ash n ARG 74 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ash n GLY 75 N -1.70 1.80 0.21 -0.13 0.00 -0.36 -4.73 105.19 100.28 2ash n GLY 75 Ca -0.01 -2.18 -0.08 0.00 0.00 0.00 0.00 46.02 43.75 2ash n GLY 75 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2ash h LEU 76 N 0.00 0.56 -0.18 0.99 5.85 -1.38 -2.07 115.31 119.08 2ash h LEU 76 Ca 0.00 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.45 2ash h LEU 76 Cb 0.00 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 2ash h LEU 76 CO 0.00 0.96 0.10 0.45 -0.34 0.00 0.00 178.44 179.62 2ash h HIS 77 N 0.40 0.19 -0.51 1.25 3.86 -1.79 -1.65 115.15 116.91 2ash h HIS 77 Ca 0.02 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.22 2ash h HIS 77 Cb 1.02 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 29.40 2ash h HIS 77 CO 0.04 0.11 0.25 -0.91 0.86 0.00 0.00 177.93 178.28 2ash h ASN 78 N 0.21 0.66 -0.15 2.45 2.35 -1.77 -0.31 115.58 119.03 2ash h ASN 78 Ca 0.07 -0.13 0.04 0.00 -0.55 0.00 0.00 56.30 55.73 2ash h ASN 78 Cb -0.00 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.16 2ash h ASN 78 CO -0.04 0.60 -0.11 0.15 -1.65 0.00 0.00 177.43 176.39 2ash h PHE 79 N 0.68 -0.26 -0.10 1.19 3.57 -0.86 -2.96 116.94 118.19 2ash h PHE 79 Ca 0.17 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2ash h PHE 79 Cb 0.12 0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.99 2ash h PHE 79 CO -0.01 -0.16 0.00 0.00 -2.23 0.00 0.00 178.31 175.91 2ash n MET 80 N -5.25 1.89 -1.60 1.11 0.00 -0.66 -4.94 117.12 107.66 2ash n MET 80 Ca -0.03 -1.31 -0.05 0.00 0.00 0.00 0.00 57.70 56.31 2ash n MET 80 Cb 0.17 -1.45 -0.01 0.00 0.00 0.00 0.00 33.22 31.93 2ash n MET 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2ash n GLY 81 N 1.23 0.49 3.35 3.17 0.00 -0.41 -4.78 105.19 108.24 2ash n GLY 81 Ca 0.17 -0.75 -0.36 0.00 0.00 0.00 0.00 46.02 45.08 2ash n GLY 81 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2ash s TRP 82 N -2.23 3.01 -2.16 1.61 -0.11 -0.26 -4.77 118.94 114.03 2ash s TRP 82 Ca 0.00 -0.80 0.21 0.00 1.22 0.00 0.00 56.10 56.73 2ash s TRP 82 Cb 0.00 -2.16 0.40 0.00 -1.50 0.00 0.00 33.47 30.21 2ash s TRP 82 CO 0.00 -0.50 1.35 1.63 -4.62 0.00 0.00 176.95 174.81 2ash n LYS 83 N 4.84 2.40 -3.65 5.86 4.01 -1.26 -4.49 118.16 125.87 2ash n LYS 83 Ca -0.17 -2.20 -0.24 0.00 -0.51 0.00 0.00 58.31 55.19 2ash n LYS 83 Cb 0.51 -1.47 0.00 0.00 -0.51 0.00 0.00 35.03 33.57 2ash n LYS 83 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2ash s ARG 84 N -1.34 2.31 0.53 1.97 0.52 -1.26 -4.85 118.95 116.83 2ash s ARG 84 Ca 0.36 -1.86 -0.22 0.00 -0.52 0.00 0.00 55.73 53.49 2ash s ARG 84 Cb 0.21 -2.26 -0.06 0.00 0.52 0.00 0.00 34.95 33.36 2ash s ARG 84 CO 0.28 -0.60 1.29 -2.30 0.02 0.00 0.00 175.30 173.99 2ash n PRO 85 N -1.83 1.60 -4.63 3.54 -0.02 -1.25 -4.88 135.00 127.52 2ash n PRO 85 Ca 0.03 0.59 -0.24 0.00 -2.02 0.00 0.00 63.50 61.86 2ash n PRO 85 Cb 0.63 -2.48 -0.16 0.00 -0.02 0.00 0.00 33.50 31.47 2ash n PRO 85 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2ash s ILE 86 N -1.31 1.17 -0.18 4.25 1.01 -1.26 -2.42 121.20 122.47 2ash s ILE 86 Ca 0.71 -0.53 -0.12 0.00 0.00 0.00 0.00 60.65 60.70 2ash s ILE 86 Cb -0.43 -1.04 -0.05 0.00 0.01 0.00 0.00 42.46 40.95 2ash s ILE 86 CO 0.50 0.35 0.22 -0.22 0.00 0.00 0.00 174.94 175.79 2ash s LEU 87 N 0.39 4.23 -0.14 2.97 0.20 -0.57 -1.05 118.68 124.72 2ash s LEU 87 Ca -0.09 0.38 -0.05 0.00 0.69 0.00 0.00 54.13 55.06 2ash s LEU 87 Cb -0.13 -2.24 -0.03 0.00 -0.43 0.00 0.00 46.19 43.35 2ash s LEU 87 CO 0.03 0.14 0.02 0.42 -0.29 0.00 0.00 176.35 176.67 2ash s THR 88 N 0.38 4.44 0.37 3.68 -4.23 -0.36 -0.71 115.64 119.21 2ash s THR 88 Ca 0.13 -0.17 -0.24 0.00 -1.18 0.00 0.00 61.69 60.22 2ash s THR 88 Cb -0.12 -2.94 -0.10 0.00 1.34 0.00 0.00 72.50 70.68 2ash s THR 88 CO 0.01 0.52 0.97 -0.62 -0.54 0.00 0.00 174.62 174.97 2ash s ASP 89 N -0.11 7.08 0.00 3.99 2.15 -0.81 -2.86 116.67 126.11 2ash s ASP 89 Ca 0.05 1.83 0.28 0.00 0.43 0.00 0.00 52.55 55.14 2ash s ASP 89 Cb -0.12 -2.57 1.12 0.00 -0.30 0.00 0.00 42.92 41.04 2ash s ASP 89 CO 0.02 -0.26 1.78 -1.54 -0.17 0.00 0.00 175.17 175.00 2ash n SER 90 N 0.03 0.94 0.00 -0.34 3.41 -1.26 -3.81 113.62 112.59 2ash n SER 90 Ca 0.04 -1.05 0.00 0.00 -0.26 0.00 0.00 58.87 57.60 2ash n SER 90 Cb 0.51 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 2ash n SER 90 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ash n GLY 91 N 1.22 0.77 0.26 5.00 0.00 -1.26 -4.85 105.19 106.33 2ash n GLY 91 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 2ash n GLY 91 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ash h GLY 92 N 0.00 0.52 1.47 -0.02 0.00 -1.92 -1.23 103.07 101.88 2ash h GLY 92 Ca 0.00 -0.33 -0.22 0.00 0.00 0.00 0.00 47.33 46.78 2ash h GLY 92 CO 0.00 0.31 -0.88 -2.75 0.00 0.00 0.00 176.54 173.22 2ash h PHE 93 N 0.46 0.71 -0.78 5.60 3.57 -1.93 -1.42 116.94 123.13 2ash h PHE 93 Ca 0.09 -0.36 -0.02 0.00 3.53 0.00 0.00 57.97 61.21 2ash h PHE 93 Cb 0.41 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.02 2ash h PHE 93 CO 0.01 1.16 0.40 1.96 -2.23 0.00 0.00 178.31 179.61 2ash h GLN 94 N 0.30 1.12 -0.33 1.11 1.08 -1.89 0.25 115.11 116.75 2ash h GLN 94 Ca -0.07 -0.15 -0.16 0.00 -1.45 0.00 0.00 58.65 56.81 2ash h GLN 94 Cb 1.50 -0.21 -0.00 0.00 -0.05 0.00 0.00 27.48 28.72 2ash h GLN 94 CO 0.16 0.85 -0.45 0.28 -0.95 0.00 0.00 178.83 178.72 2ash h VAL 95 N 1.10 1.28 -0.51 -0.54 2.07 -1.26 -2.30 116.25 116.09 2ash h VAL 95 Ca 0.27 -1.63 0.07 0.00 0.82 0.00 0.00 66.70 66.24 2ash h VAL 95 Cb 0.09 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 2ash h VAL 95 CO -0.04 0.53 0.34 0.15 0.02 0.00 0.00 177.57 178.58 2ash h PHE 96 N 0.68 0.39 0.00 1.57 3.57 -0.99 -2.79 116.94 119.37 2ash h PHE 96 Ca 0.04 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.55 2ash h PHE 96 Cb 1.03 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.64 2ash h PHE 96 CO 0.06 0.20 -0.25 0.43 -2.23 0.00 0.00 178.31 176.52 2ash n SER 97 N -4.47 0.58 -4.78 0.41 7.64 0.87 -4.91 113.62 108.96 2ash n SER 97 Ca 0.07 0.32 -0.37 0.00 1.01 0.00 0.00 58.87 59.90 2ash n SER 97 Cb 0.29 -0.31 -0.04 0.00 -1.01 0.00 0.00 64.21 63.14 2ash n SER 97 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2ash s LEU 98 N -3.93 4.16 0.49 -3.43 1.43 -0.91 -5.05 118.68 111.45 2ash s LEU 98 Ca 0.10 2.02 -0.20 0.00 -1.03 0.00 0.00 54.13 55.03 2ash s LEU 98 Cb 0.15 -4.16 -0.09 0.00 0.03 0.00 0.00 46.19 42.12 2ash s LEU 98 CO 0.63 -0.45 1.01 -2.16 0.23 0.00 0.00 176.35 175.62 2ash s PRO 99 N -2.45 3.87 -0.94 1.29 0.04 -1.26 -4.67 135.00 130.88 2ash s PRO 99 Ca 0.57 1.25 -0.10 0.00 0.04 0.00 0.00 61.00 62.76 2ash s PRO 99 Cb -0.22 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.22 2ash s PRO 99 CO 0.27 -0.36 0.68 1.63 0.04 0.00 0.00 177.00 179.26 2ash n LYS 100 N -1.05 -1.23 -4.05 4.56 4.76 -1.26 -4.82 118.16 115.06 2ash n LYS 100 Ca 0.08 0.72 -0.26 0.00 -2.87 0.00 0.00 58.31 55.99 2ash n LYS 100 Cb 0.53 -3.38 -0.05 0.00 -1.84 0.00 0.00 35.03 30.29 2ash n LYS 100 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 2ash s ILE 101 N -3.18 4.68 -0.33 -0.18 -4.36 -1.26 -4.71 121.20 111.87 2ash s ILE 101 Ca 0.18 -1.03 -0.07 0.00 -0.26 0.00 0.00 60.65 59.47 2ash s ILE 101 Cb -0.08 -3.42 0.03 0.00 1.25 0.00 0.00 42.46 40.24 2ash s ILE 101 CO 0.87 -0.14 0.11 0.00 0.24 0.00 0.00 174.94 176.03 2ash s ARG 102 N -3.24 2.84 -0.11 0.37 1.04 -0.39 -4.98 118.95 114.48 2ash s ARG 102 Ca 0.32 -1.04 -0.01 0.00 -1.04 0.00 0.00 55.73 53.97 2ash s ARG 102 Cb -0.10 -3.47 -0.02 0.00 -2.04 0.00 0.00 34.95 29.32 2ash s ARG 102 CO 0.25 -0.58 -0.08 0.42 -0.04 0.00 0.00 175.30 175.26 2ash s ILE 103 N 1.47 3.51 0.00 4.99 1.09 -1.26 -0.98 121.20 130.02 2ash s ILE 103 Ca 0.01 -0.52 0.00 0.00 -1.10 0.00 0.00 60.65 59.04 2ash s ILE 103 Cb -0.19 -2.48 0.00 0.00 -1.06 0.00 0.00 42.46 38.74 2ash s ILE 103 CO 0.03 0.54 0.00 -0.90 -0.10 0.00 0.00 174.94 174.52 2ash n ASP 104 N 3.04 0.00 0.20 3.58 5.68 -0.32 -5.02 116.55 123.71 2ash n ASP 104 Ca -0.18 -0.57 0.04 0.00 -0.50 0.00 0.00 54.79 53.58 2ash n ASP 104 Cb 0.53 0.00 0.43 0.00 -1.14 0.00 0.00 41.12 40.93 2ash n ASP 104 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2ash h ASP 105 N 0.00 0.03 -0.23 -1.12 3.32 -2.00 -3.03 116.42 113.40 2ash h ASP 105 Ca 0.00 -0.01 -0.16 0.00 0.02 0.00 0.00 57.03 56.88 2ash h ASP 105 Cb 0.00 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 2ash h ASP 105 CO 0.00 0.29 -0.47 -0.08 -1.72 0.00 0.00 179.24 177.26 2ash h GLU 106 N 0.03 0.80 0.00 3.56 4.57 -1.98 -3.49 114.58 118.06 2ash h GLU 106 Ca 0.00 -0.46 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 2ash h GLU 106 Cb 0.47 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 2ash h GLU 106 CO 0.03 1.09 0.00 0.41 -1.18 0.00 0.00 179.01 179.36 2ash n GLY 107 N 0.20 -0.52 3.06 1.92 0.00 -1.14 -4.71 105.19 104.00 2ash n GLY 107 Ca -0.03 -0.94 -0.27 0.00 0.00 0.00 0.00 46.02 44.78 2ash n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ash s VAL 108 N -3.13 1.35 -0.08 1.61 0.11 -0.06 -1.18 120.40 119.03 2ash s VAL 108 Ca 0.00 -0.60 -0.03 0.00 -2.93 0.00 0.00 61.98 58.42 2ash s VAL 108 Cb 0.00 -1.22 -0.04 0.00 -1.53 0.00 0.00 36.38 33.59 2ash s VAL 108 CO 0.00 0.41 0.05 -0.69 -3.33 0.00 0.00 175.10 171.54 2ash s VAL 109 N 0.68 4.70 0.27 2.04 1.01 -0.15 -1.26 120.40 127.69 2ash s VAL 109 Ca -0.14 -0.15 -0.15 0.00 0.00 0.00 0.00 61.98 61.54 2ash s VAL 109 Cb -0.16 -3.02 0.01 0.00 0.00 0.00 0.00 36.38 33.20 2ash s VAL 109 CO 0.04 0.57 0.58 0.72 0.00 0.00 0.00 175.10 177.01 2ash s PHE 110 N -0.97 0.20 -0.13 5.22 -0.71 -0.49 -1.26 117.98 119.84 2ash s PHE 110 Ca 0.15 -0.61 -0.11 0.00 -1.04 0.00 0.00 56.93 55.33 2ash s PHE 110 Cb -0.12 0.39 -0.05 0.00 -1.21 0.00 0.00 43.02 42.04 2ash s PHE 110 CO 0.05 -1.12 0.23 -0.98 -1.34 0.00 0.00 175.22 172.05 2ash s ARG 111 N -3.81 3.89 0.15 1.99 3.03 -1.26 0.41 118.95 123.35 2ash s ARG 111 Ca 0.19 0.01 -0.31 0.00 2.03 0.00 0.00 55.73 57.64 2ash s ARG 111 Cb -0.03 -3.30 -0.10 0.00 -1.03 0.00 0.00 34.95 30.48 2ash s ARG 111 CO 0.09 0.52 1.67 0.45 -1.13 0.00 0.00 175.30 176.90 2ash s SER 112 N -0.36 6.51 0.48 -2.89 0.15 0.24 -4.82 113.70 113.01 2ash s SER 112 Ca 0.16 2.69 0.28 0.00 0.70 0.00 0.00 55.95 59.77 2ash s SER 112 Cb -0.13 -2.59 1.51 0.00 -1.71 0.00 0.00 66.02 63.11 2ash s SER 112 CO 0.04 -0.90 1.83 -0.65 1.20 0.00 0.00 173.24 174.76 2ash h PRO 113 N 7.33 0.00 0.02 5.44 0.11 -1.96 0.10 132.00 143.05 2ash h PRO 113 Ca -0.43 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.32 2ash h PRO 113 Cb 1.20 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.26 2ash h PRO 113 CO 0.93 0.00 -2.23 -0.89 -0.21 0.00 0.00 178.00 175.60 2ash n ILE 114 N -2.55 1.52 0.00 4.15 -0.00 -1.26 -4.80 119.36 116.42 2ash n ILE 114 Ca -0.02 -0.74 0.00 0.00 -0.00 0.00 0.00 62.75 62.00 2ash n ILE 114 Cb 0.16 -1.02 0.00 0.00 -0.00 0.00 0.00 39.64 38.77 2ash n ILE 114 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 2ash n ASP 115 N -3.06 3.84 0.00 4.38 -0.08 -1.09 -5.01 116.55 115.53 2ash n ASP 115 Ca -0.34 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 52.94 2ash n ASP 115 Cb 1.08 0.43 0.00 0.00 2.34 0.00 0.00 41.12 44.97 2ash n ASP 115 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2ash n GLY 116 N 2.35 2.59 3.74 0.27 0.00 0.33 -4.93 105.19 109.55 2ash n GLY 116 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2ash n GLY 116 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ash s SER 117 N -3.60 4.75 -0.04 1.61 1.04 -1.26 -4.15 113.70 112.05 2ash s SER 117 Ca 0.00 2.29 -0.30 0.00 0.48 0.00 0.00 55.95 58.42 2ash s SER 117 Cb 0.00 -2.58 -0.04 0.00 0.10 0.00 0.00 66.02 63.49 2ash s SER 117 CO 0.00 -1.88 1.33 -1.59 0.98 0.00 0.00 173.24 172.08 2ash s LYS 118 N -3.73 4.29 -0.08 4.02 -2.85 -1.26 0.79 119.74 120.92 2ash s LYS 118 Ca 0.74 1.84 0.02 0.00 -1.00 0.00 0.00 55.97 57.56 2ash s LYS 118 Cb -0.28 -3.62 -0.03 0.00 -2.06 0.00 0.00 37.83 31.85 2ash s LYS 118 CO 0.40 -0.57 -0.11 0.08 0.10 0.00 0.00 175.35 175.25 2ash s VAL 119 N 2.58 3.31 -0.14 1.79 1.01 0.16 -4.90 120.40 124.21 2ash s VAL 119 Ca 0.60 -0.61 -0.01 0.00 0.00 0.00 0.00 61.98 61.96 2ash s VAL 119 Cb -0.28 -2.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.74 2ash s VAL 119 CO 0.23 0.58 -0.10 0.12 0.00 0.00 0.00 175.10 175.93 2ash s PHE 120 N -0.49 2.89 -0.03 5.22 5.36 -1.26 -1.40 117.98 128.27 2ash s PHE 120 Ca 0.07 -0.56 0.03 0.00 -0.96 0.00 0.00 56.93 55.51 2ash s PHE 120 Cb -0.12 -1.90 -0.00 0.00 -0.34 0.00 0.00 43.02 40.66 2ash s PHE 120 CO 0.02 -0.18 -0.12 -1.17 -1.46 0.00 0.00 175.22 172.30 2ash s LEU 121 N 0.44 1.88 0.31 6.12 2.96 -0.39 -5.00 118.68 124.99 2ash s LEU 121 Ca -0.08 -0.25 -0.05 0.00 -0.22 0.00 0.00 54.13 53.54 2ash s LEU 121 Cb -0.15 -0.70 -0.00 0.00 0.50 0.00 0.00 46.19 45.83 2ash s LEU 121 CO 0.04 0.11 0.44 0.54 -1.32 0.00 0.00 176.35 176.16 2ash s ASN 122 N 0.04 0.62 0.24 3.68 2.20 -1.26 -0.88 114.94 119.57 2ash s ASN 122 Ca -0.01 -1.35 -0.06 0.00 -0.94 0.00 0.00 52.86 50.49 2ash s ASN 122 Cb -0.09 0.62 0.34 0.00 -2.00 0.00 0.00 41.25 40.12 2ash s ASN 122 CO 0.01 -1.22 1.83 -0.65 -2.94 0.00 0.00 177.10 174.13 2ash h PRO 123 N 2.19 0.83 -0.28 3.55 0.11 -1.89 -1.62 132.00 134.89 2ash h PRO 123 Ca -0.29 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.77 2ash h PRO 123 Cb 1.24 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2ash h PRO 123 CO 0.39 0.55 0.16 0.93 -0.21 0.00 0.00 178.00 179.82 2ash h GLU 124 N 0.85 0.38 -0.59 1.05 3.07 -1.94 -1.29 114.58 116.11 2ash h GLU 124 Ca 0.37 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 59.16 2ash h GLU 124 Cb 0.25 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.05 2ash h GLU 124 CO -0.20 0.31 0.26 0.82 -1.40 0.00 0.00 179.01 178.81 2ash h ILE 125 N 0.35 1.22 -0.55 3.13 2.04 -1.92 -1.85 117.51 119.93 2ash h ILE 125 Ca 0.10 -0.64 0.02 0.00 1.00 0.00 0.00 64.86 65.35 2ash h ILE 125 Cb 0.03 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 2ash h ILE 125 CO -0.02 0.25 0.33 -1.28 0.00 0.00 0.00 178.15 177.44 2ash h SER 126 N 0.80 0.54 -0.46 1.72 0.87 -1.04 -0.90 113.55 115.08 2ash h SER 126 Ca 0.20 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.69 2ash h SER 126 Cb 0.15 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 2ash h SER 126 CO -0.02 0.38 0.00 0.24 -0.53 0.00 0.00 176.83 176.90 2ash h MET 127 N 0.66 0.81 -0.90 2.24 2.86 -1.09 -1.77 114.93 117.73 2ash h MET 127 Ca 0.22 -0.26 0.05 0.00 -2.06 0.00 0.00 59.70 57.65 2ash h MET 127 Cb 0.01 -0.07 -0.06 0.00 0.06 0.00 0.00 31.60 31.54 2ash h MET 127 CO -0.09 0.86 0.57 1.49 1.06 0.00 0.00 176.91 180.81 2ash h GLU 128 N 0.66 1.05 -0.16 1.72 4.81 -1.04 0.21 114.58 121.82 2ash h GLU 128 Ca 0.13 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 2ash h GLU 128 Cb 0.50 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 2ash h GLU 128 CO 0.02 0.69 0.02 0.28 -0.73 0.00 0.00 179.01 179.29 2ash h VAL 129 N 1.08 1.23 -0.16 0.32 2.07 -0.87 -2.04 116.25 117.87 2ash h VAL 129 Ca 0.38 -0.76 -0.16 0.00 0.82 0.00 0.00 66.70 66.98 2ash h VAL 129 Cb 0.10 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 2ash h VAL 129 CO -0.15 0.23 -0.56 1.56 0.02 0.00 0.00 177.57 178.66 2ash h GLN 130 N 0.04 0.50 -0.41 1.57 4.20 -1.07 -1.13 115.11 118.81 2ash h GLN 130 Ca 0.05 -0.32 0.04 0.00 0.06 0.00 0.00 58.65 58.48 2ash h GLN 130 Cb 0.33 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 2ash h GLN 130 CO 0.01 0.93 0.17 0.82 -0.67 0.00 0.00 178.83 180.08 2ash h ILE 131 N 0.38 0.92 -0.36 2.54 2.04 -0.98 -1.53 117.51 120.52 2ash h ILE 131 Ca 0.00 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 2ash h ILE 131 Cb 1.10 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 2ash h ILE 131 CO 0.10 0.06 0.11 0.00 0.00 0.00 0.00 178.15 178.43 2ash h ALA 132 N 1.24 1.52 -0.12 1.87 0.00 -0.78 -2.52 119.26 120.48 2ash h ALA 132 Ca 0.18 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 2ash h ALA 132 Cb 0.13 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2ash h ALA 132 CO -0.16 0.36 -0.52 -0.07 0.00 0.00 0.00 179.25 178.86 2ash h LEU 133 N 0.51 0.36 0.42 0.00 3.38 -0.94 -3.41 115.31 115.64 2ash h LEU 133 Ca 0.12 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 2ash h LEU 133 Cb 0.16 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2ash h LEU 133 CO -0.01 0.82 -0.10 0.61 0.09 0.00 0.00 178.44 179.86 2ash n GLY 134 N 0.12 0.46 3.74 0.83 0.00 -0.60 -1.14 105.19 108.60 2ash n GLY 134 Ca -0.02 -0.79 -0.36 0.00 0.00 0.00 0.00 46.02 44.85 2ash n GLY 134 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ash s SER 135 N -2.88 4.76 0.23 1.61 1.04 -1.25 -4.93 113.70 112.29 2ash s SER 135 Ca 0.00 2.42 -0.04 0.00 0.48 0.00 0.00 55.95 58.82 2ash s SER 135 Cb 0.00 -2.60 0.25 0.00 0.10 0.00 0.00 66.02 63.77 2ash s SER 135 CO 0.00 -1.89 1.71 0.44 0.98 0.00 0.00 173.24 174.48 2ash h ASP 136 N 0.43 0.81 -3.33 7.02 5.19 -1.38 -3.42 116.42 121.75 2ash h ASP 136 Ca -0.50 -0.23 -0.57 0.00 -0.62 0.00 0.00 57.03 55.12 2ash h ASP 136 Cb 1.31 -0.22 -0.34 0.00 0.18 0.00 0.00 39.33 40.26 2ash h ASP 136 CO 0.53 0.91 -0.83 -0.63 -3.12 0.00 0.00 179.24 176.10 2ash s ILE 137 N -4.89 1.42 0.06 0.35 1.01 -0.97 -0.88 121.20 117.30 2ash s ILE 137 Ca -0.10 -0.62 0.03 0.00 0.00 0.00 0.00 60.65 59.96 2ash s ILE 137 Cb 0.14 -1.29 -0.04 0.00 0.01 0.00 0.00 42.46 41.29 2ash s ILE 137 CO 0.83 0.42 0.03 0.00 0.00 0.00 0.00 174.94 176.22 2ash s MET 139 N -2.11 3.22 0.69 0.00 1.00 -1.13 -0.88 119.30 120.09 2ash s MET 139 Ca 0.25 -0.31 -0.17 0.00 0.00 0.00 0.00 55.69 55.47 2ash s MET 139 Cb -0.12 -2.99 0.01 0.00 0.00 0.00 0.00 34.83 31.73 2ash s MET 139 CO 0.17 0.72 1.16 1.33 0.00 0.00 0.00 175.02 178.40 2ash n VAL 140 N 1.74 3.74 -2.84 -6.03 0.24 -0.65 -4.51 118.33 110.02 2ash n VAL 140 Ca -0.17 -0.41 -0.42 0.00 -2.04 0.00 0.00 64.34 61.30 2ash n VAL 140 Cb 0.54 -1.30 -0.04 0.00 -1.47 0.00 0.00 33.84 31.57 2ash n VAL 140 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 2ash s PHE 141 N -1.65 3.45 0.36 6.34 5.36 -1.26 -4.65 117.98 125.93 2ash s PHE 141 Ca 0.78 1.34 0.07 0.00 -0.96 0.00 0.00 56.93 58.17 2ash s PHE 141 Cb -0.36 -3.05 -0.07 0.00 -0.34 0.00 0.00 43.02 39.20 2ash s PHE 141 CO 0.45 -0.23 -0.03 0.16 -1.46 0.00 0.00 175.22 174.12 2ash s ASP 142 N 1.13 3.51 -0.38 6.13 -4.77 -1.26 -4.32 116.67 116.70 2ash s ASP 142 Ca 0.41 -1.29 -0.05 0.00 -3.30 0.00 0.00 52.55 48.32 2ash s ASP 142 Cb -0.17 -0.32 0.08 0.00 -1.09 0.00 0.00 42.92 41.42 2ash s ASP 142 CO 0.14 -0.37 0.16 -2.28 0.70 0.00 0.00 175.17 173.52 2ash s HIS 143 N -2.78 3.39 -0.35 2.11 2.46 -1.26 -4.74 115.29 114.12 2ash s HIS 143 Ca 0.34 -1.88 -0.21 0.00 0.47 0.00 0.00 55.06 53.77 2ash s HIS 143 Cb 0.06 -2.76 0.00 0.00 -0.13 0.00 0.00 32.58 29.75 2ash s HIS 143 CO 0.16 -0.86 0.66 0.00 -2.47 0.00 0.00 174.74 172.23 2ash s PRO 145 N 2.76 1.80 0.00 0.00 0.04 -1.26 -4.81 135.00 133.53 2ash s PRO 145 Ca 0.26 -0.42 0.00 0.00 0.04 0.00 0.00 61.00 60.88 2ash s PRO 145 Cb -0.14 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.27 2ash s PRO 145 CO 0.14 -1.51 0.00 1.55 0.04 0.00 0.00 177.00 177.22 2ash n VAL 146 N -3.08 0.00 0.00 -0.36 3.14 -1.26 -4.94 118.33 111.82 2ash n VAL 146 Ca 0.11 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.49 2ash n VAL 146 Cb 0.60 -0.04 0.00 0.00 -1.06 0.00 0.00 33.84 33.35 2ash n VAL 146 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2ash n ALA 149 N -3.00 0.00 -1.54 1.55 0.00 -1.26 -4.93 120.51 111.33 2ash n ALA 149 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 2ash n ALA 149 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.51 2ash n ALA 149 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ash s ASP 150 N 0.00 4.70 0.21 0.00 1.11 -1.26 -4.72 116.67 116.71 2ash s ASP 150 Ca 0.00 2.33 -0.09 0.00 0.18 0.00 0.00 52.55 54.96 2ash s ASP 150 Cb 0.00 -2.59 0.27 0.00 1.07 0.00 0.00 42.92 41.67 2ash s ASP 150 CO 0.00 -1.92 1.76 0.22 1.18 0.00 0.00 175.17 176.41 2ash h TYR 151 N 0.21 0.46 -0.51 4.23 3.20 -2.01 -1.21 116.97 121.34 2ash h TYR 151 Ca -0.49 0.03 0.10 0.00 3.14 0.00 0.00 58.73 61.51 2ash h TYR 151 Cb 1.29 -0.11 -0.08 0.00 1.54 0.00 0.00 36.73 39.37 2ash h TYR 151 CO 0.48 0.14 0.05 0.93 -1.64 0.00 0.00 178.16 178.12 2ash h GLU 152 N 0.46 0.17 -0.54 1.82 4.39 -1.99 0.11 114.58 119.01 2ash h GLU 152 Ca 0.30 -0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.93 2ash h GLU 152 Cb 0.34 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 2ash h GLU 152 CO -0.28 0.11 0.07 1.49 -1.16 0.00 0.00 179.01 179.25 2ash h GLU 153 N 0.17 0.90 -0.44 2.33 4.81 -1.72 -2.15 114.58 118.48 2ash h GLU 153 Ca 0.26 -0.25 -0.14 0.00 -0.13 0.00 0.00 59.36 59.11 2ash h GLU 153 Cb 0.38 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2ash h GLU 153 CO -0.39 0.88 -0.26 0.28 -0.73 0.00 0.00 179.01 178.79 2ash h VAL 154 N 0.78 1.27 -0.27 0.32 2.07 -0.80 -2.48 116.25 117.15 2ash h VAL 154 Ca 0.16 -1.42 -0.03 0.00 0.82 0.00 0.00 66.70 66.23 2ash h VAL 154 Cb 0.43 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 2ash h VAL 154 CO 0.01 0.48 0.02 0.50 0.02 0.00 0.00 177.57 178.60 2ash h LYS 155 N 0.78 0.39 -0.33 1.57 3.64 -0.72 -0.98 116.57 120.92 2ash h LYS 155 Ca 0.09 -0.07 -0.14 0.00 -1.27 0.00 0.00 60.65 59.26 2ash h LYS 155 Cb 0.84 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.59 2ash h LYS 155 CO 0.07 0.41 -0.36 1.49 -2.27 0.00 0.00 179.45 178.80 2ash h GLU 156 N 0.39 0.82 -0.19 1.90 4.81 -1.21 -1.28 114.58 119.82 2ash h GLU 156 Ca 0.09 -0.44 -0.13 0.00 -0.13 0.00 0.00 59.36 58.75 2ash h GLU 156 Cb 0.23 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 2ash h GLU 156 CO 0.00 1.08 -0.43 0.00 -0.73 0.00 0.00 179.01 178.94 2ash h ALA 157 N 0.73 0.92 -0.24 2.92 0.00 -1.15 -0.75 119.26 121.68 2ash h ALA 157 Ca 0.05 -0.44 -0.14 0.00 0.00 0.00 0.00 54.91 54.37 2ash h ALA 157 Cb 0.94 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 2ash h ALA 157 CO 0.09 0.64 -0.41 1.15 0.00 0.00 0.00 179.25 180.71 2ash h THR 158 N 0.36 1.31 -0.37 0.00 2.02 -1.10 -0.55 112.91 114.58 2ash h THR 158 Ca 0.03 -1.61 -0.01 0.00 0.77 0.00 0.00 66.41 65.59 2ash h THR 158 Cb 0.90 1.74 -0.02 0.00 -1.74 0.00 0.00 68.15 69.03 2ash h THR 158 CO 0.08 0.51 0.20 -0.33 0.37 0.00 0.00 175.52 176.35 2ash h GLU 159 N 0.43 0.52 -0.94 6.66 5.08 -1.17 -2.47 114.58 122.69 2ash h GLU 159 Ca 0.02 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2ash h GLU 159 Cb 1.01 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 30.11 2ash h GLU 159 CO 0.09 0.43 0.62 -0.09 -1.00 0.00 0.00 179.01 179.07 2ash h ARG 160 N 0.47 1.22 -0.67 2.33 2.43 -1.05 -2.60 114.38 116.52 2ash h ARG 160 Ca 0.13 -0.07 0.07 0.00 -0.81 0.00 0.00 59.98 59.30 2ash h ARG 160 Cb 0.06 -0.28 -0.06 0.00 -0.42 0.00 0.00 29.97 29.28 2ash h ARG 160 CO -0.02 0.81 0.36 1.15 -1.51 0.00 0.00 179.97 180.75 2ash h THR 161 N 1.26 0.93 -0.17 0.20 2.02 -0.98 0.33 112.91 116.50 2ash h THR 161 Ca 0.35 -0.22 0.03 0.00 0.77 0.00 0.00 66.41 67.34 2ash h THR 161 Cb -0.12 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 66.49 2ash h THR 161 CO -0.08 0.12 -0.03 0.22 0.37 0.00 0.00 175.52 176.11 2ash h TYR 162 N 0.65 -0.07 -0.58 3.16 3.20 -1.12 0.19 116.97 122.40 2ash h TYR 162 Ca 0.31 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.15 2ash h TYR 162 Cb 0.24 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.54 2ash h TYR 162 CO -0.09 -0.06 0.18 0.00 -1.64 0.00 0.00 178.16 176.55 2ash h ARG 163 N 0.01 0.87 -0.02 1.82 3.08 -1.08 -1.90 114.38 117.16 2ash h ARG 163 Ca 0.08 -0.16 -0.13 0.00 0.07 0.00 0.00 59.98 59.84 2ash h ARG 163 Cb 0.12 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 2ash h ARG 163 CO -0.16 0.75 -0.59 -1.49 -1.07 0.00 0.00 179.97 177.41 2ash h TRP 164 N 0.85 0.07 -0.57 3.04 4.06 -0.77 -2.43 115.95 120.19 2ash h TRP 164 Ca 0.19 -0.03 -0.07 0.00 2.06 0.00 0.00 58.89 61.04 2ash h TRP 164 Cb 0.25 -0.01 -0.02 0.00 -1.00 0.00 0.00 29.16 28.37 2ash h TRP 164 CO 0.02 0.63 0.09 0.00 -3.56 0.00 0.00 178.44 175.62 2ash h ALA 165 N 1.36 0.76 -0.01 1.49 0.00 0.09 0.15 119.26 123.10 2ash h ALA 165 Ca -0.01 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.66 2ash h ALA 165 Cb 1.06 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2ash h ALA 165 CO 0.08 0.52 -0.07 -0.07 0.00 0.00 0.00 179.25 179.71 2ash h LEU 166 N 0.85 -0.20 -1.06 0.00 3.38 -1.25 -1.16 115.31 115.86 2ash h LEU 166 Ca 0.17 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.13 2ash h LEU 166 Cb 0.43 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 2ash h LEU 166 CO 0.01 -0.10 0.15 0.03 0.09 0.00 0.00 178.44 178.62 2ash h ARG 167 N -0.11 0.81 -0.18 1.13 3.08 -1.36 -1.45 114.38 116.30 2ash h ARG 167 Ca 0.03 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2ash h ARG 167 Cb 0.16 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 2ash h ARG 167 CO -0.08 0.72 0.09 0.77 -1.07 0.00 0.00 179.97 180.40 2ash h SER 168 N 0.79 0.24 -0.68 7.04 0.02 -0.74 -1.87 113.55 118.35 2ash h SER 168 Ca 0.18 -0.12 -0.04 0.00 -0.84 0.00 0.00 61.79 60.96 2ash h SER 168 Cb 0.27 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.71 2ash h SER 168 CO -0.00 0.30 0.25 0.50 -1.14 0.00 0.00 176.83 176.73 2ash h LYS 169 N 0.17 1.03 -0.13 3.45 3.64 -0.89 -2.25 116.57 121.58 2ash h LYS 169 Ca 0.06 -0.20 -0.07 0.00 -1.27 0.00 0.00 60.65 59.17 2ash h LYS 169 Cb 0.12 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 2ash h LYS 169 CO -0.01 0.87 -0.23 0.87 -2.27 0.00 0.00 179.45 178.69 2ash h LYS 170 N 0.98 0.23 -0.00 1.90 1.57 -1.19 -1.87 116.57 118.18 2ash h LYS 170 Ca 0.22 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2ash h LYS 170 Cb 0.24 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2ash h LYS 170 CO -0.01 0.46 -0.08 0.00 -0.57 0.00 0.00 179.45 179.25 2ash n ALA 171 N -2.48 2.66 -2.41 3.86 0.00 -0.71 -4.65 120.51 116.77 2ash n ALA 171 Ca -0.01 -0.21 -0.43 0.00 0.00 0.00 0.00 53.44 52.80 2ash n ALA 171 Cb 0.34 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.40 2ash n ALA 171 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2ash n PHE 172 N -1.17 3.39 -3.44 0.00 7.35 -0.71 -4.79 117.46 118.09 2ash n PHE 172 Ca 0.13 -2.91 -0.43 0.00 -0.76 0.00 0.00 57.45 53.48 2ash n PHE 172 Cb 0.27 -2.05 -0.06 0.00 0.35 0.00 0.00 39.48 37.99 2ash n PHE 172 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 2ash s LYS 173 N 0.89 2.94 0.08 -4.13 1.02 -1.26 -4.99 119.74 114.28 2ash s LYS 173 Ca 0.41 -2.04 -0.02 0.00 0.02 0.00 0.00 55.97 54.34 2ash s LYS 173 Cb 0.08 -4.14 0.01 0.00 -0.52 0.00 0.00 37.83 33.25 2ash s LYS 173 CO -0.00 -1.26 0.15 0.25 -0.92 0.00 0.00 175.35 173.57 2ash n THR 174 N 4.57 0.00 -4.03 2.17 -2.24 -1.26 -5.09 114.28 108.40 2ash n THR 174 Ca -0.02 -0.28 -0.08 0.00 -2.27 0.00 0.00 64.05 61.40 2ash n THR 174 Cb 0.42 0.23 -0.10 0.00 -2.10 0.00 0.00 70.33 68.77 2ash n THR 174 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2ash s GLU 175 N -2.07 0.52 -1.48 -0.78 -1.05 -1.26 -4.93 118.70 107.65 2ash s GLU 175 Ca 0.05 -0.97 0.00 0.00 -0.15 0.00 0.00 54.97 53.89 2ash s GLU 175 Cb -0.01 0.19 0.00 0.00 -0.44 0.00 0.00 34.13 33.87 2ash s GLU 175 CO 0.03 -0.10 0.00 0.09 0.95 0.00 0.00 175.26 176.23 2ash n ASN 176 N 0.63 -4.74 -3.93 0.83 3.02 -1.26 -4.99 115.26 104.81 2ash n ASN 176 Ca -0.18 0.20 -0.22 0.00 -0.03 0.00 0.00 54.58 54.35 2ash n ASN 176 Cb 0.59 -3.72 -0.17 0.00 -0.61 0.00 0.00 39.78 35.87 2ash n ASN 176 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2ash s GLN 177 N -3.97 1.18 0.51 3.52 -0.21 -1.26 -4.57 119.66 114.85 2ash s GLN 177 Ca 0.00 -0.21 -0.14 0.00 0.02 0.00 0.00 55.36 55.03 2ash s GLN 177 Cb 0.00 -1.10 -0.07 0.00 1.00 0.00 0.00 33.01 32.84 2ash s GLN 177 CO 0.00 -0.07 0.95 0.00 -2.12 0.00 0.00 175.29 174.04 2ash s ALA 178 N 0.95 3.14 -0.09 6.09 0.00 -0.06 -4.95 121.76 126.84 2ash s ALA 178 Ca -0.10 0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.89 2ash s ALA 178 Cb -0.15 -3.01 0.02 0.00 0.00 0.00 0.00 23.12 19.99 2ash s ALA 178 CO 0.00 -0.29 -0.09 -1.17 0.00 0.00 0.00 175.76 174.22 2ash s LEU 179 N -4.28 1.33 -0.13 0.00 2.96 -1.26 -0.56 118.68 116.74 2ash s LEU 179 Ca 0.56 -0.29 -0.04 0.00 -0.22 0.00 0.00 54.13 54.14 2ash s LEU 179 Cb -0.10 -0.81 -0.04 0.00 0.50 0.00 0.00 46.19 45.74 2ash s LEU 179 CO 0.36 -0.07 0.03 -0.36 -1.32 0.00 0.00 176.35 175.00 2ash s PHE 180 N 1.35 3.23 0.60 5.38 0.40 -0.06 -1.07 117.98 127.80 2ash s PHE 180 Ca -0.02 0.14 -0.08 0.00 -0.60 0.00 0.00 56.93 56.38 2ash s PHE 180 Cb -0.14 -1.91 -0.01 0.00 0.51 0.00 0.00 43.02 41.47 2ash s PHE 180 CO -0.04 0.35 0.94 0.20 0.70 0.00 0.00 175.22 177.37 2ash s GLY 181 N -0.39 1.60 -0.19 4.36 0.00 -0.73 -1.64 107.32 110.32 2ash s GLY 181 Ca 0.08 -0.50 -0.01 0.00 0.00 0.00 0.00 44.72 44.30 2ash s GLY 181 CO 0.02 -0.23 -0.04 -0.42 0.00 0.00 0.00 173.10 172.44 2ash s ILE 182 N -3.04 1.10 0.13 0.90 1.01 -1.26 -0.52 121.20 119.52 2ash s ILE 182 Ca 0.54 -0.75 -0.30 0.00 0.00 0.00 0.00 60.65 60.14 2ash s ILE 182 Cb -0.11 -1.36 -0.07 0.00 0.01 0.00 0.00 42.46 40.94 2ash s ILE 182 CO 0.48 0.02 1.05 -0.69 0.00 0.00 0.00 174.94 175.80 2ash s VAL 183 N 1.62 4.16 0.00 2.92 1.01 0.52 -4.85 120.40 125.77 2ash s VAL 183 Ca -0.01 1.78 0.00 0.00 0.00 0.00 0.00 61.98 63.75 2ash s VAL 183 Cb -0.16 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.08 2ash s VAL 183 CO -0.07 0.27 0.00 0.00 0.00 0.00 0.00 175.10 175.30 2ash n GLN 184 N 2.74 3.48 0.00 2.72 1.13 -1.26 -0.97 117.38 125.21 2ash n GLN 184 Ca 0.03 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.09 2ash n GLN 184 Cb 0.47 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.82 2ash n GLN 184 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ash n GLY 185 N 4.39 1.11 7.00 1.08 0.00 -1.26 -4.18 105.19 113.32 2ash n GLY 185 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ash n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ash n GLY 186 N 0.00 2.98 1.73 -0.02 0.00 -1.26 -1.95 105.19 106.67 2ash n GLY 186 Ca 0.00 -0.34 0.01 0.00 0.00 0.00 0.00 46.02 45.69 2ash n GLY 186 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2ash n ILE 187 N 0.00 2.40 -3.72 -0.61 -5.35 -1.26 -4.91 119.36 105.92 2ash n ILE 187 Ca 0.00 -1.24 -0.38 0.00 -0.27 0.00 0.00 62.75 60.86 2ash n ILE 187 Cb 0.00 -0.36 -0.11 0.00 -1.74 0.00 0.00 39.64 37.42 2ash n ILE 187 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2ash s TYR 188 N -2.52 3.35 0.28 4.28 2.02 -0.82 -4.99 117.35 118.94 2ash s TYR 188 Ca 0.46 -1.69 0.01 0.00 -0.37 0.00 0.00 57.07 55.48 2ash s TYR 188 Cb 0.36 -2.68 0.57 0.00 -0.40 0.00 0.00 41.96 39.80 2ash s TYR 188 CO 0.13 -0.83 1.80 -1.35 -1.57 0.00 0.00 175.55 173.73 2ash h PRO 189 N 8.24 0.79 -0.69 -1.71 0.11 -1.91 -0.73 132.00 136.10 2ash h PRO 189 Ca -0.21 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.78 2ash h PRO 189 Cb 1.07 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.98 2ash h PRO 189 CO 0.67 0.52 0.14 0.38 -0.21 0.00 0.00 178.00 179.50 2ash h ASP 190 N 0.81 1.06 -0.24 -2.05 2.03 -1.94 -0.43 116.42 115.67 2ash h ASP 190 Ca 0.49 -0.24 -0.12 0.00 -0.73 0.00 0.00 57.03 56.44 2ash h ASP 190 Cb 0.61 -0.28 -0.01 0.00 -0.83 0.00 0.00 39.33 38.82 2ash h ASP 190 CO -0.32 1.04 -0.26 -0.07 -1.03 0.00 0.00 179.24 178.60 2ash h LEU 191 N 1.05 0.75 -0.31 0.15 3.38 -1.48 -1.35 115.31 117.50 2ash h LEU 191 Ca 0.21 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 2ash h LEU 191 Cb 0.40 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2ash h LEU 191 CO 0.01 0.98 0.09 0.03 0.09 0.00 0.00 178.44 179.63 2ash h ARG 192 N 0.63 0.48 -0.35 1.13 2.47 -0.85 -0.74 114.38 117.16 2ash h ARG 192 Ca 0.08 -0.11 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 2ash h ARG 192 Cb 0.77 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 29.00 2ash h ARG 192 CO 0.06 0.54 0.23 -0.09 0.56 0.00 0.00 179.97 181.27 2ash h ARG 193 N 0.34 0.45 -0.55 0.04 2.43 -1.00 -1.50 114.38 114.59 2ash h ARG 193 Ca 0.10 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.15 2ash h ARG 193 Cb 0.26 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.69 2ash h ARG 193 CO -0.00 0.30 -0.02 0.93 -1.51 0.00 0.00 179.97 179.67 2ash h GLU 194 N 0.47 0.97 -0.51 0.20 3.07 -1.08 -1.11 114.58 116.59 2ash h GLU 194 Ca 0.13 -0.30 -0.02 0.00 -0.50 0.00 0.00 59.36 58.66 2ash h GLU 194 Cb -0.05 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.74 2ash h GLU 194 CO -0.03 0.97 0.24 1.03 -1.40 0.00 0.00 179.01 179.81 2ash h SER 195 N 0.89 0.67 -0.40 1.42 0.87 -1.02 -0.17 113.55 115.81 2ash h SER 195 Ca 0.16 -0.14 -0.04 0.00 -1.23 0.00 0.00 61.79 60.55 2ash h SER 195 Cb 0.55 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 2ash h SER 195 CO 0.03 0.62 0.11 0.00 -0.53 0.00 0.00 176.83 177.06 2ash h ALA 196 N 1.08 0.52 -0.74 6.23 0.00 -0.98 -1.52 119.26 123.85 2ash h ALA 196 Ca 0.17 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2ash h ALA 196 Cb 0.13 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2ash h ALA 196 CO -0.02 0.19 0.41 -0.07 0.00 0.00 0.00 179.25 179.76 2ash h LEU 197 N 0.50 0.92 -0.44 0.00 3.38 -1.09 -1.24 115.31 117.34 2ash h LEU 197 Ca 0.13 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 2ash h LEU 197 Cb 0.29 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2ash h LEU 197 CO -0.00 0.75 0.13 1.56 0.09 0.00 0.00 178.44 180.97 2ash h GLN 198 N 1.02 0.69 -0.24 1.13 4.20 -0.85 -1.81 115.11 119.26 2ash h GLN 198 Ca 0.26 -0.15 -0.19 0.00 0.06 0.00 0.00 58.65 58.63 2ash h GLN 198 Cb 0.03 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.71 2ash h GLN 198 CO -0.04 0.68 -0.59 -0.07 -0.67 0.00 0.00 178.83 178.13 2ash h LEU 199 N 0.58 0.93 -1.46 1.46 3.38 -1.14 -2.66 115.31 116.40 2ash h LEU 199 Ca 0.14 -0.57 -0.05 0.00 0.09 0.00 0.00 57.88 57.50 2ash h LEU 199 Cb 0.28 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2ash h LEU 199 CO -0.00 1.33 -0.24 0.71 0.09 0.00 0.00 178.44 180.32 2ash h THR 200 N 0.57 0.81 -0.22 0.22 1.35 -1.26 -1.60 112.91 112.78 2ash h THR 200 Ca -0.01 -0.97 -0.10 0.00 -0.55 0.00 0.00 66.41 64.78 2ash h THR 200 Cb 1.21 1.59 -0.01 0.00 -1.73 0.00 0.00 68.15 69.20 2ash h THR 200 CO 0.13 0.24 -0.31 0.77 -0.25 0.00 0.00 175.52 176.10 2ash h SER 201 N 0.00 0.45 0.09 5.36 4.64 -1.21 -3.06 113.55 119.83 2ash h SER 201 Ca -0.00 -0.17 -0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2ash h SER 201 Cb 0.57 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 2ash h SER 201 CO 0.03 0.74 -0.04 0.40 -0.87 0.00 0.00 176.83 177.09 2ash h ILE 202 N 0.38 1.09 -0.59 0.95 2.04 -1.07 -3.50 117.51 116.80 2ash h ILE 202 Ca 0.05 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 65.24 2ash h ILE 202 Cb 0.74 1.52 0.00 0.00 -0.74 0.00 0.00 36.82 38.33 2ash h ILE 202 CO 0.06 0.16 0.00 0.61 0.00 0.00 0.00 178.15 178.98 2ash n GLY 203 N -0.30 -0.27 3.52 5.37 0.00 -0.65 -5.13 105.19 107.73 2ash n GLY 203 Ca -0.08 -0.87 -0.25 0.00 0.00 0.00 0.00 46.02 44.82 2ash n GLY 203 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ash s PHE 204 N 0.00 1.96 -0.95 1.61 0.08 -1.26 -5.04 117.98 114.38 2ash s PHE 204 Ca 0.00 -1.02 0.28 0.00 0.12 0.00 0.00 56.93 56.31 2ash s PHE 204 Cb 0.00 -1.34 1.15 0.00 -0.57 0.00 0.00 43.02 42.26 2ash s PHE 204 CO 0.00 -0.01 1.89 -0.25 -0.10 0.00 0.00 175.22 176.76 2ash n ASP 205 N -0.96 0.16 -3.62 1.36 8.00 -0.24 -4.92 116.55 116.33 2ash n ASP 205 Ca -0.06 0.50 0.01 0.00 0.71 0.00 0.00 54.79 55.95 2ash n ASP 205 Cb 0.66 -0.54 -0.01 0.00 -0.02 0.00 0.00 41.12 41.22 2ash n ASP 205 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2ash s GLY 206 N -3.11 -0.40 -0.05 0.44 0.00 -1.25 -4.38 107.32 98.57 2ash s GLY 206 Ca 0.13 0.79 -0.01 0.00 0.00 0.00 0.00 44.72 45.64 2ash s GLY 206 CO 0.55 0.17 0.01 -0.19 0.00 0.00 0.00 173.10 173.63 2ash s TYR 207 N -2.45 0.45 0.06 1.90 1.51 -0.61 -1.78 117.35 116.43 2ash s TYR 207 Ca 0.13 -0.04 -0.01 0.00 -1.01 0.00 0.00 57.07 56.15 2ash s TYR 207 Cb 0.04 -0.61 -0.04 0.00 -0.11 0.00 0.00 41.96 41.24 2ash s TYR 207 CO -0.04 -0.23 0.23 0.00 -1.11 0.00 0.00 175.55 174.40 2ash s ALA 208 N 1.64 3.97 -0.39 3.71 0.00 0.32 -0.72 121.76 130.30 2ash s ALA 208 Ca -0.01 -0.79 -0.10 0.00 0.00 0.00 0.00 51.96 51.07 2ash s ALA 208 Cb -0.13 -1.88 0.05 0.00 0.00 0.00 0.00 23.12 21.16 2ash s ALA 208 CO -0.03 0.79 0.22 0.42 0.00 0.00 0.00 175.76 177.16 2ash s ILE 209 N -1.49 4.33 0.43 0.00 1.01 0.15 -0.36 121.20 125.27 2ash s ILE 209 Ca 0.34 -1.14 0.08 0.00 0.00 0.00 0.00 60.65 59.93 2ash s ILE 209 Cb -0.13 -3.53 -0.00 0.00 0.01 0.00 0.00 42.46 38.81 2ash s ILE 209 CO 0.26 -0.35 0.46 -0.83 0.00 0.00 0.00 174.94 174.47 2ash s GLY 210 N 1.80 2.07 -1.06 6.18 0.00 -0.14 -2.45 107.32 113.72 2ash s GLY 210 Ca 0.02 -1.81 0.00 0.00 0.00 0.00 0.00 44.72 42.93 2ash s GLY 210 CO 0.04 -1.65 0.00 0.61 0.00 0.00 0.00 173.10 172.10 2ash n GLY 211 N -1.69 1.12 3.43 0.20 0.00 -1.26 -4.66 105.19 102.33 2ash n GLY 211 Ca 0.05 -0.57 -0.21 0.00 0.00 0.00 0.00 46.02 45.29 2ash n GLY 211 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ash s LEU 212 N -2.30 2.41 -1.46 0.99 1.43 -1.26 -4.69 118.68 113.81 2ash s LEU 212 Ca 0.00 -1.24 -0.09 0.00 -1.03 0.00 0.00 54.13 51.77 2ash s LEU 212 Cb 0.00 -0.56 0.04 0.00 0.03 0.00 0.00 46.19 45.69 2ash s LEU 212 CO 0.00 -0.42 0.83 -0.24 0.23 0.00 0.00 176.35 176.75 2ash n SER 213 N -0.61 -5.50 -0.21 2.29 2.88 -1.26 -4.87 113.62 106.33 2ash n SER 213 Ca -0.05 -0.49 0.08 0.00 -1.33 0.00 0.00 58.87 57.08 2ash n SER 213 Cb 0.64 -4.41 0.12 0.00 -0.75 0.00 0.00 64.21 59.81 2ash n SER 213 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 2ash n ILE 214 N -4.60 1.54 0.00 2.46 -5.35 -1.26 -4.76 119.36 107.39 2ash n ILE 214 Ca -0.03 -1.91 0.00 0.00 -0.27 0.00 0.00 62.75 60.54 2ash n ILE 214 Cb 0.57 -0.08 0.00 0.00 -1.74 0.00 0.00 39.64 38.38 2ash n ILE 214 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ash n GLY 215 N -1.12 0.82 3.76 3.28 0.00 -1.26 -5.12 105.19 105.54 2ash n GLY 215 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 2ash n GLY 215 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2ash s GLU 216 N 0.00 1.79 0.48 1.61 1.03 -1.26 -4.98 118.70 117.37 2ash s GLU 216 Ca 0.00 0.85 -0.24 0.00 0.03 0.00 0.00 54.97 55.61 2ash s GLU 216 Cb 0.00 -1.87 -0.07 0.00 -0.80 0.00 0.00 34.13 31.39 2ash s GLU 216 CO 0.00 -1.88 1.42 -1.83 -1.33 0.00 0.00 175.26 171.64 2ash s GLU 217 N -4.99 3.51 0.35 -4.83 4.04 -1.26 -4.81 118.70 110.70 2ash s GLU 217 Ca 0.62 2.40 0.09 0.00 0.04 0.00 0.00 54.97 58.11 2ash s GLU 217 Cb -0.17 -2.54 0.81 0.00 0.02 0.00 0.00 34.13 32.26 2ash s GLU 217 CO 0.56 -0.95 1.85 -0.09 -1.84 0.00 0.00 175.26 174.79 2ash h ARG 218 N 2.06 0.68 0.00 -4.83 9.65 -2.00 -0.27 114.38 119.67 2ash h ARG 218 Ca -0.51 -0.04 -0.05 0.00 -1.10 0.00 0.00 59.98 58.28 2ash h ARG 218 Cb 1.28 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 29.70 2ash h ARG 218 CO 0.60 0.45 -0.23 0.66 2.80 0.00 0.00 179.97 184.25 2ash h SER 219 N 0.70 0.00 0.56 -3.80 4.64 -2.00 -2.23 113.55 111.42 2ash h SER 219 Ca 0.47 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.51 2ash h SER 219 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2ash h SER 219 CO -0.23 0.23 -1.34 -0.07 -0.87 0.00 0.00 176.83 174.55 2ash h LEU 220 N 0.00 0.44 -0.72 5.97 3.38 -1.43 -2.26 115.31 120.70 2ash h LEU 220 Ca -0.00 -0.51 0.15 0.00 0.09 0.00 0.00 57.88 57.61 2ash h LEU 220 Cb 0.44 -0.14 -0.11 0.00 0.09 0.00 0.00 40.66 40.94 2ash h LEU 220 CO 0.03 1.40 0.17 0.74 0.09 0.00 0.00 178.44 180.87 2ash h THR 221 N 0.08 0.53 0.04 0.22 2.02 -0.94 0.02 112.91 114.87 2ash h THR 221 Ca -0.17 -0.09 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 2ash h THR 221 Cb 2.00 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.65 2ash h THR 221 CO 0.20 0.05 -0.02 -0.07 0.37 0.00 0.00 175.52 176.05 2ash h LEU 222 N 0.27 -0.04 -0.83 2.58 3.38 -1.47 -2.35 115.31 116.84 2ash h LEU 222 Ca 0.40 -0.56 0.08 0.00 0.09 0.00 0.00 57.88 57.89 2ash h LEU 222 Cb 0.67 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.36 2ash h LEU 222 CO -0.49 0.56 0.49 -0.08 0.09 0.00 0.00 178.44 179.01 2ash h GLU 223 N -0.68 0.82 -0.17 1.13 4.81 -1.35 -1.85 114.58 117.28 2ash h GLU 223 Ca -0.01 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.06 2ash h GLU 223 Cb 0.60 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2ash h GLU 223 CO 0.01 0.54 -0.38 0.52 -0.73 0.00 0.00 179.01 178.97 2ash h MET 224 N 0.84 0.38 -0.29 1.92 2.86 -1.02 -1.83 114.93 117.79 2ash h MET 224 Ca 0.39 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.84 2ash h MET 224 Cb 0.30 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2ash h MET 224 CO -0.22 0.71 0.16 1.15 1.06 0.00 0.00 176.91 179.77 2ash h THR 225 N 0.32 1.13 -0.44 2.22 2.02 -1.00 -1.06 112.91 116.10 2ash h THR 225 Ca 0.03 -0.33 0.06 0.00 0.77 0.00 0.00 66.41 66.94 2ash h THR 225 Cb 0.82 0.81 -0.05 0.00 -1.74 0.00 0.00 68.15 67.99 2ash h THR 225 CO 0.07 0.13 0.15 -0.33 0.37 0.00 0.00 175.52 175.90 2ash h GLU 226 N 0.36 0.30 -0.06 6.66 5.08 -1.09 -0.27 114.58 125.57 2ash h GLU 226 Ca 0.10 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2ash h GLU 226 Cb 0.06 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2ash h GLU 226 CO -0.02 0.20 0.04 0.28 -1.00 0.00 0.00 179.01 178.51 2ash h VAL 227 N 0.31 1.04 -0.39 3.13 2.07 -1.10 -2.30 116.25 119.01 2ash h VAL 227 Ca 0.21 -0.11 0.03 0.00 0.82 0.00 0.00 66.70 67.64 2ash h VAL 227 Cb 0.21 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 2ash h VAL 227 CO -0.22 0.04 0.21 0.74 0.02 0.00 0.00 177.57 178.36 2ash h THR 228 N 0.05 1.00 -0.16 2.57 2.02 -1.08 -3.15 112.91 114.16 2ash h THR 228 Ca 0.02 -0.15 -0.08 0.00 0.77 0.00 0.00 66.41 66.97 2ash h THR 228 Cb 0.03 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 2ash h THR 228 CO -0.00 0.08 -0.27 0.58 0.37 0.00 0.00 175.52 176.28 2ash h VAL 229 N 0.42 1.25 -0.84 3.16 2.07 -0.91 -1.64 116.25 119.77 2ash h VAL 229 Ca 0.16 -1.20 0.18 0.00 0.82 0.00 0.00 66.70 66.67 2ash h VAL 229 Cb 0.05 1.43 -0.06 0.00 -1.52 0.00 0.00 31.29 31.19 2ash h VAL 229 CO -0.10 0.37 0.56 -0.08 0.02 0.00 0.00 177.57 178.33 2ash h GLU 230 N 0.27 0.36 -0.56 1.57 4.81 -1.37 -2.11 114.58 117.55 2ash h GLU 230 Ca 0.04 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2ash h GLU 230 Cb 0.62 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.92 2ash h GLU 230 CO 0.04 0.24 0.00 1.19 -0.73 0.00 0.00 179.01 179.75 2ash n PHE 231 N -4.48 0.86 -4.45 0.92 3.72 -0.63 -4.96 117.46 108.44 2ash n PHE 231 Ca 0.17 -0.53 -0.34 0.00 -0.05 0.00 0.00 57.45 56.70 2ash n PHE 231 Cb 0.65 -0.06 -0.10 0.00 -0.94 0.00 0.00 39.48 39.03 2ash n PHE 231 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2ash s LEU 232 N -1.19 3.40 0.32 4.37 1.43 -0.79 -4.63 118.68 121.59 2ash s LEU 232 Ca 0.40 0.04 -0.29 0.00 -1.03 0.00 0.00 54.13 53.24 2ash s LEU 232 Cb 0.22 -1.81 -0.11 0.00 0.03 0.00 0.00 46.19 44.52 2ash s LEU 232 CO 0.25 0.35 1.50 -2.84 0.23 0.00 0.00 176.35 175.83 2ash s PRO 233 N -1.03 4.16 0.51 1.29 0.02 -1.26 -4.91 135.00 133.79 2ash s PRO 233 Ca 0.14 2.50 0.32 0.00 0.02 0.00 0.00 61.00 63.98 2ash s PRO 233 Cb -0.11 -3.02 1.25 0.00 0.02 0.00 0.00 34.50 32.64 2ash s PRO 233 CO 0.04 -0.52 1.93 0.93 -0.33 0.00 0.00 177.00 179.05 2ash h GLU 234 N 4.00 0.00 -0.45 5.54 5.08 -1.98 -3.13 114.58 123.64 2ash h GLU 234 Ca -0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2ash h GLU 234 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2ash h GLU 234 CO 0.72 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.33 2ash n ASP 235 N -3.00 2.47 -4.20 1.42 5.75 -1.26 -4.85 116.55 112.88 2ash n ASP 235 Ca 0.01 -1.99 -0.19 0.00 -0.01 0.00 0.00 54.79 52.61 2ash n ASP 235 Cb 0.32 -0.30 -0.12 0.00 -1.03 0.00 0.00 41.12 39.98 2ash n ASP 235 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2ash s LYS 236 N -1.39 0.89 0.41 0.11 1.02 -1.19 -4.72 119.74 114.87 2ash s LYS 236 Ca 0.31 -1.01 -0.26 0.00 0.02 0.00 0.00 55.97 55.03 2ash s LYS 236 Cb 0.16 -0.94 -0.09 0.00 -0.52 0.00 0.00 37.83 36.44 2ash s LYS 236 CO 0.21 0.21 1.39 -2.14 -0.92 0.00 0.00 175.35 174.10 2ash s PRO 237 N -1.82 3.92 -0.20 -1.68 0.02 -1.26 -4.84 135.00 129.13 2ash s PRO 237 Ca 0.00 2.34 -0.06 0.00 0.02 0.00 0.00 61.00 63.30 2ash s PRO 237 Cb -0.10 -2.79 -0.03 0.00 0.02 0.00 0.00 34.50 31.61 2ash s PRO 237 CO 0.03 -0.60 0.03 1.03 -0.33 0.00 0.00 177.00 177.16 2ash s ARG 238 N -2.25 3.72 -0.22 5.54 3.00 -1.26 -1.58 118.95 125.89 2ash s ARG 238 Ca 0.57 -0.47 0.02 0.00 0.00 0.00 0.00 55.73 55.85 2ash s ARG 238 Cb -0.42 -3.16 0.05 0.00 0.00 0.00 0.00 34.95 31.42 2ash s ARG 238 CO 0.55 0.04 -0.12 -0.47 0.00 0.00 0.00 175.30 175.30 2ash s TYR 239 N 0.96 2.81 -0.35 -0.53 5.04 0.11 -0.75 117.35 124.63 2ash s TYR 239 Ca 0.02 -1.91 -0.24 0.00 -2.44 0.00 0.00 57.07 52.50 2ash s TYR 239 Cb -0.14 -1.79 0.01 0.00 0.35 0.00 0.00 41.96 40.39 2ash s TYR 239 CO 0.02 -0.81 0.84 0.12 -1.34 0.00 0.00 175.55 174.38 2ash s PHE 240 N 1.26 3.12 -0.19 4.97 2.19 -0.61 0.29 117.98 129.02 2ash s PHE 240 Ca -0.04 0.69 -0.29 0.00 0.33 0.00 0.00 56.93 57.62 2ash s PHE 240 Cb -0.17 -3.46 -0.00 0.00 -1.31 0.00 0.00 43.02 38.08 2ash s PHE 240 CO -0.07 -0.74 1.08 -1.64 1.83 0.00 0.00 175.22 175.68 2ash s MET 241 N 3.21 4.29 0.45 10.12 -1.94 -1.02 -4.15 119.30 130.26 2ash s MET 241 Ca 0.34 1.44 0.00 0.00 -1.71 0.00 0.00 55.69 55.76 2ash s MET 241 Cb -0.13 -3.64 0.00 0.00 2.01 0.00 0.00 34.83 33.07 2ash s MET 241 CO 0.17 -0.58 0.00 0.41 -0.01 0.00 0.00 175.02 175.01 2ash n GLY 242 N 3.34 -2.10 2.51 -0.03 0.00 -1.25 -4.77 105.19 102.89 2ash n GLY 242 Ca 0.12 -1.43 -0.20 0.00 0.00 0.00 0.00 46.02 44.50 2ash n GLY 242 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ash n GLY 243 N -1.01 1.05 2.21 -0.02 0.00 -1.24 -4.58 105.19 101.61 2ash n GLY 243 Ca 0.00 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 2ash n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ash n GLY 244 N -0.69 3.85 3.79 -0.02 0.00 -1.07 -4.74 105.19 106.32 2ash n GLY 244 Ca -0.22 -1.45 -0.34 0.00 0.00 0.00 0.00 46.02 44.02 2ash n GLY 244 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ash s SER 245 N 1.89 5.73 0.18 1.61 1.04 -1.26 -4.72 113.70 118.17 2ash s SER 245 Ca 0.67 1.97 -0.13 0.00 0.48 0.00 0.00 55.95 58.93 2ash s SER 245 Cb 0.24 -2.55 0.14 0.00 0.10 0.00 0.00 66.02 63.95 2ash s SER 245 CO -0.05 -1.20 1.76 -0.65 0.98 0.00 0.00 173.24 174.08 2ash h PRO 246 N 0.76 0.38 -0.28 4.02 0.11 -1.95 -0.45 132.00 134.61 2ash h PRO 246 Ca -0.48 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.45 2ash h PRO 246 Cb 1.24 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2ash h PRO 246 CO 0.57 0.25 -0.45 1.05 -0.21 0.00 0.00 178.00 179.22 2ash h GLU 247 N 0.40 0.71 -0.34 1.05 9.09 -1.85 -2.20 114.58 121.43 2ash h GLU 247 Ca 0.22 -0.39 -0.07 0.00 0.05 0.00 0.00 59.36 59.17 2ash h GLU 247 Cb 0.18 0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 27.30 2ash h GLU 247 CO -0.19 1.01 -0.04 1.25 0.05 0.00 0.00 179.01 181.08 2ash h LEU 248 N 0.57 0.62 -0.40 3.06 5.85 -1.78 -1.80 115.31 121.43 2ash h LEU 248 Ca 0.04 -0.34 0.08 0.00 0.84 0.00 0.00 57.88 58.50 2ash h LEU 248 Cb 1.00 -0.17 -0.08 0.00 0.37 0.00 0.00 40.66 41.77 2ash h LEU 248 CO 0.09 0.81 -0.17 0.40 -0.34 0.00 0.00 178.44 179.24 2ash h ILE 249 N 0.42 0.46 -0.70 4.05 2.04 -1.01 0.62 117.51 123.40 2ash h ILE 249 Ca 0.09 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.95 2ash h ILE 249 Cb 0.52 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 2ash h ILE 249 CO 0.03 0.00 0.43 -0.07 0.00 0.00 0.00 178.15 178.53 2ash h LEU 250 N -0.10 0.83 -1.25 1.44 4.07 -1.23 0.95 115.31 120.03 2ash h LEU 250 Ca 0.20 -0.06 -0.01 0.00 0.08 0.00 0.00 57.88 58.09 2ash h LEU 250 Cb 0.40 -0.21 -0.03 0.00 1.08 0.00 0.00 40.66 41.90 2ash h LEU 250 CO -0.46 0.64 0.33 -0.33 -1.08 0.00 0.00 178.44 177.54 2ash h GLU 251 N 0.95 0.84 0.08 1.13 4.39 -0.88 -2.43 114.58 118.66 2ash h GLU 251 Ca 0.25 -0.09 -0.25 0.00 0.34 0.00 0.00 59.36 59.61 2ash h GLU 251 Cb -0.04 -0.17 0.01 0.00 -0.10 0.00 0.00 28.75 28.45 2ash h GLU 251 CO -0.05 0.62 -1.11 -0.07 -1.16 0.00 0.00 179.01 177.24 2ash h LEU 252 N 0.84 0.50 -1.01 1.33 3.38 -0.30 -3.04 115.31 117.02 2ash h LEU 252 Ca 0.22 -0.47 0.05 0.00 0.09 0.00 0.00 57.88 57.77 2ash h LEU 252 Cb 0.03 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.56 2ash h LEU 252 CO -0.03 1.31 0.66 0.58 0.09 0.00 0.00 178.44 181.04 2ash h VAL 253 N 0.15 1.13 0.00 1.22 2.07 -0.76 -1.60 116.25 118.46 2ash h VAL 253 Ca -0.12 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2ash h VAL 253 Cb 1.80 -0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 2ash h VAL 253 CO 0.19 0.22 0.00 -0.67 0.02 0.00 0.00 177.57 177.33 2ash n ASP 254 N -4.47 0.35 -0.62 0.57 2.03 -0.92 -1.45 116.55 112.03 2ash n ASP 254 Ca 0.15 0.59 0.06 0.00 0.52 0.00 0.00 54.79 56.11 2ash n ASP 254 Cb 0.14 -0.66 0.14 0.00 -0.72 0.00 0.00 41.12 40.02 2ash n ASP 254 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2ash n ARG 255 N -1.89 2.40 0.00 -0.67 1.74 -0.68 -4.23 116.66 113.33 2ash n ARG 255 Ca 0.02 -1.89 0.00 0.00 -0.77 0.00 0.00 57.85 55.21 2ash n ARG 255 Cb 0.18 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.36 2ash n ARG 255 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ash n GLY 256 N 0.58 1.10 3.83 -0.13 0.00 -0.53 -4.84 105.19 105.20 2ash n GLY 256 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 2ash n GLY 256 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ash s VAL 257 N -2.00 4.92 -0.13 1.61 1.01 -0.74 -4.73 120.40 120.33 2ash s VAL 257 Ca 0.00 0.93 0.09 0.00 0.00 0.00 0.00 61.98 63.00 2ash s VAL 257 Cb 0.00 -3.77 -0.15 0.00 0.00 0.00 0.00 36.38 32.47 2ash s VAL 257 CO 0.00 0.50 0.00 0.47 0.00 0.00 0.00 175.10 176.07 2ash n ASP 258 N 1.56 2.05 -4.12 3.32 8.00 0.07 -4.22 116.55 123.22 2ash n ASP 258 Ca -0.11 -0.02 -0.20 0.00 0.71 0.00 0.00 54.79 55.17 2ash n ASP 258 Cb 0.52 0.57 -0.14 0.00 -0.02 0.00 0.00 41.12 42.05 2ash n ASP 258 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2ash s MET 259 N -2.31 0.92 0.05 -1.24 -1.94 -0.49 -1.31 119.30 112.97 2ash s MET 259 Ca -0.10 -0.68 -0.07 0.00 -1.71 0.00 0.00 55.69 53.13 2ash s MET 259 Cb 0.04 -0.90 -0.01 0.00 2.01 0.00 0.00 34.83 35.97 2ash s MET 259 CO 0.49 0.23 0.14 -0.06 -0.01 0.00 0.00 175.02 175.81 2ash s PHE 260 N -0.75 0.18 0.04 -0.03 0.08 -0.58 -1.57 117.98 115.35 2ash s PHE 260 Ca 0.02 -0.52 -0.14 0.00 0.12 0.00 0.00 56.93 56.41 2ash s PHE 260 Cb -0.07 -0.11 0.02 0.00 -0.57 0.00 0.00 43.02 42.29 2ash s PHE 260 CO 0.01 -0.44 0.31 0.16 -0.10 0.00 0.00 175.22 175.16 2ash s ASP 261 N -2.40 -0.14 -0.21 1.36 1.47 -1.26 -0.57 116.67 114.91 2ash s ASP 261 Ca -0.01 -0.16 -0.28 0.00 1.18 0.00 0.00 52.55 53.28 2ash s ASP 261 Cb 0.02 0.36 0.13 0.00 -0.34 0.00 0.00 42.92 43.08 2ash s ASP 261 CO -0.07 -0.61 1.02 -0.55 0.68 0.00 0.00 175.17 175.64 2ash s SER 262 N -2.02 -0.40 0.00 2.11 0.15 -1.25 -2.60 113.70 109.70 2ash s SER 262 Ca -0.05 0.60 0.28 0.00 0.70 0.00 0.00 55.95 57.48 2ash s SER 262 Cb -0.01 0.55 1.29 0.00 -1.71 0.00 0.00 66.02 66.14 2ash s SER 262 CO -0.03 -0.26 1.93 1.33 1.20 0.00 0.00 173.24 177.42 2ash n VAL 263 N 1.38 0.07 -0.15 4.45 0.24 -1.26 -4.23 118.33 118.83 2ash n VAL 263 Ca -0.11 0.02 -0.07 0.00 -2.04 0.00 0.00 64.34 62.14 2ash n VAL 263 Cb 0.57 -0.54 -0.01 0.00 -1.47 0.00 0.00 33.84 32.39 2ash n VAL 263 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 2ash h PHE 264 N 0.00 -0.91 -0.87 6.34 3.57 -1.94 -0.06 116.94 123.08 2ash h PHE 264 Ca 0.00 0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 2ash h PHE 264 Cb 0.40 0.47 -0.04 0.00 2.79 0.00 0.00 35.95 39.57 2ash h PHE 264 CO 0.00 -0.38 0.52 -1.00 -2.23 0.00 0.00 178.31 175.22 2ash h PRO 265 N -0.21 1.18 0.00 6.41 0.13 -1.93 -1.18 132.00 136.40 2ash h PRO 265 Ca 0.20 -0.11 -0.00 0.00 -0.87 0.00 0.00 66.00 65.22 2ash h PRO 265 Cb 0.54 -0.25 0.00 0.00 0.13 0.00 0.00 31.00 31.42 2ash h PRO 265 CO -0.59 0.83 -0.00 1.79 -0.23 0.00 0.00 178.00 179.79 2ash h THR 266 N 1.20 1.67 -0.60 1.56 1.35 -1.76 -2.90 112.91 113.42 2ash h THR 266 Ca 0.31 -2.00 0.09 0.00 -0.55 0.00 0.00 66.41 64.26 2ash h THR 266 Cb -0.04 3.02 -0.07 0.00 -1.73 0.00 0.00 68.15 69.33 2ash h THR 266 CO -0.06 0.52 0.23 -0.09 -0.25 0.00 0.00 175.52 175.87 2ash h ARG 267 N -0.86 0.41 0.00 4.72 2.43 -1.00 -2.61 114.38 117.47 2ash h ARG 267 Ca -0.00 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.04 2ash h ARG 267 Cb 0.85 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.29 2ash h ARG 267 CO 0.00 0.27 -0.49 -0.84 -1.51 0.00 0.00 179.97 177.40 2ash h ILE 268 N 0.42 0.99 -0.76 1.20 3.07 -1.31 -2.64 117.51 118.48 2ash h ILE 268 Ca 0.30 -1.97 0.05 0.00 1.55 0.00 0.00 64.86 64.80 2ash h ILE 268 Cb 0.36 2.19 -0.05 0.00 -0.27 0.00 0.00 36.82 39.05 2ash h ILE 268 CO -0.29 0.48 0.46 0.00 -1.05 0.00 0.00 178.15 177.75 2ash h ALA 269 N 1.51 1.02 0.00 0.16 0.00 -1.26 -1.41 119.26 119.29 2ash h ALA 269 Ca -0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2ash h ALA 269 Cb 1.15 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2ash h ALA 269 CO 0.06 0.20 -0.26 0.00 0.00 0.00 0.00 179.25 179.26 2ash h ARG 270 N 0.87 0.00 -0.01 0.00 3.08 -1.12 -2.06 114.38 115.14 2ash h ARG 270 Ca 0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.38 2ash h ARG 270 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 2ash h ARG 270 CO -0.15 0.26 -0.01 0.72 -1.07 0.00 0.00 179.97 179.72 2ash n HIS 271 N -3.88 0.00 0.00 3.04 8.25 -0.75 -4.89 115.22 116.99 2ash n HIS 271 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2ash n HIS 271 Cb 0.34 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.44 2ash n HIS 271 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ash n GLY 272 N 1.09 1.09 3.40 -1.41 0.00 -0.77 -4.91 105.19 103.68 2ash n GLY 272 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 2ash n GLY 272 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ash s THR 273 N -2.00 3.46 0.04 2.61 2.01 -0.60 -0.52 115.64 120.64 2ash s THR 273 Ca 0.00 -0.50 -0.13 0.00 0.31 0.00 0.00 61.69 61.37 2ash s THR 273 Cb 0.00 -2.51 -0.06 0.00 0.01 0.00 0.00 72.50 69.94 2ash s THR 273 CO 0.00 0.48 0.42 0.00 -0.69 0.00 0.00 174.62 174.84 2ash s ALA 274 N 0.66 3.69 -0.33 7.40 0.00 0.12 -3.28 121.76 130.02 2ash s ALA 274 Ca -0.04 -0.25 -0.16 0.00 0.00 0.00 0.00 51.96 51.50 2ash s ALA 274 Cb -0.15 -2.37 -0.01 0.00 0.00 0.00 0.00 23.12 20.59 2ash s ALA 274 CO 0.02 0.50 0.43 -0.51 0.00 0.00 0.00 175.76 176.21 2ash s LEU 275 N -1.41 4.31 0.43 0.00 1.43 -1.26 -0.86 118.68 121.32 2ash s LEU 275 Ca 0.28 -0.02 0.05 0.00 -1.03 0.00 0.00 54.13 53.40 2ash s LEU 275 Cb -0.16 -2.46 -0.06 0.00 0.03 0.00 0.00 46.19 43.54 2ash s LEU 275 CO 0.15 -0.36 0.02 0.42 0.23 0.00 0.00 176.35 176.81 2ash s THR 276 N 2.18 1.56 -1.46 5.49 -4.23 -0.78 -4.76 115.64 113.65 2ash s THR 276 Ca 0.15 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 58.86 2ash s THR 276 Cb -0.16 -2.70 0.35 0.00 1.34 0.00 0.00 72.50 71.33 2ash s THR 276 CO 0.12 0.00 1.59 0.79 -0.54 0.00 0.00 174.62 176.58 2ash n TRP 277 N -1.01 0.00 -1.00 3.99 7.02 -1.26 -2.00 117.44 123.18 2ash n TRP 277 Ca -0.09 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.47 2ash n TRP 277 Cb 0.67 -0.27 0.29 0.00 -2.42 0.00 0.00 31.31 29.58 2ash n TRP 277 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 2ash n ASN 278 N -1.27 4.27 0.00 -0.99 3.02 -1.26 -4.99 115.26 114.04 2ash n ASN 278 Ca 0.09 -3.04 0.00 0.00 -0.03 0.00 0.00 54.58 51.60 2ash n ASN 278 Cb 0.15 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 38.73 2ash n ASN 278 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ash n GLY 279 N -0.29 -2.20 3.77 7.41 0.00 -0.85 -4.92 105.19 108.12 2ash n GLY 279 Ca 0.24 -1.86 -0.41 0.00 0.00 0.00 0.00 46.02 43.99 2ash n GLY 279 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ash s LYS 280 N -0.20 4.07 -0.13 1.61 1.02 -1.26 -1.86 119.74 122.99 2ash s LYS 280 Ca 0.00 2.46 0.00 0.00 0.02 0.00 0.00 55.97 58.45 2ash s LYS 280 Cb 0.00 -2.92 0.02 0.00 -0.52 0.00 0.00 37.83 34.41 2ash s LYS 280 CO 0.00 -0.52 -0.12 -1.17 -0.92 0.00 0.00 175.35 172.62 2ash s LEU 281 N -2.17 1.52 -0.51 3.17 2.96 -0.04 -4.93 118.68 118.68 2ash s LEU 281 Ca 0.54 -0.42 -0.25 0.00 -0.22 0.00 0.00 54.13 53.79 2ash s LEU 281 Cb -0.44 -1.05 0.03 0.00 0.50 0.00 0.00 46.19 45.23 2ash s LEU 281 CO 0.59 -0.07 0.93 0.21 -1.32 0.00 0.00 176.35 176.70 2ash s ASN 282 N 1.48 6.40 0.49 3.68 2.47 -1.26 -0.71 114.94 127.49 2ash s ASN 282 Ca 0.03 -0.16 0.31 0.00 0.42 0.00 0.00 52.86 53.46 2ash s ASN 282 Cb -0.13 -2.44 1.19 0.00 -1.45 0.00 0.00 41.25 38.42 2ash s ASN 282 CO -0.09 -1.15 1.90 -0.07 -3.72 0.00 0.00 177.10 173.98 2ash h LEU 283 N 10.78 0.00 -0.35 3.21 -0.00 -1.18 -2.61 115.31 125.16 2ash h LEU 283 Ca -0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.63 2ash h LEU 283 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.73 2ash h LEU 283 CO 1.06 0.00 0.00 0.29 -0.00 0.00 0.00 178.44 179.79 2ash n LYS 284 N -2.94 0.23 -2.05 1.13 5.02 -1.26 -4.27 118.16 114.02 2ash n LYS 284 Ca 0.01 0.32 -0.41 0.00 -2.02 0.00 0.00 58.31 56.21 2ash n LYS 284 Cb 0.32 -1.84 -0.02 0.00 -0.02 0.00 0.00 35.03 33.47 2ash n LYS 284 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ash s ALA 285 N -3.21 3.59 0.46 7.82 0.00 -0.99 -4.89 121.76 124.54 2ash s ALA 285 Ca 0.07 1.29 0.38 0.00 0.00 0.00 0.00 51.96 53.71 2ash s ALA 285 Cb 0.11 -3.53 1.93 0.00 0.00 0.00 0.00 23.12 21.63 2ash s ALA 285 CO 0.50 -0.70 2.21 0.66 0.00 0.00 0.00 175.76 178.42 2ash h SER 286 N 4.73 0.00 0.44 0.00 4.64 -1.90 -1.80 113.55 119.67 2ash h SER 286 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2ash h SER 286 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2ash h SER 286 CO 0.75 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 176.73 2ash n TYR 287 N -3.22 0.31 0.93 4.77 0.18 -1.26 -1.81 117.16 117.06 2ash n TYR 287 Ca -0.02 0.13 0.13 0.00 1.88 0.00 0.00 57.90 60.03 2ash n TYR 287 Cb 0.17 -0.71 0.51 0.00 -0.38 0.00 0.00 39.34 38.92 2ash n TYR 287 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 2ash n ASN 288 N -1.79 0.22 -0.32 9.48 3.02 -0.68 -4.43 115.26 120.76 2ash n ASN 288 Ca 0.02 0.36 0.02 0.00 -0.03 0.00 0.00 54.58 54.95 2ash n ASN 288 Cb 0.15 -0.37 0.20 0.00 -0.61 0.00 0.00 39.78 39.14 2ash n ASN 288 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2ash h LYS 289 N 0.00 1.10 -0.29 3.52 3.64 -1.55 -1.73 116.57 121.26 2ash h LYS 289 Ca 0.00 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2ash h LYS 289 Cb 0.54 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 2ash h LYS 289 CO 0.00 0.73 0.00 0.54 -2.27 0.00 0.00 179.45 178.45 2ash n ARG 290 N -4.46 2.86 -2.44 1.90 1.74 -1.26 -4.56 116.66 110.45 2ash n ARG 290 Ca 0.13 -2.19 -0.42 0.00 -0.77 0.00 0.00 57.85 54.59 2ash n ARG 290 Cb 0.13 -1.38 -0.03 0.00 -1.02 0.00 0.00 32.46 30.16 2ash n ARG 290 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2ash s SER 291 N -1.25 7.02 0.00 0.55 0.15 -0.69 -4.87 113.70 114.61 2ash s SER 291 Ca 0.26 1.81 0.12 0.00 0.70 0.00 0.00 55.95 58.84 2ash s SER 291 Cb 0.16 -2.55 0.36 0.00 -1.71 0.00 0.00 66.02 62.27 2ash s SER 291 CO 0.13 -0.63 1.29 0.18 1.20 0.00 0.00 173.24 175.41 2ash n LEU 292 N 5.49 1.87 -4.87 3.45 4.77 -1.26 -1.58 117.00 124.86 2ash n LEU 292 Ca 0.12 -0.92 -0.31 0.00 -0.03 0.00 0.00 56.01 54.87 2ash n LEU 292 Cb 0.46 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 41.29 2ash n LEU 292 CO 0.56 0.46 0.48 -1.61 -1.33 0.00 0.00 177.39 175.95 2ash s GLU 293 N -1.55 3.82 0.92 3.23 0.41 -1.26 -4.77 118.70 119.49 2ash s GLU 293 Ca 0.24 0.57 -0.12 0.00 -0.41 0.00 0.00 54.97 55.25 2ash s GLU 293 Cb 0.13 -2.35 0.14 0.00 -1.78 0.00 0.00 34.13 30.27 2ash s GLU 293 CO 0.17 -0.06 1.10 -1.25 -0.49 0.00 0.00 175.26 174.73 2ash s PRO 294 N -3.83 1.10 0.26 0.39 0.04 -1.26 -0.55 135.00 131.15 2ash s PRO 294 Ca 0.53 0.60 -0.02 0.00 0.04 0.00 0.00 61.00 62.15 2ash s PRO 294 Cb -0.10 -1.81 0.47 0.00 0.04 0.00 0.00 34.50 33.10 2ash s PRO 294 CO 0.30 -2.30 1.83 0.28 0.04 0.00 0.00 177.00 177.15 2ash h VAL 295 N -1.58 0.92 -2.69 -0.36 2.07 -1.86 -3.40 116.25 109.35 2ash h VAL 295 Ca -0.51 -0.31 -0.35 0.00 0.82 0.00 0.00 66.70 66.35 2ash h VAL 295 Cb 1.30 -0.06 -0.37 0.00 -1.52 0.00 0.00 31.29 30.64 2ash h VAL 295 CO 0.58 0.16 -0.66 -0.62 0.02 0.00 0.00 177.57 177.05 2ash s ASP 296 N -5.66 1.55 0.61 0.57 -1.08 -1.26 -4.96 116.67 106.44 2ash s ASP 296 Ca -0.12 -0.27 0.36 0.00 -0.52 0.00 0.00 52.55 52.00 2ash s ASP 296 Cb 0.21 0.23 2.02 0.00 -1.46 0.00 0.00 42.92 43.92 2ash s ASP 296 CO 0.80 -0.33 2.27 1.05 0.52 0.00 0.00 175.17 179.48 2ash h GLU 297 N 8.34 0.00 -0.00 4.34 4.11 -1.97 -2.35 114.58 127.05 2ash h GLU 297 Ca -0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.27 2ash h GLU 297 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2ash h GLU 297 CO 0.27 0.02 -0.10 0.54 0.07 0.00 0.00 179.01 179.81 2ash n ARG 298 N -3.45 0.76 -4.10 1.06 3.00 -1.26 -4.92 116.66 107.74 2ash n ARG 298 Ca -0.03 -0.26 -0.33 0.00 -0.01 0.00 0.00 57.85 57.22 2ash n ARG 298 Cb 0.11 -1.49 -0.07 0.00 0.00 0.00 0.00 32.46 31.00 2ash n ARG 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2ash n GLY 300 N 1.26 3.36 3.75 0.00 0.00 -1.26 -4.61 105.19 107.70 2ash n GLY 300 Ca -0.14 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 44.78 2ash n GLY 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ash h TYR 302 N -1.33 -0.02 -0.47 0.00 3.20 -1.95 -0.55 116.97 115.84 2ash h TYR 302 Ca -0.48 0.06 -0.07 0.00 3.14 0.00 0.00 58.73 61.38 2ash h TYR 302 Cb 1.27 0.15 -0.02 0.00 1.54 0.00 0.00 36.73 39.67 2ash h TYR 302 CO 0.47 -0.31 0.00 1.15 -1.64 0.00 0.00 178.16 177.83 2ash h THR 303 N 0.08 1.26 0.00 1.81 2.02 -1.91 -2.78 112.91 113.40 2ash h THR 303 Ca 0.49 -1.06 -0.19 0.00 0.77 0.00 0.00 66.41 66.43 2ash h THR 303 Cb 0.93 1.01 -0.03 0.00 -1.74 0.00 0.00 68.15 68.32 2ash h THR 303 CO -0.76 0.37 -0.90 0.00 0.37 0.00 0.00 175.52 174.60 2ash h LYS 305 N 0.00 0.00 0.00 0.00 1.57 -1.05 -3.40 116.57 113.69 2ash h LYS 305 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2ash h LYS 305 Cb 1.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.93 2ash h LYS 305 CO 0.12 0.27 -0.96 0.09 -0.57 0.00 0.00 179.45 178.39 2ash n ASN 306 N -3.42 4.80 -4.27 0.86 3.02 -1.06 -5.09 115.26 110.10 2ash n ASN 306 Ca 0.00 0.00 -0.17 0.00 -0.03 0.00 0.00 54.58 54.38 2ash n ASN 306 Cb 0.46 0.87 -0.11 0.00 -0.61 0.00 0.00 39.78 40.39 2ash n ASN 306 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2ash s PHE 307 N -1.93 1.44 0.24 3.10 0.08 -1.07 -5.10 117.98 114.75 2ash s PHE 307 Ca 0.00 -0.60 0.05 0.00 0.12 0.00 0.00 56.93 56.50 2ash s PHE 307 Cb 0.00 -0.73 -0.03 0.00 -0.57 0.00 0.00 43.02 41.69 2ash s PHE 307 CO 0.00 0.18 0.36 0.95 -0.10 0.00 0.00 175.22 176.61 2ash s THR 308 N -2.59 5.22 0.31 0.64 -4.23 -1.26 -4.36 115.64 109.37 2ash s THR 308 Ca 0.14 -1.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.65 2ash s THR 308 Cb -0.02 -3.84 0.28 0.00 1.34 0.00 0.00 72.50 70.25 2ash s THR 308 CO 0.03 -0.33 1.94 0.03 -0.54 0.00 0.00 174.62 175.75 2ash h ARG 309 N 1.17 1.00 -0.49 3.99 3.08 -0.84 -2.08 114.38 120.20 2ash h ARG 309 Ca -0.52 -0.06 0.10 0.00 0.07 0.00 0.00 59.98 59.57 2ash h ARG 309 Cb 1.23 -0.23 -0.10 0.00 0.08 0.00 0.00 29.97 30.96 2ash h ARG 309 CO 0.61 0.66 -0.17 1.03 -1.07 0.00 0.00 179.97 181.03 2ash h SER 310 N 1.03 -0.61 -0.38 7.04 0.87 -0.91 0.15 113.55 120.75 2ash h SER 310 Ca 0.35 0.16 -0.09 0.00 -1.23 0.00 0.00 61.79 60.98 2ash h SER 310 Cb 0.09 0.36 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 2ash h SER 310 CO -0.11 -0.21 -0.13 0.22 -0.53 0.00 0.00 176.83 176.07 2ash h TYR 311 N -0.06 0.85 -0.44 2.24 3.20 -1.68 -1.85 116.97 119.23 2ash h TYR 311 Ca 0.23 -0.19 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 2ash h TYR 311 Cb 0.42 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 2ash h TYR 311 CO -0.46 0.91 0.15 0.82 -1.64 0.00 0.00 178.16 177.94 2ash h ILE 312 N 0.55 1.22 -0.63 1.81 2.04 -1.25 -0.00 117.51 121.24 2ash h ILE 312 Ca 0.09 -0.71 0.08 0.00 1.00 0.00 0.00 64.86 65.33 2ash h ILE 312 Cb 0.65 0.85 -0.07 0.00 -0.74 0.00 0.00 36.82 37.51 2ash h ILE 312 CO 0.04 0.26 0.28 -0.74 0.00 0.00 0.00 178.15 177.99 2ash h HIS 313 N 0.58 0.51 -0.58 1.37 2.76 -0.94 -1.85 115.15 116.99 2ash h HIS 313 Ca 0.14 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.32 2ash h HIS 313 Cb 0.25 -0.13 -0.03 0.00 1.55 0.00 0.00 27.41 29.05 2ash h HIS 313 CO 0.01 0.18 0.28 1.25 -1.30 0.00 0.00 177.93 178.34 2ash h HIS 314 N 0.51 0.84 -0.52 5.26 -0.00 -0.91 -0.13 115.15 120.20 2ash h HIS 314 Ca 0.31 -0.04 0.01 0.00 -0.00 0.00 0.00 60.37 60.65 2ash h HIS 314 Cb 0.33 -0.26 -0.03 0.00 -0.00 0.00 0.00 27.41 27.45 2ash h HIS 314 CO -0.13 0.65 0.34 -0.07 -0.00 0.00 0.00 177.93 178.71 2ash h LEU 315 N 0.79 0.58 -0.71 0.26 3.38 -0.35 -0.95 115.31 118.31 2ash h LEU 315 Ca 0.20 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.10 2ash h LEU 315 Cb 0.12 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2ash h LEU 315 CO -0.02 0.42 0.20 -0.26 0.09 0.00 0.00 178.44 178.87 2ash h PHE 316 N 0.69 1.17 -0.96 1.13 0.04 -1.15 0.09 116.94 117.94 2ash h PHE 316 Ca 0.19 -0.13 0.13 0.00 2.80 0.00 0.00 57.97 60.96 2ash h PHE 316 Cb -0.06 -0.33 -0.09 0.00 2.20 0.00 0.00 35.95 37.66 2ash h PHE 316 CO -0.04 0.94 0.59 0.22 -0.60 0.00 0.00 178.31 179.41 2ash h ASP 317 N 1.06 0.84 -0.04 2.17 3.58 -0.50 -2.09 116.42 121.45 2ash h ASP 317 Ca 0.23 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.74 2ash h ASP 317 Cb 0.33 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.28 2ash h ASP 317 CO -0.00 0.43 0.00 0.54 -2.88 0.00 0.00 179.24 177.33 2ash n ARG 318 N -4.68 1.96 -1.10 0.28 5.12 -0.41 -4.96 116.66 112.88 2ash n ARG 318 Ca 0.18 -1.40 -0.03 0.00 -1.93 0.00 0.00 57.85 54.67 2ash n ARG 318 Cb 0.37 -1.47 -0.01 0.00 -1.16 0.00 0.00 32.46 30.19 2ash n ARG 318 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2ash n GLY 319 N 1.25 0.64 3.67 -0.13 0.00 -0.64 -4.99 105.19 104.99 2ash n GLY 319 Ca 0.17 -0.87 -0.43 0.00 0.00 0.00 0.00 46.02 44.89 2ash n GLY 319 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ash s GLU 320 N -2.20 4.24 0.60 1.61 0.41 -0.08 -4.90 118.70 118.39 2ash s GLU 320 Ca 0.00 1.75 0.35 0.00 -0.41 0.00 0.00 54.97 56.66 2ash s GLU 320 Cb 0.00 -3.75 1.96 0.00 -1.78 0.00 0.00 34.13 30.55 2ash s GLU 320 CO 0.00 -0.68 2.25 0.28 -0.49 0.00 0.00 175.26 176.62 2ash h VAL 321 N 5.40 0.32 -1.00 2.63 2.07 -1.94 -1.62 116.25 122.11 2ash h VAL 321 Ca -0.30 -0.12 0.24 0.00 0.82 0.00 0.00 66.70 67.34 2ash h VAL 321 Cb 1.13 1.09 -0.09 0.00 -1.52 0.00 0.00 31.29 31.90 2ash h VAL 321 CO 0.95 0.02 0.65 0.25 0.02 0.00 0.00 177.57 179.46 2ash h LEU 322 N 0.00 0.46 -0.62 2.57 5.85 -1.93 -0.61 115.31 121.02 2ash h LEU 322 Ca -0.00 0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.81 2ash h LEU 322 Cb 0.09 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 2ash h LEU 322 CO 0.00 0.13 0.39 1.23 -0.34 0.00 0.00 178.44 179.85 2ash h GLY 323 N 0.43 0.89 1.02 3.75 0.00 -1.59 -0.61 103.07 106.95 2ash h GLY 323 Ca 0.55 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 47.50 2ash h GLY 323 CO -0.26 0.26 -0.03 1.46 0.00 0.00 0.00 176.54 177.98 2ash h GLN 324 N 0.78 0.90 -0.16 4.80 4.20 -1.31 -2.57 115.11 121.74 2ash h GLN 324 Ca 0.25 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2ash h GLN 324 Cb -0.01 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 2ash h GLN 324 CO -0.09 0.94 0.10 0.82 -0.67 0.00 0.00 178.83 179.93 2ash h ILE 325 N 0.76 1.03 -0.56 2.54 2.04 -0.93 -0.94 117.51 121.45 2ash h ILE 325 Ca 0.14 -0.07 -0.09 0.00 1.00 0.00 0.00 64.86 65.84 2ash h ILE 325 Cb 0.56 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 2ash h ILE 325 CO 0.03 0.04 -0.00 -0.07 0.00 0.00 0.00 178.15 178.15 2ash h LEU 326 N 0.20 0.93 -0.68 1.44 3.38 -1.06 -1.75 115.31 117.78 2ash h LEU 326 Ca 0.06 -0.25 -0.13 0.00 0.09 0.00 0.00 57.88 57.65 2ash h LEU 326 Cb -0.01 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 2ash h LEU 326 CO -0.02 0.99 -0.61 -0.07 0.09 0.00 0.00 178.44 178.82 2ash h LEU 327 N 0.88 0.00 -0.13 1.67 3.38 -1.38 -2.02 115.31 117.71 2ash h LEU 327 Ca 0.16 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 2ash h LEU 327 Cb 0.52 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 2ash h LEU 327 CO 0.03 0.61 -0.08 0.74 0.09 0.00 0.00 178.44 179.83 2ash h THR 328 N 0.00 1.33 -0.32 0.22 2.02 -0.89 0.96 112.91 116.22 2ash h THR 328 Ca -0.01 -1.14 0.07 0.00 0.77 0.00 0.00 66.41 66.10 2ash h THR 328 Cb 1.14 1.82 -0.07 0.00 -1.74 0.00 0.00 68.15 69.30 2ash h THR 328 CO 0.08 0.33 -0.11 0.40 0.37 0.00 0.00 175.52 176.59 2ash h ILE 329 N -0.08 0.61 -0.21 3.11 2.04 -1.29 -2.00 117.51 119.68 2ash h ILE 329 Ca 0.03 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.88 2ash h ILE 329 Cb 0.56 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 2ash h ILE 329 CO 0.02 0.00 0.10 -0.74 0.00 0.00 0.00 178.15 177.53 2ash h HIS 330 N -0.05 0.30 -0.64 1.37 2.76 -1.22 -2.08 115.15 115.59 2ash h HIS 330 Ca 0.16 -0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 58.26 2ash h HIS 330 Cb 0.29 -0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.13 2ash h HIS 330 CO -0.33 0.31 0.17 -0.91 -1.30 0.00 0.00 177.93 175.87 2ash h ASN 331 N 0.21 0.93 -0.33 3.26 2.35 -0.69 0.69 115.58 122.00 2ash h ASN 331 Ca 0.07 -0.17 -0.09 0.00 -0.55 0.00 0.00 56.30 55.55 2ash h ASN 331 Cb 0.12 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 2ash h ASN 331 CO -0.01 0.89 -0.16 0.40 -1.65 0.00 0.00 177.43 176.90 2ash h ILE 332 N 0.95 1.29 -0.53 2.81 1.08 -1.35 -1.87 117.51 119.89 2ash h ILE 332 Ca 0.21 -1.27 0.10 0.00 -0.39 0.00 0.00 64.86 63.51 2ash h ILE 332 Cb 0.31 1.41 -0.08 0.00 -3.07 0.00 0.00 36.82 35.39 2ash h ILE 332 CO -0.00 0.41 0.04 0.78 -0.69 0.00 0.00 178.15 178.69 2ash h ASN 333 N 0.46 -0.14 -0.00 1.72 2.35 -1.06 -0.56 115.58 118.34 2ash h ASN 333 Ca 0.07 0.12 0.03 0.00 -0.55 0.00 0.00 56.30 55.97 2ash h ASN 333 Cb 0.69 0.19 -0.03 0.00 0.05 0.00 0.00 38.32 39.22 2ash h ASN 333 CO 0.05 -0.05 -0.17 0.15 -1.65 0.00 0.00 177.43 175.76 2ash h PHE 334 N 0.16 -0.45 -0.61 1.19 3.57 -0.68 -0.94 116.94 119.18 2ash h PHE 334 Ca 0.27 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.80 2ash h PHE 334 Cb 0.41 0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.32 2ash h PHE 334 CO -0.29 -0.25 0.39 0.52 -2.23 0.00 0.00 178.31 176.44 2ash h MET 335 N -0.28 0.76 -0.61 1.11 2.86 -1.01 0.11 114.93 117.88 2ash h MET 335 Ca 0.06 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.55 2ash h MET 335 Cb 0.36 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.82 2ash h MET 335 CO -0.17 0.50 -0.01 0.82 1.06 0.00 0.00 176.91 179.12 2ash h ILE 336 N 0.78 1.27 -0.40 -1.22 1.08 -1.00 -2.67 117.51 115.35 2ash h ILE 336 Ca 0.23 -1.17 -0.05 0.00 -0.39 0.00 0.00 64.86 63.48 2ash h ILE 336 Cb -0.04 0.80 -0.02 0.00 -3.07 0.00 0.00 36.82 34.49 2ash h ILE 336 CO -0.07 0.42 0.05 -1.28 -0.69 0.00 0.00 178.15 176.58 2ash h SER 337 N 0.98 0.65 -0.51 1.72 0.87 -0.95 -1.30 113.55 115.01 2ash h SER 337 Ca 0.17 -0.27 0.10 0.00 -1.23 0.00 0.00 61.79 60.56 2ash h SER 337 Cb 0.57 -0.17 -0.09 0.00 -0.44 0.00 0.00 62.40 62.26 2ash h SER 337 CO 0.03 0.76 -0.10 0.25 -0.53 0.00 0.00 176.83 177.24 2ash h LEU 338 N 0.52 -0.42 -0.66 2.23 5.85 -0.68 0.18 115.31 122.34 2ash h LEU 338 Ca 0.12 0.15 -0.11 0.00 0.84 0.00 0.00 57.88 58.88 2ash h LEU 338 Cb 0.39 0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 2ash h LEU 338 CO 0.01 -0.15 -0.12 0.24 -0.34 0.00 0.00 178.44 178.08 2ash h MET 339 N 0.02 0.92 -0.65 1.25 2.86 -1.33 -0.30 114.93 117.71 2ash h MET 339 Ca 0.25 -0.33 0.06 0.00 -2.06 0.00 0.00 59.70 57.62 2ash h MET 339 Cb 0.38 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.93 2ash h MET 339 CO -0.51 0.99 0.36 -0.22 1.06 0.00 0.00 176.91 178.59 2ash h LYS 340 N 0.82 0.64 -0.40 1.72 1.63 -0.71 -0.96 116.57 119.31 2ash h LYS 340 Ca 0.13 -0.04 -0.11 0.00 -0.85 0.00 0.00 60.65 59.79 2ash h LYS 340 Cb 0.65 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.12 2ash h LYS 340 CO 0.05 0.42 -0.18 0.93 -3.45 0.00 0.00 179.45 177.22 2ash h GLU 341 N 0.66 0.77 -0.22 1.90 4.39 -0.54 -1.12 114.58 120.42 2ash h GLU 341 Ca 0.29 -0.29 0.05 0.00 0.34 0.00 0.00 59.36 59.75 2ash h GLU 341 Cb 0.19 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.74 2ash h GLU 341 CO -0.18 0.89 -0.10 0.28 -1.16 0.00 0.00 179.01 178.74 2ash h VAL 342 N 0.68 0.68 -0.66 3.13 2.07 -0.70 -0.39 116.25 121.05 2ash h VAL 342 Ca 0.10 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.60 2ash h VAL 342 Cb 0.68 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 2ash h VAL 342 CO 0.05 0.00 0.33 0.03 0.02 0.00 0.00 177.57 178.00 2ash h ARG 343 N -0.07 0.95 -0.40 1.57 3.08 -0.85 -1.46 114.38 117.19 2ash h ARG 343 Ca 0.12 -0.13 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 2ash h ARG 343 Cb 0.25 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 2ash h ARG 343 CO -0.27 0.74 -0.07 0.00 -1.07 0.00 0.00 179.97 179.30 2ash h ARG 344 N 0.91 0.69 -0.00 0.04 3.08 -1.04 -2.54 114.38 115.52 2ash h ARG 344 Ca 0.23 -0.20 -0.12 0.00 0.07 0.00 0.00 59.98 59.96 2ash h ARG 344 Cb 0.10 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 2ash h ARG 344 CO -0.03 0.75 -0.56 0.66 -1.07 0.00 0.00 179.97 179.72 2ash h SER 345 N 0.63 0.01 -0.18 7.04 4.64 -0.62 -1.07 113.55 124.01 2ash h SER 345 Ca 0.12 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.35 2ash h SER 345 Cb 0.50 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2ash h SER 345 CO 0.03 0.57 -0.19 0.40 -0.87 0.00 0.00 176.83 176.77 2ash h ILE 346 N 0.01 1.33 -0.60 0.95 2.04 -1.05 0.88 117.51 121.06 2ash h ILE 346 Ca -0.01 -1.35 0.03 0.00 1.00 0.00 0.00 64.86 64.54 2ash h ILE 346 Cb 0.99 1.80 -0.04 0.00 -0.74 0.00 0.00 36.82 38.83 2ash h ILE 346 CO 0.07 0.41 0.37 -0.08 0.00 0.00 0.00 178.15 178.92 2ash h GLU 347 N 0.11 0.70 -0.01 2.37 4.81 -1.33 -2.96 114.58 118.27 2ash h GLU 347 Ca 0.03 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2ash h GLU 347 Cb 0.73 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.95 2ash h GLU 347 CO 0.05 0.46 -0.15 -1.13 -0.73 0.00 0.00 179.01 177.51 2ash n SER 348 N -4.74 1.27 -0.54 1.04 3.41 -0.42 -4.95 113.62 108.70 2ash n SER 348 Ca 0.06 -1.17 -0.07 0.00 -0.26 0.00 0.00 58.87 57.43 2ash n SER 348 Cb 0.09 0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.09 2ash n SER 348 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ash n GLY 349 N 1.28 0.88 1.33 5.00 0.00 -0.12 -4.91 105.19 108.64 2ash n GLY 349 Ca 0.15 -0.73 0.08 0.00 0.00 0.00 0.00 46.02 45.52 2ash n GLY 349 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ash n THR 350 N -2.84 2.01 -0.18 2.61 -2.24 0.12 -4.70 114.28 109.06 2ash n THR 350 Ca -0.07 -1.39 0.01 0.00 -2.27 0.00 0.00 64.05 60.33 2ash n THR 350 Cb 0.24 0.01 0.26 0.00 -2.10 0.00 0.00 70.33 68.74 2ash n THR 350 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2ash h PHE 351 N 3.19 0.89 0.00 4.78 3.57 -1.80 -1.74 116.94 125.83 2ash h PHE 351 Ca 0.00 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.45 2ash h PHE 351 Cb 1.45 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.88 2ash h PHE 351 CO 0.69 0.57 -0.33 0.87 -2.23 0.00 0.00 178.31 177.88 2ash h LYS 352 N 0.95 0.00 -0.34 1.11 1.79 -1.90 -0.09 116.57 118.10 2ash h LYS 352 Ca 0.25 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.60 2ash h LYS 352 Cb -0.09 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.56 2ash h LYS 352 CO -0.05 0.33 -0.26 0.93 -1.08 0.00 0.00 179.45 179.31 2ash h GLU 353 N 0.00 0.77 0.02 3.15 5.08 -1.69 -1.51 114.58 120.40 2ash h GLU 353 Ca -0.00 -0.38 -0.00 0.00 -1.00 0.00 0.00 59.36 57.98 2ash h GLU 353 Cb 0.59 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2ash h GLU 353 CO 0.04 1.00 -0.01 1.25 -1.00 0.00 0.00 179.01 180.29 2ash h LEU 354 N 0.55 -0.03 -0.54 1.33 5.85 -1.24 -2.73 115.31 118.49 2ash h LEU 354 Ca 0.06 -0.00 0.07 0.00 0.84 0.00 0.00 57.88 58.85 2ash h LEU 354 Cb 0.82 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.80 2ash h LEU 354 CO 0.07 -0.01 0.22 0.50 -0.34 0.00 0.00 178.44 178.88 2ash h LYS 355 N -0.03 0.41 -0.63 1.25 3.64 -1.00 -1.75 116.57 118.46 2ash h LYS 355 Ca -0.00 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2ash h LYS 355 Cb 0.03 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 2ash h LYS 355 CO 0.01 0.27 0.36 0.66 -2.27 0.00 0.00 179.45 178.48 2ash h SER 356 N 0.42 0.76 -0.16 4.20 4.64 -1.24 -1.37 113.55 120.81 2ash h SER 356 Ca 0.26 -0.05 -0.08 0.00 -0.47 0.00 0.00 61.79 61.45 2ash h SER 356 Cb 0.26 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2ash h SER 356 CO -0.24 0.60 -0.21 0.50 -0.87 0.00 0.00 176.83 176.61 2ash h LYS 357 N 0.87 0.42 -0.34 4.77 3.64 -1.06 -2.70 116.57 122.17 2ash h LYS 357 Ca 0.22 -0.24 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2ash h LYS 357 Cb -0.01 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2ash h LYS 357 CO -0.04 0.83 0.21 0.28 -2.27 0.00 0.00 179.45 178.46 2ash h VAL 358 N 0.05 1.06 -0.01 2.00 2.07 -1.07 -2.44 116.25 117.91 2ash h VAL 358 Ca 0.02 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 2ash h VAL 358 Cb 0.77 0.59 -0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2ash h VAL 358 CO 0.05 0.08 -0.09 0.58 0.02 0.00 0.00 177.57 178.21 2ash h VAL 359 N 0.44 1.07 -0.04 2.57 2.07 -1.31 0.54 116.25 121.59 2ash h VAL 359 Ca 0.13 -0.33 -0.10 0.00 0.82 0.00 0.00 66.70 67.22 2ash h VAL 359 Cb -0.03 1.16 0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2ash h VAL 359 CO -0.04 0.10 -0.36 -0.08 0.02 0.00 0.00 177.57 177.20 2ash h GLU 360 N 0.02 0.31 0.00 1.57 4.57 -1.12 -1.58 114.58 118.36 2ash h GLU 360 Ca 0.00 -0.29 0.00 0.00 -1.18 0.00 0.00 59.36 57.90 2ash h GLU 360 Cb 0.17 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 2ash h GLU 360 CO 0.01 0.95 -0.88 1.33 -1.18 0.00 0.00 179.01 179.24 2ash n VAL 361 N -4.40 0.20 0.28 0.32 0.24 -0.95 -3.75 118.33 110.26 2ash n VAL 361 Ca -0.09 -0.23 0.06 0.00 -2.04 0.00 0.00 64.34 62.04 2ash n VAL 361 Cb 0.54 0.14 0.09 0.00 -1.47 0.00 0.00 33.84 33.14 2ash n VAL 361 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2ash n TYR 362 N -1.96 0.17 0.00 6.34 4.01 0.15 -4.24 117.16 121.63 2ash n TYR 362 Ca 0.03 -0.16 0.00 0.00 -0.16 0.00 0.00 57.90 57.60 2ash n TYR 362 Cb 0.43 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.45 2ash n TYR 362 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27