#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2abe n TRP 5 N 0.00 1.37 -1.60 4.41 4.27 -1.26 -4.88 117.44 119.76 2abe n TRP 5 Ca 0.00 0.42 0.00 0.00 -3.89 0.00 0.00 57.50 54.03 2abe n TRP 5 Cb 0.00 -2.19 0.00 0.00 -1.36 0.00 0.00 31.31 27.76 2abe n TRP 5 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2abe n GLY 6 N 1.03 3.05 0.06 -1.67 0.00 -0.11 -5.04 105.19 102.51 2abe n GLY 6 Ca 0.15 -0.61 0.05 0.00 0.00 0.00 0.00 46.02 45.60 2abe n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2abe n TYR 7 N 0.00 0.00 -2.26 1.61 4.01 -1.26 -3.83 117.16 115.44 2abe n TYR 7 Ca 0.00 -0.69 -0.24 0.00 -0.16 0.00 0.00 57.90 56.81 2abe n TYR 7 Cb 0.00 -0.09 0.15 0.00 -0.31 0.00 0.00 39.34 39.08 2abe n TYR 7 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2abe n GLY 8 N -0.89 -0.33 0.22 2.72 0.00 -1.26 -4.68 105.19 100.96 2abe n GLY 8 Ca 0.08 -1.88 -0.01 0.00 0.00 0.00 0.00 46.02 44.21 2abe n GLY 8 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2abe h LYS 9 N 0.00 0.28 -0.01 1.61 1.63 -1.97 0.36 116.57 118.47 2abe h LYS 9 Ca -0.35 -0.10 0.00 0.00 -0.85 0.00 0.00 60.65 59.35 2abe h LYS 9 Cb 1.13 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.74 2abe h LYS 9 CO 0.31 0.55 -0.52 0.72 -3.45 0.00 0.00 179.45 177.06 2abe n HIS 10 N -4.12 0.00 -1.23 1.91 8.25 -1.26 -4.35 115.22 114.42 2abe n HIS 10 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2abe n HIS 10 Cb 0.40 -0.05 0.01 0.00 1.12 0.00 0.00 29.99 31.47 2abe n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2abe n ASN 11 N -0.54 0.24 -3.75 0.41 6.94 -1.19 -4.97 115.26 112.40 2abe n ASN 11 Ca 0.09 -1.46 -0.30 0.00 -0.02 0.00 0.00 54.58 52.88 2abe n ASN 11 Cb 0.41 -0.08 0.25 0.00 -2.36 0.00 0.00 39.78 38.00 2abe n ASN 11 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2abe s GLY 12 N -0.49 1.53 0.48 4.83 0.00 0.13 -0.93 107.32 112.87 2abe s GLY 12 Ca 0.01 -0.87 0.31 0.00 0.00 0.00 0.00 44.72 44.16 2abe s GLY 12 CO 0.00 0.03 1.76 -2.55 0.00 0.00 0.00 173.10 172.35 2abe h PRO 13 N -2.81 0.14 0.00 2.90 0.11 -1.84 0.27 132.00 130.78 2abe h PRO 13 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2abe h PRO 13 Cb 1.31 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2abe h PRO 13 CO 0.33 0.09 0.00 -1.91 -0.21 0.00 0.00 178.00 176.31 2abe n GLU 14 N -4.38 0.06 -0.01 1.05 0.00 -1.26 -3.02 120.64 113.08 2abe n GLU 14 Ca 0.28 0.21 0.08 0.00 0.00 0.00 0.00 57.16 57.73 2abe n GLU 14 Cb 1.18 -1.59 -0.12 0.00 0.00 0.00 0.00 31.44 30.92 2abe n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2abe n HIS 15 N -1.69 0.00 -0.17 4.31 8.25 0.96 -4.64 115.22 122.24 2abe n HIS 15 Ca 0.04 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.65 2abe n HIS 15 Cb 0.25 -0.27 0.49 0.00 1.12 0.00 0.00 29.99 31.58 2abe n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 2abe h TRP 16 N 0.00 0.52 -0.48 4.41 6.55 -1.44 -2.53 115.95 122.98 2abe h TRP 16 Ca 0.00 0.01 0.11 0.00 0.95 0.00 0.00 58.89 59.97 2abe h TRP 16 Cb 0.66 -0.17 -0.02 0.00 -0.86 0.00 0.00 29.16 28.77 2abe h TRP 16 CO 0.00 0.21 0.34 1.12 -1.05 0.00 0.00 178.44 179.05 2abe h HIS 17 N 0.45 0.16 -0.71 0.49 2.07 -1.79 0.22 115.15 116.04 2abe h HIS 17 Ca 0.37 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.89 2abe h HIS 17 Cb 0.79 -0.05 -0.03 0.00 2.57 0.00 0.00 27.41 30.68 2abe h HIS 17 CO -0.00 0.07 0.43 0.87 -3.07 0.00 0.00 177.93 176.24 2abe h LYS 18 N 0.15 0.95 0.00 5.12 1.57 -1.80 -2.78 116.57 119.78 2abe h LYS 18 Ca 0.23 -0.08 -0.25 0.00 -1.87 0.00 0.00 60.65 58.68 2abe h LYS 18 Cb 0.71 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.77 2abe h LYS 18 CO -0.03 0.67 -1.72 -0.25 -0.57 0.00 0.00 179.45 177.55 2abe n ASP 19 N -4.55 0.70 -3.72 0.86 8.00 -0.77 -4.69 116.55 112.38 2abe n ASP 19 Ca 0.06 0.32 -0.29 0.00 0.71 0.00 0.00 54.79 55.59 2abe n ASP 19 Cb 0.05 0.26 -0.13 0.00 -0.02 0.00 0.00 41.12 41.28 2abe n ASP 19 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2abe s PHE 20 N -2.74 2.17 0.49 1.24 0.08 0.70 -4.99 117.98 114.94 2abe s PHE 20 Ca -0.05 -2.57 0.27 0.00 0.12 0.00 0.00 56.93 54.70 2abe s PHE 20 Cb 0.08 -1.97 1.34 0.00 -0.57 0.00 0.00 43.02 41.91 2abe s PHE 20 CO 0.82 -0.76 1.87 -1.35 -0.10 0.00 0.00 175.22 175.71 2abe h PRO 21 N 6.49 0.14 0.00 0.24 0.11 -1.73 -0.81 132.00 136.43 2abe h PRO 21 Ca 0.02 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.13 2abe h PRO 21 Cb 0.91 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2abe h PRO 21 CO 0.51 0.09 0.03 1.51 -0.21 0.00 0.00 178.00 179.93 2abe n ILE 22 N -4.36 1.01 0.25 4.15 0.13 -1.26 -1.98 119.36 117.29 2abe n ILE 22 Ca 0.19 0.74 0.18 0.00 -1.10 0.00 0.00 62.75 62.76 2abe n ILE 22 Cb 0.88 -1.74 0.89 0.00 -0.84 0.00 0.00 39.64 38.83 2abe n ILE 22 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2abe h ALA 23 N 1.92 1.57 -0.37 1.51 0.00 -1.47 0.43 119.26 122.84 2abe h ALA 23 Ca 0.00 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2abe h ALA 23 Cb 0.06 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 2abe h ALA 23 CO 0.00 -0.28 0.03 1.63 0.00 0.00 0.00 179.25 180.63 2abe n LYS 24 N -3.43 2.73 -0.14 0.00 5.02 -0.84 -4.98 118.16 116.52 2abe n LYS 24 Ca 0.00 -2.98 -0.05 0.00 -2.02 0.00 0.00 58.31 53.26 2abe n LYS 24 Cb 0.32 -1.90 0.05 0.00 -0.02 0.00 0.00 35.03 33.48 2abe n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2abe n GLY 25 N -0.64 -2.91 0.07 0.72 0.00 0.15 -4.99 105.19 97.59 2abe n GLY 25 Ca 0.28 -1.39 0.11 0.00 0.00 0.00 0.00 46.02 45.03 2abe n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2abe n GLU 26 N -2.30 0.49 -2.90 1.61 -0.58 -1.26 -4.47 120.64 111.23 2abe n GLU 26 Ca 0.03 0.04 -0.20 0.00 -0.42 0.00 0.00 57.16 56.61 2abe n GLU 26 Cb 0.11 -1.71 -0.01 0.00 -0.57 0.00 0.00 31.44 29.26 2abe n GLU 26 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2abe n ARG 27 N -2.37 1.97 -3.28 3.49 1.85 -1.26 -4.67 116.66 112.39 2abe n ARG 27 Ca 0.00 -3.91 -0.32 0.00 -1.00 0.00 0.00 57.85 52.62 2abe n ARG 27 Cb 0.51 -1.82 -0.06 0.00 -1.05 0.00 0.00 32.46 30.04 2abe n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 2abe s GLN 28 N -3.02 3.92 0.24 2.89 -1.52 -1.26 -2.67 119.66 118.23 2abe s GLN 28 Ca 0.41 0.48 0.09 0.00 -1.95 0.00 0.00 55.36 54.39 2abe s GLN 28 Cb 0.36 -2.58 -0.05 0.00 -0.22 0.00 0.00 33.01 30.53 2abe s GLN 28 CO -0.09 0.26 -0.16 -1.12 -0.25 0.00 0.00 175.29 173.93 2abe s SER 29 N -2.26 2.98 0.93 5.90 0.01 -1.26 -4.69 113.70 115.31 2abe s SER 29 Ca 0.50 -1.03 -0.12 0.00 1.31 0.00 0.00 55.95 56.61 2abe s SER 29 Cb -0.11 -0.20 0.20 0.00 0.21 0.00 0.00 66.02 66.12 2abe s SER 29 CO 0.19 -0.09 1.24 -0.81 0.41 0.00 0.00 173.24 174.18 2abe n PRO 30 N -0.48 -0.99 -4.09 12.44 -0.04 -1.26 -4.62 135.00 135.96 2abe n PRO 30 Ca -0.07 -2.21 -0.09 0.00 -0.04 0.00 0.00 63.50 61.09 2abe n PRO 30 Cb 0.60 -1.18 -0.09 0.00 -0.04 0.00 0.00 33.50 32.79 2abe n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2abe s VAL 31 N -3.68 0.11 0.00 0.52 -7.23 -1.26 0.15 120.40 109.01 2abe s VAL 31 Ca 0.73 -1.75 -0.24 0.00 -1.81 0.00 0.00 61.98 58.90 2abe s VAL 31 Cb -0.02 -1.90 -0.05 0.00 0.56 0.00 0.00 36.38 34.97 2abe s VAL 31 CO 0.50 -0.51 0.74 -0.62 -0.31 0.00 0.00 175.10 174.90 2abe s ASP 32 N -3.01 7.13 -0.54 4.85 2.15 -1.26 -3.33 116.67 122.65 2abe s ASP 32 Ca 0.19 1.35 -0.19 0.00 0.43 0.00 0.00 52.55 54.33 2abe s ASP 32 Cb 0.07 -2.44 0.07 0.00 -0.30 0.00 0.00 42.92 40.31 2abe s ASP 32 CO -0.01 -0.02 0.68 -0.63 -0.17 0.00 0.00 175.17 175.02 2abe s ILE 33 N 0.22 4.80 -0.56 4.11 -1.09 0.88 -4.94 121.20 124.62 2abe s ILE 33 Ca 0.38 -0.59 -0.24 0.00 -2.23 0.00 0.00 60.65 57.97 2abe s ILE 33 Cb -0.19 -4.39 0.04 0.00 -1.58 0.00 0.00 42.46 36.34 2abe s ILE 33 CO 0.21 -0.95 0.95 -0.62 -1.23 0.00 0.00 174.94 173.30 2abe s ASP 34 N 3.02 6.32 0.58 3.58 -1.08 -1.26 -0.81 116.67 127.02 2abe s ASP 34 Ca 0.15 -0.41 0.28 0.00 -0.52 0.00 0.00 52.55 52.05 2abe s ASP 34 Cb -0.20 -2.44 1.72 0.00 -1.46 0.00 0.00 42.92 40.54 2abe s ASP 34 CO 0.11 -1.26 2.21 0.71 0.52 0.00 0.00 175.17 177.45 2abe h THR 35 N 6.02 0.57 -0.01 1.71 1.35 -1.94 -1.22 112.91 119.38 2abe h THR 35 Ca -0.26 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 2abe h THR 35 Cb 1.07 0.96 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 2abe h THR 35 CO 1.10 0.00 -0.04 1.41 -0.25 0.00 0.00 175.52 177.74 2abe n HIS 36 N -3.93 0.00 0.05 4.73 8.25 -1.26 -3.72 115.22 119.35 2abe n HIS 36 Ca -0.02 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.45 2abe n HIS 36 Cb 0.14 -0.03 -0.02 0.00 1.12 0.00 0.00 29.99 31.21 2abe n HIS 36 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2abe n THR 37 N -0.21 0.00 -2.29 1.59 -1.04 -0.55 -5.00 114.28 106.77 2abe n THR 37 Ca 0.19 -0.24 -0.38 0.00 -2.04 0.00 0.00 64.05 61.58 2abe n THR 37 Cb 0.31 0.70 -0.02 0.00 -1.82 0.00 0.00 70.33 69.50 2abe n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2abe s ALA 38 N -1.73 3.11 -0.13 2.41 0.00 -0.68 -4.80 121.76 119.93 2abe s ALA 38 Ca -0.00 0.95 -0.01 0.00 0.00 0.00 0.00 51.96 52.90 2abe s ALA 38 Cb 0.02 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 2abe s ALA 38 CO 0.10 -0.55 -0.10 0.21 0.00 0.00 0.00 175.76 175.42 2abe s LYS 39 N -2.41 3.43 0.32 0.00 2.36 -0.56 -4.87 119.74 118.01 2abe s LYS 39 Ca 0.59 -0.63 -0.29 0.00 -2.55 0.00 0.00 55.97 53.09 2abe s LYS 39 Cb -0.30 -2.71 -0.10 0.00 -1.05 0.00 0.00 37.83 33.67 2abe s LYS 39 CO 0.37 0.25 1.35 -0.47 1.55 0.00 0.00 175.35 178.41 2abe s TYR 40 N 0.27 2.98 -0.33 4.03 5.04 -1.26 -0.65 117.35 127.44 2abe s TYR 40 Ca -0.07 1.32 0.01 0.00 -2.44 0.00 0.00 57.07 55.89 2abe s TYR 40 Cb -0.15 -3.75 0.10 0.00 0.35 0.00 0.00 41.96 38.51 2abe s TYR 40 CO 0.05 -2.14 0.09 0.34 -1.34 0.00 0.00 175.55 172.55 2abe s ASP 41 N -0.30 4.26 0.63 4.32 -1.08 -0.46 -4.83 116.67 119.22 2abe s ASP 41 Ca 0.51 -1.86 0.33 0.00 -0.52 0.00 0.00 52.55 51.01 2abe s ASP 41 Cb -0.41 -1.13 1.80 0.00 -1.46 0.00 0.00 42.92 41.72 2abe s ASP 41 CO 0.53 -0.40 2.07 -0.65 0.52 0.00 0.00 175.17 177.24 2abe h PRO 42 N 7.87 0.00 -0.00 4.34 0.11 -1.94 -1.32 132.00 141.06 2abe h PRO 42 Ca -0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 2abe h PRO 42 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2abe h PRO 42 CO 0.49 0.00 -0.12 -1.13 -0.21 0.00 0.00 178.00 177.03 2abe n SER 43 N -3.30 0.23 -4.70 -2.05 3.41 -1.26 -4.83 113.62 101.12 2abe n SER 43 Ca -0.00 -0.07 -0.42 0.00 -0.26 0.00 0.00 58.87 58.12 2abe n SER 43 Cb 0.32 -0.20 -0.03 0.00 -0.26 0.00 0.00 64.21 64.04 2abe n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2abe s LEU 44 N -2.77 4.34 0.53 1.04 1.43 -0.50 -5.02 118.68 117.74 2abe s LEU 44 Ca 0.21 2.03 -0.09 0.00 -1.03 0.00 0.00 54.13 55.25 2abe s LEU 44 Cb 0.19 -3.57 -0.05 0.00 0.03 0.00 0.00 46.19 42.80 2abe s LEU 44 CO 0.53 -0.57 0.90 -0.54 0.23 0.00 0.00 176.35 176.90 2abe s LYS 45 N 1.59 3.64 0.61 1.70 1.02 -1.23 -4.96 119.74 122.11 2abe s LYS 45 Ca 0.60 0.53 -0.18 0.00 0.02 0.00 0.00 55.97 56.94 2abe s LYS 45 Cb -0.30 -2.24 -0.03 0.00 -0.52 0.00 0.00 37.83 34.75 2abe s LYS 45 CO 0.27 -0.33 1.20 -2.14 -0.92 0.00 0.00 175.35 173.44 2abe s PRO 46 N -4.72 2.87 0.34 -1.68 0.02 -1.26 -2.44 135.00 128.13 2abe s PRO 46 Ca 0.52 1.80 -0.27 0.00 0.02 0.00 0.00 61.00 63.07 2abe s PRO 46 Cb -0.11 -1.92 -0.09 0.00 0.02 0.00 0.00 34.50 32.40 2abe s PRO 46 CO 0.45 -1.28 1.13 -0.51 -0.33 0.00 0.00 177.00 176.46 2abe s LEU 47 N -4.23 4.38 -0.25 -5.54 1.43 -1.26 -1.97 118.68 111.24 2abe s LEU 47 Ca 0.77 2.28 0.03 0.00 -1.03 0.00 0.00 54.13 56.18 2abe s LEU 47 Cb -0.30 -3.83 0.06 0.00 0.03 0.00 0.00 46.19 42.15 2abe s LEU 47 CO 0.35 -0.37 -0.12 -0.55 0.23 0.00 0.00 176.35 175.89 2abe s SER 48 N -1.03 4.30 -0.28 2.29 0.15 0.07 -4.89 113.70 114.31 2abe s SER 48 Ca 0.50 -1.32 -0.02 0.00 0.70 0.00 0.00 55.95 55.82 2abe s SER 48 Cb -0.30 -1.54 0.04 0.00 -1.71 0.00 0.00 66.02 62.51 2abe s SER 48 CO 0.39 -0.17 -0.02 -0.69 1.20 0.00 0.00 173.24 173.94 2abe s VAL 49 N 1.12 2.98 -0.68 4.45 1.01 -1.26 -1.05 120.40 126.97 2abe s VAL 49 Ca -0.07 -1.20 -0.03 0.00 0.00 0.00 0.00 61.98 60.68 2abe s VAL 49 Cb -0.19 -2.62 0.17 0.00 0.00 0.00 0.00 36.38 33.74 2abe s VAL 49 CO -0.06 0.04 0.50 -0.44 0.00 0.00 0.00 175.10 175.14 2abe s SER 50 N 1.29 5.36 -0.06 3.32 0.01 -0.40 -4.87 113.70 118.35 2abe s SER 50 Ca -0.03 -3.02 0.15 0.00 1.31 0.00 0.00 55.95 54.36 2abe s SER 50 Cb -0.18 -1.87 0.46 0.00 0.21 0.00 0.00 66.02 64.64 2abe s SER 50 CO -0.02 -0.33 1.39 -1.22 0.41 0.00 0.00 173.24 173.46 2abe n TYR 51 N 3.26 0.80 -0.01 2.43 4.01 -1.26 -1.82 117.16 124.57 2abe n TYR 51 Ca 0.10 -0.59 0.03 0.00 -0.16 0.00 0.00 57.90 57.28 2abe n TYR 51 Cb 0.38 -0.12 0.40 0.00 -0.31 0.00 0.00 39.34 39.69 2abe n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 2abe h ASP 52 N 2.60 0.49 -0.64 7.72 2.03 -1.90 -2.79 116.42 123.93 2abe h ASP 52 Ca 0.00 -0.02 -0.30 0.00 -0.73 0.00 0.00 57.03 55.98 2abe h ASP 52 Cb 1.03 -0.12 -0.18 0.00 -0.83 0.00 0.00 39.33 39.23 2abe h ASP 52 CO 0.09 0.38 0.25 0.00 -1.03 0.00 0.00 179.24 178.92 2abe n GLN 53 N -4.45 2.36 -1.95 4.15 1.13 -1.24 -5.02 117.38 112.36 2abe n GLN 53 Ca 0.03 -3.08 -0.39 0.00 -1.94 0.00 0.00 57.00 51.62 2abe n GLN 53 Cb 0.08 -2.01 0.01 0.00 0.11 0.00 0.00 30.24 28.42 2abe n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2abe s ALA 54 N -3.20 3.13 -0.35 -1.58 0.00 -1.06 -4.52 121.76 114.18 2abe s ALA 54 Ca 0.51 1.28 0.01 0.00 0.00 0.00 0.00 51.96 53.75 2abe s ALA 54 Cb 0.43 -3.52 0.11 0.00 0.00 0.00 0.00 23.12 20.15 2abe s ALA 54 CO 0.07 -1.02 0.13 0.99 0.00 0.00 0.00 175.76 175.93 2abe s THR 55 N -1.29 1.21 0.45 0.00 2.01 -1.26 -4.92 115.64 111.84 2abe s THR 55 Ca 0.62 -1.86 -0.21 0.00 0.31 0.00 0.00 61.69 60.54 2abe s THR 55 Cb -0.39 -1.89 -0.09 0.00 0.01 0.00 0.00 72.50 70.14 2abe s THR 55 CO 0.49 -0.73 1.02 -0.94 -0.69 0.00 0.00 174.62 173.76 2abe s SER 56 N 1.15 6.59 0.00 3.53 1.04 -1.26 -1.12 113.70 123.62 2abe s SER 56 Ca 0.12 1.89 0.00 0.00 0.48 0.00 0.00 55.95 58.45 2abe s SER 56 Cb -0.20 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.36 2abe s SER 56 CO -0.15 -0.61 0.00 0.18 0.98 0.00 0.00 173.24 173.64 2abe n LEU 57 N -0.67 1.31 -3.82 2.42 4.77 0.85 -4.10 117.00 117.75 2abe n LEU 57 Ca 0.08 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.96 2abe n LEU 57 Cb 0.52 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.57 2abe n LEU 57 CO 0.40 0.19 0.24 -0.60 -1.33 0.00 0.00 177.39 176.29 2abe s ARG 58 N -1.95 1.42 -0.04 3.23 3.52 -1.20 -1.98 118.95 121.96 2abe s ARG 58 Ca 0.00 -0.98 0.04 0.00 -0.13 0.00 0.00 55.73 54.66 2abe s ARG 58 Cb 0.00 0.50 -0.00 0.00 -1.56 0.00 0.00 34.95 33.89 2abe s ARG 58 CO 0.00 -0.60 -0.17 -1.50 -0.81 0.00 0.00 175.30 172.22 2abe s ILE 59 N -3.91 1.43 -0.02 4.11 1.10 -0.50 -0.85 121.20 122.56 2abe s ILE 59 Ca 0.13 -0.72 -0.02 0.00 -0.51 0.00 0.00 60.65 59.53 2abe s ILE 59 Cb -0.01 -1.23 0.00 0.00 0.15 0.00 0.00 42.46 41.37 2abe s ILE 59 CO 0.01 0.41 0.05 -0.22 -2.11 0.00 0.00 174.94 173.08 2abe s LEU 60 N 0.05 1.81 -0.45 8.50 2.96 0.12 -1.27 118.68 130.40 2abe s LEU 60 Ca -0.04 0.09 -0.17 0.00 -0.22 0.00 0.00 54.13 53.79 2abe s LEU 60 Cb -0.12 0.19 0.04 0.00 0.50 0.00 0.00 46.19 46.80 2abe s LEU 60 CO 0.02 -0.03 0.44 0.21 -1.32 0.00 0.00 176.35 175.67 2abe s ASN 61 N -0.03 6.18 -0.08 3.68 3.84 -0.56 -0.74 114.94 127.23 2abe s ASN 61 Ca -0.01 -0.91 0.12 0.00 0.21 0.00 0.00 52.86 52.28 2abe s ASN 61 Cb -0.01 -2.22 0.50 0.00 -0.55 0.00 0.00 41.25 38.98 2abe s ASN 61 CO 0.00 -0.63 1.36 -0.46 -2.79 0.00 0.00 177.10 174.58 2abe n ASN 62 N 5.54 3.46 0.00 -4.21 0.23 -0.77 -0.37 115.26 119.14 2abe n ASN 62 Ca -0.09 -2.32 0.00 0.00 -0.53 0.00 0.00 54.58 51.64 2abe n ASN 62 Cb 0.46 -0.48 0.00 0.00 -2.08 0.00 0.00 39.78 37.68 2abe n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2abe n GLY 63 N 0.86 1.70 0.00 4.83 0.00 -1.26 -4.75 105.19 106.57 2abe n GLY 63 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2abe n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2abe n HIS 64 N -2.00 0.00 -1.36 1.61 1.44 -1.26 -4.70 115.22 108.95 2abe n HIS 64 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2abe n HIS 64 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2abe n HIS 64 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2abe n ALA 65 N -0.23 0.00 -2.89 1.59 0.00 -1.26 -4.89 120.51 112.83 2abe n ALA 65 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 2abe n ALA 65 Cb 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.32 2abe n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2abe s PHE 66 N -2.44 2.04 -0.06 0.00 -0.12 -1.26 -1.85 117.98 114.30 2abe s PHE 66 Ca 0.00 -0.62 0.01 0.00 -0.05 0.00 0.00 56.93 56.26 2abe s PHE 66 Cb 0.00 -1.36 -0.03 0.00 -0.63 0.00 0.00 43.02 41.00 2abe s PHE 66 CO 0.00 -0.21 -0.05 -0.80 -0.05 0.00 0.00 175.22 174.11 2abe s ASN 67 N 0.01 4.77 -0.30 1.98 0.02 0.08 -4.31 114.94 117.21 2abe s ASN 67 Ca -0.05 -0.01 -0.07 0.00 -1.02 0.00 0.00 52.86 51.71 2abe s ASN 67 Cb -0.13 -1.22 0.01 0.00 0.02 0.00 0.00 41.25 39.93 2abe s ASN 67 CO 0.03 0.35 0.08 -0.69 0.02 0.00 0.00 177.10 176.90 2abe s VAL 68 N -0.86 3.97 -0.03 1.60 1.01 -0.65 -0.70 120.40 124.74 2abe s VAL 68 Ca 0.14 -0.71 -0.09 0.00 0.00 0.00 0.00 61.98 61.32 2abe s VAL 68 Cb -0.11 -3.06 -0.05 0.00 0.00 0.00 0.00 36.38 33.16 2abe s VAL 68 CO 0.03 0.07 0.28 -1.61 0.00 0.00 0.00 175.10 173.86 2abe s GLU 69 N 1.50 3.65 0.26 2.72 2.02 -0.03 -2.04 118.70 126.78 2abe s GLU 69 Ca 0.02 0.07 0.11 0.00 0.02 0.00 0.00 54.97 55.19 2abe s GLU 69 Cb -0.17 -3.15 -0.05 0.00 0.10 0.00 0.00 34.13 30.86 2abe s GLU 69 CO 0.03 0.70 -0.10 -0.06 0.02 0.00 0.00 175.26 175.84 2abe s PHE 70 N -1.16 2.51 -0.26 1.61 0.40 -0.40 -0.10 117.98 120.58 2abe s PHE 70 Ca 0.23 -0.27 -0.29 0.00 -0.60 0.00 0.00 56.93 56.00 2abe s PHE 70 Cb -0.14 -1.12 0.01 0.00 0.51 0.00 0.00 43.02 42.28 2abe s PHE 70 CO 0.12 0.64 1.13 0.34 0.70 0.00 0.00 175.22 178.15 2abe s ASP 71 N -3.46 6.96 -0.22 1.36 2.15 -0.28 -4.84 116.67 118.34 2abe s ASP 71 Ca 0.30 1.31 0.12 0.00 0.43 0.00 0.00 52.55 54.71 2abe s ASP 71 Cb -0.06 -2.54 0.43 0.00 -0.30 0.00 0.00 42.92 40.45 2abe s ASP 71 CO 0.17 -0.81 1.29 -0.90 -0.17 0.00 0.00 175.17 174.75 2abe n ASP 72 N 6.73 2.13 -0.10 -0.34 5.75 -1.26 -4.63 116.55 124.83 2abe n ASP 72 Ca 0.13 -3.71 0.15 0.00 -0.01 0.00 0.00 54.79 51.35 2abe n ASP 72 Cb 0.46 -0.55 0.76 0.00 -1.03 0.00 0.00 41.12 40.76 2abe n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2abe n SER 73 N -1.13 0.34 -3.97 -1.12 3.41 -1.26 -4.85 113.62 105.04 2abe n SER 73 Ca 0.23 -0.79 -0.09 0.00 -0.26 0.00 0.00 58.87 57.96 2abe n SER 73 Cb 0.79 -0.07 -0.05 0.00 -0.26 0.00 0.00 64.21 64.62 2abe n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2abe s GLN 74 N -2.24 1.53 -1.47 4.33 -0.21 -1.26 -5.06 119.66 115.28 2abe s GLN 74 Ca 0.37 -1.20 -0.11 0.00 0.02 0.00 0.00 55.36 54.45 2abe s GLN 74 Cb 0.21 0.48 0.03 0.00 1.00 0.00 0.00 33.01 34.73 2abe s GLN 74 CO 0.41 -0.64 2.44 -0.25 -2.12 0.00 0.00 175.29 175.13 2abe n ASP 75 N -0.38 6.29 0.07 5.90 8.00 -1.26 -4.59 116.55 130.59 2abe n ASP 75 Ca -0.03 -2.84 -0.22 0.00 0.71 0.00 0.00 54.79 52.41 2abe n ASP 75 Cb 0.62 -1.55 -0.15 0.00 -0.02 0.00 0.00 41.12 40.01 2abe n ASP 75 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2abe h LYS 76 N 5.43 0.38 -4.00 -1.24 1.57 -1.86 -3.43 116.57 113.42 2abe h LYS 76 Ca 0.66 -0.64 -0.58 0.00 -1.87 0.00 0.00 60.65 58.22 2abe h LYS 76 Cb 0.47 0.24 -0.39 0.00 0.08 0.00 0.00 32.23 32.63 2abe h LYS 76 CO 1.76 1.31 -0.77 0.00 -0.57 0.00 0.00 179.45 181.17 2abe s ALA 77 N -2.51 1.61 0.15 3.86 0.00 -1.26 -3.60 121.76 120.01 2abe s ALA 77 Ca -0.14 -1.20 0.07 0.00 0.00 0.00 0.00 51.96 50.69 2abe s ALA 77 Cb 0.03 -1.38 -0.04 0.00 0.00 0.00 0.00 23.12 21.73 2abe s ALA 77 CO 0.86 -1.25 -0.16 0.14 0.00 0.00 0.00 175.76 175.34 2abe s VAL 78 N 1.56 1.61 -0.08 0.00 -7.23 -0.75 -1.46 120.40 114.05 2abe s VAL 78 Ca -0.02 -1.89 0.04 0.00 -1.81 0.00 0.00 61.98 58.30 2abe s VAL 78 Cb -0.18 -1.76 0.00 0.00 0.56 0.00 0.00 36.38 35.01 2abe s VAL 78 CO -0.09 -0.40 -0.20 -0.22 -0.31 0.00 0.00 175.10 173.88 2abe s LEU 79 N -2.68 1.94 0.00 1.32 2.96 0.35 -1.28 118.68 121.29 2abe s LEU 79 Ca 0.14 -0.46 -0.01 0.00 -0.22 0.00 0.00 54.13 53.58 2abe s LEU 79 Cb -0.05 -1.19 0.01 0.00 0.50 0.00 0.00 46.19 45.46 2abe s LEU 79 CO 0.05 0.13 0.48 2.29 -1.32 0.00 0.00 176.35 177.98 2abe n LYS 80 N 3.50 0.69 0.00 1.98 2.85 -0.22 -1.79 118.16 125.18 2abe n LYS 80 Ca -0.20 -2.91 0.00 0.00 -1.05 0.00 0.00 58.31 54.15 2abe n LYS 80 Cb 0.53 2.76 0.00 0.00 -0.65 0.00 0.00 35.03 37.67 2abe n LYS 80 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2abe n GLY 81 N -0.60 -0.79 7.00 2.58 0.00 -1.26 -0.75 105.19 111.37 2abe n GLY 81 Ca 0.01 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.87 2abe n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2abe n GLY 82 N 0.00 2.73 0.40 -0.02 0.00 -0.83 -1.37 105.19 106.10 2abe n GLY 82 Ca 0.00 -0.35 0.10 0.00 0.00 0.00 0.00 46.02 45.77 2abe n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2abe n PRO 83 N 13.91 1.53 -2.93 1.61 -0.04 -1.26 -3.51 135.00 144.30 2abe n PRO 83 Ca 0.00 -0.79 -0.32 0.00 -0.04 0.00 0.00 63.50 62.34 2abe n PRO 83 Cb 0.00 -1.37 -0.06 0.00 -0.04 0.00 0.00 33.50 32.03 2abe n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2abe s LEU 84 N -1.60 3.96 -0.29 1.53 1.43 -0.47 -5.05 118.68 118.19 2abe s LEU 84 Ca 0.32 1.46 0.02 0.00 -1.03 0.00 0.00 54.13 54.90 2abe s LEU 84 Cb 0.16 -4.30 0.08 0.00 0.03 0.00 0.00 46.19 42.16 2abe s LEU 84 CO 0.25 -0.31 0.00 -1.81 0.23 0.00 0.00 176.35 174.72 2abe s ASP 85 N -2.35 4.23 0.00 2.29 1.01 -1.26 -4.45 116.67 116.14 2abe s ASP 85 Ca 0.58 -1.60 0.00 0.00 0.71 0.00 0.00 52.55 52.24 2abe s ASP 85 Cb -0.10 -1.29 0.00 0.00 1.01 0.00 0.00 42.92 42.54 2abe s ASP 85 CO 0.18 -0.31 0.00 0.61 0.21 0.00 0.00 175.17 175.85 2abe n GLY 86 N 4.55 -0.83 3.62 0.21 0.00 -1.26 -5.02 105.19 106.46 2abe n GLY 86 Ca -0.05 -2.22 -0.34 0.00 0.00 0.00 0.00 46.02 43.41 2abe n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2abe s THR 87 N -0.33 4.23 -0.14 2.61 2.01 -1.26 -4.59 115.64 118.17 2abe s THR 87 Ca 0.00 -0.26 0.02 0.00 0.31 0.00 0.00 61.69 61.76 2abe s THR 87 Cb 0.00 -2.81 0.01 0.00 0.01 0.00 0.00 72.50 69.71 2abe s THR 87 CO 0.00 0.56 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.96 2abe s TYR 88 N -0.40 2.67 -0.05 4.92 1.51 -0.74 -1.41 117.35 123.86 2abe s TYR 88 Ca 0.07 -1.25 -0.18 0.00 -1.01 0.00 0.00 57.07 54.70 2abe s TYR 88 Cb -0.12 -1.81 -0.05 0.00 -0.11 0.00 0.00 41.96 39.87 2abe s TYR 88 CO 0.02 -0.56 0.48 1.03 -1.11 0.00 0.00 175.55 175.41 2abe s ARG 89 N 0.73 4.20 0.13 -0.62 0.52 -0.46 -0.49 118.95 122.96 2abe s ARG 89 Ca -0.09 0.51 -0.31 0.00 -0.52 0.00 0.00 55.73 55.32 2abe s ARG 89 Cb -0.16 -3.34 -0.08 0.00 0.52 0.00 0.00 34.95 31.89 2abe s ARG 89 CO 0.00 0.39 1.34 -1.17 0.02 0.00 0.00 175.30 175.88 2abe s LEU 90 N -0.16 4.38 -0.06 2.53 2.96 -0.54 -1.44 118.68 126.36 2abe s LEU 90 Ca 0.26 2.29 0.02 0.00 -0.22 0.00 0.00 54.13 56.48 2abe s LEU 90 Cb -0.16 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 42.89 2abe s LEU 90 CO 0.13 -0.59 -0.04 0.00 -1.32 0.00 0.00 176.35 174.54 2abe n ILE 91 N 3.58 0.37 -3.52 6.68 0.00 0.26 -4.59 119.36 122.14 2abe n ILE 91 Ca 0.10 -0.17 -0.08 0.00 0.00 0.00 0.00 62.75 62.60 2abe n ILE 91 Cb 0.43 -0.77 -0.02 0.00 0.00 0.00 0.00 39.64 39.28 2abe n ILE 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2abe s GLN 92 N -2.13 0.73 0.07 9.51 1.03 -1.22 -1.28 119.66 126.37 2abe s GLN 92 Ca -0.07 -0.21 0.03 0.00 0.04 0.00 0.00 55.36 55.15 2abe s GLN 92 Cb 0.02 0.34 -0.03 0.00 0.03 0.00 0.00 33.01 33.37 2abe s GLN 92 CO 0.17 -0.31 -0.09 -0.59 -2.54 0.00 0.00 175.29 171.93 2abe s PHE 93 N -2.74 0.89 0.30 9.60 -0.12 -0.86 -0.77 117.98 124.26 2abe s PHE 93 Ca 0.04 -0.60 -0.14 0.00 -0.05 0.00 0.00 56.93 56.18 2abe s PHE 93 Cb -0.01 -0.51 0.01 0.00 -0.63 0.00 0.00 43.02 41.89 2abe s PHE 93 CO -0.07 -0.05 0.60 -3.38 -0.05 0.00 0.00 175.22 172.27 2abe s HIS 94 N -2.02 0.27 0.30 3.49 -3.43 -0.68 -1.63 115.29 111.58 2abe s HIS 94 Ca -0.01 -0.69 0.05 0.00 -0.80 0.00 0.00 55.06 53.60 2abe s HIS 94 Cb -0.06 0.41 -0.06 0.00 -1.43 0.00 0.00 32.58 31.45 2abe s HIS 94 CO -0.00 -1.19 0.00 -0.06 -2.00 0.00 0.00 174.74 171.49 2abe s PHE 95 N -3.54 1.96 -0.04 0.38 0.40 -1.26 -0.57 117.98 115.31 2abe s PHE 95 Ca 0.19 -0.83 0.02 0.00 -0.60 0.00 0.00 56.93 55.71 2abe s PHE 95 Cb -0.03 -1.22 0.01 0.00 0.51 0.00 0.00 43.02 42.29 2abe s PHE 95 CO 0.10 0.14 -0.09 -1.01 0.70 0.00 0.00 175.22 175.07 2abe s HIS 96 N -3.15 1.04 0.18 0.36 3.76 -0.53 -4.76 115.29 112.18 2abe s HIS 96 Ca 0.33 -0.30 -0.06 0.00 -0.15 0.00 0.00 55.06 54.88 2abe s HIS 96 Cb 0.07 -0.77 -0.02 0.00 1.11 0.00 0.00 32.58 32.96 2abe s HIS 96 CO 0.14 -0.16 0.23 1.67 -0.85 0.00 0.00 174.74 175.77 2abe s TRP 97 N 0.44 0.64 0.52 1.40 -2.14 -1.22 -0.91 118.94 117.67 2abe s TRP 97 Ca -0.08 -0.98 0.06 0.00 2.66 0.00 0.00 56.10 57.76 2abe s TRP 97 Cb -0.12 -0.21 0.06 0.00 -3.10 0.00 0.00 33.47 30.10 2abe s TRP 97 CO 0.01 -0.70 0.48 0.41 -2.66 0.00 0.00 176.95 174.49 2abe n GLY 98 N -0.22 2.55 0.02 3.67 0.00 -1.19 -1.09 105.19 108.92 2abe n GLY 98 Ca -0.04 -2.27 0.12 0.00 0.00 0.00 0.00 46.02 43.83 2abe n GLY 98 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2abe n SER 99 N -1.99 0.50 -4.12 1.61 3.41 -1.26 -4.30 113.62 107.47 2abe n SER 99 Ca 0.03 -0.04 -0.08 0.00 -0.26 0.00 0.00 58.87 58.51 2abe n SER 99 Cb 0.58 0.13 -0.10 0.00 -0.26 0.00 0.00 64.21 64.56 2abe n SER 99 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2abe s LEU 100 N -3.38 2.46 0.51 1.04 1.43 -1.26 -5.05 118.68 114.42 2abe s LEU 100 Ca 0.10 -1.01 0.33 0.00 -1.03 0.00 0.00 54.13 52.51 2abe s LEU 100 Cb 0.16 0.12 1.41 0.00 0.03 0.00 0.00 46.19 47.92 2abe s LEU 100 CO 0.69 -0.57 1.97 0.44 0.23 0.00 0.00 176.35 179.11 2abe h ASP 101 N 3.08 0.00 -0.00 2.29 3.32 -1.92 -3.04 116.42 120.14 2abe h ASP 101 Ca -0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.71 2abe h ASP 101 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 2abe h ASP 101 CO 0.65 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.78 2abe n GLY 102 N -0.12 -0.96 3.42 2.75 0.00 -1.26 -3.58 105.19 105.44 2abe n GLY 102 Ca 0.00 -0.20 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 2abe n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2abe s GLN 103 N -2.00 1.24 0.00 1.61 -2.07 -1.15 -4.70 119.66 112.58 2abe s GLN 103 Ca 0.46 -0.98 0.00 0.00 -1.82 0.00 0.00 55.36 53.02 2abe s GLN 103 Cb 0.21 0.45 0.00 0.00 -1.09 0.00 0.00 33.01 32.58 2abe s GLN 103 CO 0.35 -0.49 0.00 0.41 -1.32 0.00 0.00 175.29 174.24 2abe n GLY 104 N -0.27 2.85 3.84 2.60 0.00 -1.04 -3.14 105.19 110.03 2abe n GLY 104 Ca -0.10 -0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 2abe n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2abe s SER 105 N 0.00 5.83 -0.20 1.61 1.04 -0.61 -3.45 113.70 117.93 2abe s SER 105 Ca 0.00 1.57 -0.17 0.00 0.48 0.00 0.00 55.95 57.83 2abe s SER 105 Cb 0.00 -2.49 -0.14 0.00 0.10 0.00 0.00 66.02 63.49 2abe s SER 105 CO 0.00 -1.14 0.01 -0.62 0.98 0.00 0.00 173.24 172.48 2abe n GLU 106 N -2.72 0.54 -2.28 4.02 1.02 -1.26 -4.83 120.64 115.13 2abe n GLU 106 Ca 0.07 0.51 -0.33 0.00 -0.02 0.00 0.00 57.16 57.39 2abe n GLU 106 Cb 0.54 -1.69 -0.02 0.00 -0.02 0.00 0.00 31.44 30.25 2abe n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2abe s HIS 107 N -2.38 3.21 0.14 -0.32 3.76 -1.26 -4.51 115.29 113.93 2abe s HIS 107 Ca -0.27 1.50 0.05 0.00 -0.15 0.00 0.00 55.06 56.19 2abe s HIS 107 Cb 0.06 -2.91 -0.04 0.00 1.11 0.00 0.00 32.58 30.80 2abe s HIS 107 CO 0.48 -0.71 -0.11 0.95 -0.85 0.00 0.00 174.74 174.50 2abe s THR 108 N -2.48 1.19 -0.21 1.30 -4.23 -1.21 -4.72 115.64 105.27 2abe s THR 108 Ca 0.62 -1.95 0.02 0.00 -1.18 0.00 0.00 61.69 59.19 2abe s THR 108 Cb -0.13 -1.73 0.04 0.00 1.34 0.00 0.00 72.50 72.02 2abe s THR 108 CO 0.32 -0.66 -0.15 -0.69 -0.54 0.00 0.00 174.62 172.90 2abe s VAL 109 N -2.98 2.01 -1.49 2.29 1.01 -0.88 -0.08 120.40 120.28 2abe s VAL 109 Ca 0.14 -1.19 -0.09 0.00 0.00 0.00 0.00 61.98 60.84 2abe s VAL 109 Cb 0.00 -1.97 0.06 0.00 0.00 0.00 0.00 36.38 34.47 2abe s VAL 109 CO 0.01 0.27 0.78 0.47 0.00 0.00 0.00 175.10 176.64 2abe n ASP 110 N 4.57 -2.89 0.00 3.32 8.00 0.00 -0.29 116.55 129.27 2abe n ASP 110 Ca -0.17 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 54.46 2abe n ASP 110 Cb 0.47 -3.57 0.00 0.00 -0.02 0.00 0.00 41.12 37.99 2abe n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2abe n LYS 111 N -4.49 0.00 -2.73 -1.24 4.76 -1.26 -4.99 118.16 108.20 2abe n LYS 111 Ca -0.10 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 54.93 2abe n LYS 111 Cb 0.58 -3.19 -0.03 0.00 -1.84 0.00 0.00 35.03 30.56 2abe n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2abe s LYS 112 N -0.34 4.55 -0.09 1.97 2.20 0.61 -5.01 119.74 123.62 2abe s LYS 112 Ca 0.00 1.38 -0.06 0.00 -0.36 0.00 0.00 55.97 56.94 2abe s LYS 112 Cb 0.00 -3.46 -0.04 0.00 -1.51 0.00 0.00 37.83 32.82 2abe s LYS 112 CO 0.00 -0.04 0.13 0.15 -0.36 0.00 0.00 175.35 175.23 2abe s LYS 113 N 0.99 3.39 0.36 4.03 1.02 -1.26 -2.06 119.74 126.21 2abe s LYS 113 Ca 0.51 -0.20 0.07 0.00 0.02 0.00 0.00 55.97 56.38 2abe s LYS 113 Cb -0.21 -3.13 -0.02 0.00 -0.52 0.00 0.00 37.83 33.95 2abe s LYS 113 CO 0.27 0.75 0.38 0.71 -0.92 0.00 0.00 175.35 176.54 2abe s TYR 114 N -1.07 2.89 0.36 3.18 2.02 -1.26 -4.73 117.35 118.74 2abe s TYR 114 Ca 0.17 -0.34 0.19 0.00 -0.37 0.00 0.00 57.07 56.72 2abe s TYR 114 Cb -0.12 -1.98 1.01 0.00 -0.40 0.00 0.00 41.96 40.47 2abe s TYR 114 CO 0.07 0.01 1.92 0.00 -1.57 0.00 0.00 175.55 175.98 2abe h ALA 115 N 1.06 1.33 -2.50 3.71 0.00 -1.49 -1.54 119.26 119.84 2abe h ALA 115 Ca -0.44 -0.23 0.13 0.00 0.00 0.00 0.00 54.91 54.37 2abe h ALA 115 Cb 1.26 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.91 2abe h ALA 115 CO 0.56 0.32 0.42 0.00 0.00 0.00 0.00 179.25 180.54 2abe s ALA 116 N -4.16 -1.62 -0.03 0.00 0.00 -1.15 -3.21 121.76 111.60 2abe s ALA 116 Ca -0.02 0.28 -0.01 0.00 0.00 0.00 0.00 51.96 52.21 2abe s ALA 116 Cb 0.14 0.65 0.03 0.00 0.00 0.00 0.00 23.12 23.93 2abe s ALA 116 CO 0.66 -0.94 0.04 -2.00 0.00 0.00 0.00 175.76 173.53 2abe s GLU 117 N -3.40 -0.05 -0.16 0.00 2.12 -0.09 -0.92 118.70 116.22 2abe s GLU 117 Ca 0.09 0.25 -0.14 0.00 0.36 0.00 0.00 54.97 55.54 2abe s GLU 117 Cb -0.02 -0.32 -0.05 0.00 0.26 0.00 0.00 34.13 34.00 2abe s GLU 117 CO -0.01 -0.22 0.29 -1.17 -0.54 0.00 0.00 175.26 173.61 2abe s LEU 118 N 1.40 4.25 -0.21 2.70 2.96 0.94 -1.45 118.68 129.27 2abe s LEU 118 Ca -0.05 0.51 0.02 0.00 -0.22 0.00 0.00 54.13 54.38 2abe s LEU 118 Cb -0.13 -2.36 0.04 0.00 0.50 0.00 0.00 46.19 44.24 2abe s LEU 118 CO -0.03 0.12 -0.16 -1.00 -1.32 0.00 0.00 176.35 173.95 2abe s HIS 119 N 0.39 2.90 -0.40 5.38 3.76 0.26 -1.04 115.29 126.54 2abe s HIS 119 Ca 0.16 -1.86 -0.13 0.00 -0.15 0.00 0.00 55.06 53.08 2abe s HIS 119 Cb -0.13 -1.89 0.03 0.00 1.11 0.00 0.00 32.58 31.70 2abe s HIS 119 CO 0.04 -0.82 0.27 -0.51 -0.85 0.00 0.00 174.74 172.86 2abe s LEU 120 N 1.24 5.00 -0.12 0.89 1.02 -0.65 -1.69 118.68 124.37 2abe s LEU 120 Ca -0.00 -1.01 -0.21 0.00 0.02 0.00 0.00 54.13 52.92 2abe s LEU 120 Cb -0.16 -2.10 -0.03 0.00 0.02 0.00 0.00 46.19 43.92 2abe s LEU 120 CO -0.10 -0.45 0.63 -0.69 0.02 0.00 0.00 176.35 175.76 2abe s VAL 121 N 1.61 5.07 0.08 -1.59 1.01 0.05 -1.72 120.40 124.91 2abe s VAL 121 Ca 0.04 1.26 0.06 0.00 0.00 0.00 0.00 61.98 63.33 2abe s VAL 121 Cb -0.20 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 2abe s VAL 121 CO 0.08 0.22 -0.16 -1.00 0.00 0.00 0.00 175.10 174.24 2abe s HIS 122 N 1.12 1.36 0.07 5.22 3.76 -0.23 -0.58 115.29 126.00 2abe s HIS 122 Ca 0.32 -0.44 0.09 0.00 -0.15 0.00 0.00 55.06 54.88 2abe s HIS 122 Cb -0.16 -0.76 -0.03 0.00 1.11 0.00 0.00 32.58 32.73 2abe s HIS 122 CO 0.14 0.09 -0.24 1.67 -0.85 0.00 0.00 174.74 175.55 2abe s TRP 123 N -1.22 2.09 -0.15 1.40 1.48 -0.52 -1.14 118.94 120.88 2abe s TRP 123 Ca 0.00 -0.39 -0.29 0.00 -1.06 0.00 0.00 56.10 54.36 2abe s TRP 123 Cb -0.10 -1.22 -0.05 0.00 -1.16 0.00 0.00 33.47 30.95 2abe s TRP 123 CO 0.03 0.16 1.81 1.21 -4.06 0.00 0.00 176.95 176.10 2abe s ASN 124 N -1.43 6.24 0.60 -2.66 3.84 0.93 -1.36 114.94 121.10 2abe s ASN 124 Ca 0.10 1.96 0.30 0.00 0.21 0.00 0.00 52.86 55.43 2abe s ASN 124 Cb -0.10 -2.53 1.79 0.00 -0.55 0.00 0.00 41.25 39.86 2abe s ASN 124 CO 0.03 -1.32 2.18 0.71 -2.79 0.00 0.00 177.10 175.91 2abe h THR 125 N 6.17 0.45 0.00 -5.21 1.35 -1.58 -2.20 112.91 111.89 2abe h THR 125 Ca -0.39 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 2abe h THR 125 Cb 1.19 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 68.53 2abe h THR 125 CO 0.98 0.00 0.00 2.29 -0.25 0.00 0.00 175.52 178.54 2abe n LYS 127 N -3.74 0.09 -0.25 4.72 2.85 -1.26 -2.08 118.16 118.49 2abe n LYS 127 Ca -0.01 0.44 0.10 0.00 -1.05 0.00 0.00 58.31 57.79 2abe n LYS 127 Cb 0.20 -1.72 0.27 0.00 -0.65 0.00 0.00 35.03 33.13 2abe n LYS 127 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2abe n TYR 128 N -1.90 0.66 0.00 5.58 4.01 -0.83 -4.99 117.16 119.69 2abe n TYR 128 Ca 0.01 -0.33 0.00 0.00 -0.16 0.00 0.00 57.90 57.42 2abe n TYR 128 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 2abe n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2abe n GLY 129 N 1.44 1.34 3.40 2.72 0.00 -0.88 -4.52 105.19 108.69 2abe n GLY 129 Ca 0.20 -0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.12 2abe n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2abe s ASP 130 N 0.00 -0.09 0.25 1.61 1.47 -1.26 -5.05 116.67 113.60 2abe s ASP 130 Ca 0.00 -0.65 -0.03 0.00 1.18 0.00 0.00 52.55 53.05 2abe s ASP 130 Cb 0.00 0.49 0.44 0.00 -0.34 0.00 0.00 42.92 43.51 2abe s ASP 130 CO 0.00 -0.94 1.80 0.15 0.68 0.00 0.00 175.17 176.86 2abe h PHE 131 N 2.41 0.85 -0.87 2.11 3.57 -1.93 -1.51 116.94 121.57 2abe h PHE 131 Ca -0.31 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.30 2abe h PHE 131 Cb 1.24 -0.26 -0.07 0.00 2.79 0.00 0.00 35.95 39.66 2abe h PHE 131 CO 0.38 0.31 0.53 0.78 -2.23 0.00 0.00 178.31 178.08 2abe h GLY 132 N 0.76 1.33 1.81 2.40 0.00 -1.96 -1.46 103.07 105.96 2abe h GLY 132 Ca 0.42 -0.37 -0.21 0.00 0.00 0.00 0.00 47.33 47.17 2abe h GLY 132 CO -0.28 0.22 -0.94 0.50 0.00 0.00 0.00 176.54 176.05 2abe h LYS 133 N 0.93 0.16 -0.29 4.80 1.79 -1.71 -3.25 116.57 119.00 2abe h LYS 133 Ca 0.40 -0.20 0.01 0.00 -2.18 0.00 0.00 60.65 58.68 2abe h LYS 133 Cb 0.25 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 2abe h LYS 133 CO -0.20 0.98 0.19 0.00 -1.08 0.00 0.00 179.45 179.34 2abe h ALA 134 N 0.94 1.83 -0.15 3.86 0.00 -0.26 -1.92 119.26 123.56 2abe h ALA 134 Ca -0.05 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2abe h ALA 134 Cb 1.60 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 2abe h ALA 134 CO 0.14 0.15 0.02 1.33 0.00 0.00 0.00 179.25 180.89 2abe n VAL 135 N -4.49 0.77 -0.31 0.00 0.24 -0.84 -2.67 118.33 111.03 2abe n VAL 135 Ca 0.02 -0.36 0.02 0.00 -2.04 0.00 0.00 64.34 61.98 2abe n VAL 135 Cb 0.09 -0.49 0.03 0.00 -1.47 0.00 0.00 33.84 32.01 2abe n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2abe n GLN 136 N 0.15 2.47 -4.40 7.34 1.13 -0.72 -4.93 117.38 118.41 2abe n GLN 136 Ca 0.08 -1.73 -0.20 0.00 -1.94 0.00 0.00 57.00 53.20 2abe n GLN 136 Cb 0.52 -1.10 -0.14 0.00 0.11 0.00 0.00 30.24 29.63 2abe n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2abe s GLN 137 N -1.43 0.95 0.62 -1.09 -1.52 -1.09 -5.04 119.66 111.07 2abe s GLN 137 Ca 0.08 -0.69 0.39 0.00 -1.95 0.00 0.00 55.36 53.19 2abe s GLN 137 Cb 0.07 -0.95 2.07 0.00 -0.22 0.00 0.00 33.01 33.98 2abe s GLN 137 CO 0.01 0.24 2.26 -1.00 -0.25 0.00 0.00 175.29 176.54 2abe h PRO 138 N 5.12 0.00 0.00 2.91 0.13 -1.87 -2.38 132.00 135.92 2abe h PRO 138 Ca -0.37 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.74 2abe h PRO 138 Cb 1.18 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.26 2abe h PRO 138 CO 0.45 0.01 -0.48 -0.40 -0.23 0.00 0.00 178.00 177.35 2abe n ASP 139 N -3.22 1.68 0.10 1.44 5.75 -1.26 -4.35 116.55 116.69 2abe n ASP 139 Ca -0.02 -3.48 -0.04 0.00 -0.01 0.00 0.00 54.79 51.24 2abe n ASP 139 Cb 0.14 -0.47 0.13 0.00 -1.03 0.00 0.00 41.12 39.88 2abe n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 2abe h GLY 140 N 0.80 0.16 -3.33 6.12 0.00 -1.30 -3.43 103.07 102.10 2abe h GLY 140 Ca -0.03 -0.21 -0.56 0.00 0.00 0.00 0.00 47.33 46.53 2abe h GLY 140 CO 0.01 0.19 -0.79 1.08 0.00 0.00 0.00 176.54 177.03 2abe s LEU 141 N -7.76 2.43 -0.05 3.11 1.43 0.02 -0.05 118.68 117.81 2abe s LEU 141 Ca -0.03 -0.85 -0.01 0.00 -1.03 0.00 0.00 54.13 52.21 2abe s LEU 141 Cb 0.12 -0.91 0.03 0.00 0.03 0.00 0.00 46.19 45.45 2abe s LEU 141 CO 0.79 0.01 0.01 0.00 0.23 0.00 0.00 176.35 177.39 2abe s ALA 142 N -1.89 0.48 -0.12 4.21 0.00 -0.29 -1.01 121.76 123.14 2abe s ALA 142 Ca 0.16 0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.19 2abe s ALA 142 Cb -0.07 -0.58 0.00 0.00 0.00 0.00 0.00 23.12 22.47 2abe s ALA 142 CO 0.07 -0.34 -0.22 0.08 0.00 0.00 0.00 175.76 175.36 2abe s VAL 143 N 1.71 2.22 -0.26 0.00 1.01 -1.04 -1.07 120.40 122.96 2abe s VAL 143 Ca 0.00 -0.95 -0.15 0.00 0.00 0.00 0.00 61.98 60.88 2abe s VAL 143 Cb -0.13 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 2abe s VAL 143 CO -0.03 0.55 0.37 -0.22 0.00 0.00 0.00 175.10 175.77 2abe s LEU 144 N 0.49 4.05 -0.15 3.92 2.96 -0.70 -1.62 118.68 127.62 2abe s LEU 144 Ca -0.14 0.31 -0.05 0.00 -0.22 0.00 0.00 54.13 54.02 2abe s LEU 144 Cb -0.17 -2.43 -0.03 0.00 0.50 0.00 0.00 46.19 44.06 2abe s LEU 144 CO 0.05 -0.17 0.02 -0.83 -1.32 0.00 0.00 176.35 174.10 2abe s GLY 145 N 1.57 1.84 -0.07 7.98 0.00 0.14 -1.64 107.32 117.13 2abe s GLY 145 Ca 0.15 -0.78 0.01 0.00 0.00 0.00 0.00 44.72 44.11 2abe s GLY 145 CO 0.10 -0.12 -0.09 -0.42 0.00 0.00 0.00 173.10 172.57 2abe s ILE 146 N 0.09 0.98 0.35 0.90 1.09 -0.20 -1.08 121.20 123.33 2abe s ILE 146 Ca 0.03 -0.35 -0.23 0.00 -1.10 0.00 0.00 60.65 59.00 2abe s ILE 146 Cb -0.13 -0.94 -0.10 0.00 -1.06 0.00 0.00 42.46 40.23 2abe s ILE 146 CO 0.02 0.33 0.90 -0.36 -0.10 0.00 0.00 174.94 175.73 2abe s PHE 147 N 1.00 3.54 -0.09 3.97 0.08 -1.26 -0.04 117.98 125.17 2abe s PHE 147 Ca -0.09 1.63 0.04 0.00 0.12 0.00 0.00 56.93 58.63 2abe s PHE 147 Cb -0.15 -2.83 -0.01 0.00 -0.57 0.00 0.00 43.02 39.47 2abe s PHE 147 CO -0.00 0.11 -0.22 -0.51 -0.10 0.00 0.00 175.22 174.51 2abe s LEU 148 N -2.49 2.24 0.11 -0.37 1.02 -0.09 -1.16 118.68 117.94 2abe s LEU 148 Ca 0.53 -0.48 0.11 0.00 0.02 0.00 0.00 54.13 54.31 2abe s LEU 148 Cb -0.15 -1.45 -0.04 0.00 0.02 0.00 0.00 46.19 44.58 2abe s LEU 148 CO 0.19 0.19 -0.27 -1.59 0.02 0.00 0.00 176.35 174.90 2abe s LYS 149 N 0.15 1.50 -0.19 1.70 -2.85 -0.35 -2.17 119.74 117.53 2abe s LYS 149 Ca -0.12 -1.29 -0.28 0.00 -1.00 0.00 0.00 55.97 53.29 2abe s LYS 149 Cb -0.16 -1.91 -0.00 0.00 -2.06 0.00 0.00 37.83 33.70 2abe s LYS 149 CO 0.06 0.46 0.96 0.08 0.10 0.00 0.00 175.35 177.01 2abe s VAL 150 N -1.00 4.77 0.00 1.79 1.01 -1.26 -0.76 120.40 124.96 2abe s VAL 150 Ca 0.13 1.88 0.00 0.00 0.00 0.00 0.00 61.98 64.00 2abe s VAL 150 Cb -0.10 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.03 2abe s VAL 150 CO 0.05 -0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.69 2abe n GLY 151 N 3.35 0.29 3.84 4.51 0.00 0.11 -4.88 105.19 112.42 2abe n GLY 151 Ca 0.09 0.48 -0.33 0.00 0.00 0.00 0.00 46.02 46.26 2abe n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2abe s SER 152 N 2.00 6.82 0.55 1.61 0.01 -1.26 -4.14 113.70 119.29 2abe s SER 152 Ca 0.00 1.25 -0.21 0.00 1.31 0.00 0.00 55.95 58.30 2abe s SER 152 Cb 0.00 -2.36 -0.05 0.00 0.21 0.00 0.00 66.02 63.83 2abe s SER 152 CO 0.00 -0.11 1.29 0.00 0.41 0.00 0.00 173.24 174.83 2abe s ALA 153 N -1.81 2.74 -0.40 1.44 0.00 -1.26 -2.28 121.76 120.20 2abe s ALA 153 Ca 0.49 1.19 -0.10 0.00 0.00 0.00 0.00 51.96 53.54 2abe s ALA 153 Cb -0.12 -3.51 0.06 0.00 0.00 0.00 0.00 23.12 19.54 2abe s ALA 153 CO 0.19 -1.23 0.24 0.21 0.00 0.00 0.00 175.76 175.17 2abe s LYS 154 N -3.00 2.71 0.16 0.00 2.47 -1.24 -4.79 119.74 116.05 2abe s LYS 154 Ca 0.72 -1.29 -0.20 0.00 -1.56 0.00 0.00 55.97 53.64 2abe s LYS 154 Cb -0.36 -3.76 0.08 0.00 -1.46 0.00 0.00 37.83 32.33 2abe s LYS 154 CO 0.42 -0.84 1.63 -1.35 0.16 0.00 0.00 175.35 175.36 2abe h PRO 155 N 8.43 -0.16 0.00 4.03 0.11 -1.92 -1.89 132.00 140.59 2abe h PRO 155 Ca -0.24 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.88 2abe h PRO 155 Cb 1.09 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2abe h PRO 155 CO 0.72 -0.11 0.08 0.41 -0.21 0.00 0.00 178.00 178.89 2abe n GLY 156 N -1.38 -0.81 0.09 -0.55 0.00 -1.26 -1.87 105.19 99.41 2abe n GLY 156 Ca 0.01 0.19 0.05 0.00 0.00 0.00 0.00 46.02 46.27 2abe n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2abe n LEU 157 N -2.23 0.67 -0.20 0.99 7.94 -0.72 -4.36 117.00 119.10 2abe n LEU 157 Ca -0.01 0.28 0.17 0.00 -1.11 0.00 0.00 56.01 55.34 2abe n LEU 157 Cb 0.11 0.04 0.51 0.00 0.53 0.00 0.00 43.42 44.61 2abe n LEU 157 CO 0.09 0.02 1.22 -0.61 -1.11 0.00 0.00 177.39 177.00 2abe h GLN 158 N 0.00 0.39 -0.78 1.96 5.75 -1.36 -0.49 115.11 120.58 2abe h GLN 158 Ca -0.10 -0.02 0.01 0.00 -0.15 0.00 0.00 58.65 58.38 2abe h GLN 158 Cb 1.33 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.75 2abe h GLN 158 CO 0.02 0.26 0.52 -0.22 -2.65 0.00 0.00 178.83 176.76 2abe h LYS 159 N 0.40 1.02 -0.12 1.69 3.64 -1.76 -0.44 116.57 121.00 2abe h LYS 159 Ca 0.41 -0.06 -0.13 0.00 -1.27 0.00 0.00 60.65 59.60 2abe h LYS 159 Cb 1.00 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 2abe h LYS 159 CO -0.14 0.68 -0.43 0.28 -2.27 0.00 0.00 179.45 177.56 2abe h VAL 160 N 1.05 1.36 -0.93 2.00 2.07 -1.39 -3.26 116.25 117.16 2abe h VAL 160 Ca 0.29 -1.74 0.07 0.00 0.82 0.00 0.00 66.70 66.14 2abe h VAL 160 Cb -0.11 2.12 -0.07 0.00 -1.52 0.00 0.00 31.29 31.71 2abe h VAL 160 CO -0.06 0.52 0.58 0.58 0.02 0.00 0.00 177.57 179.21 2abe h VAL 161 N 0.12 1.04 0.00 2.57 2.07 -0.73 -2.72 116.25 118.60 2abe h VAL 161 Ca -0.02 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 2abe h VAL 161 Cb 1.06 -0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.73 2abe h VAL 161 CO 0.09 0.19 -0.17 0.44 0.02 0.00 0.00 177.57 178.15 2abe h ASP 162 N 1.04 0.00 0.49 0.57 3.32 -1.15 -3.13 116.42 117.57 2abe h ASP 162 Ca 0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.46 2abe h ASP 162 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 2abe h ASP 162 CO -0.19 0.17 -0.48 0.55 -1.72 0.00 0.00 179.24 177.57 2abe n VAL 163 N -3.33 0.00 -0.06 -1.35 3.14 -1.03 -4.29 118.33 111.42 2abe n VAL 163 Ca 0.00 -0.01 0.11 0.00 -2.96 0.00 0.00 64.34 61.49 2abe n VAL 163 Cb 0.40 0.25 0.50 0.00 -1.06 0.00 0.00 33.84 33.92 2abe n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2abe h LEU 164 N 0.06 0.35 -2.13 6.55 3.38 -1.51 -1.88 115.31 120.14 2abe h LEU 164 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2abe h LEU 164 Cb 0.50 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 2abe h LEU 164 CO 0.00 0.22 -0.02 0.44 0.09 0.00 0.00 178.44 179.17 2abe h ASP 165 N 0.40 0.00 0.88 -0.43 3.32 -1.81 -1.98 116.42 116.80 2abe h ASP 165 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 2abe h ASP 165 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 2abe h ASP 165 CO -0.06 0.02 -0.13 -1.54 -1.72 0.00 0.00 179.24 175.81 2abe n SER 166 N -4.23 0.14 -2.47 6.45 3.41 -0.71 -3.78 113.62 112.44 2abe n SER 166 Ca -0.03 0.31 -0.12 0.00 -0.26 0.00 0.00 58.87 58.77 2abe n SER 166 Cb 0.11 -0.31 0.03 0.00 -0.26 0.00 0.00 64.21 63.78 2abe n SER 166 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2abe n ILE 167 N -1.51 1.83 -0.34 -1.33 -5.35 -0.76 -4.72 119.36 107.18 2abe n ILE 167 Ca 0.07 -3.59 0.01 0.00 -0.27 0.00 0.00 62.75 58.97 2abe n ILE 167 Cb 0.34 0.10 0.15 0.00 -1.74 0.00 0.00 39.64 38.49 2abe n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2abe h LYS 168 N 2.46 1.07 -6.23 6.28 3.64 -1.61 -3.42 116.57 118.75 2abe h LYS 168 Ca 0.10 -0.06 -0.56 0.00 -1.27 0.00 0.00 60.65 58.86 2abe h LYS 168 Cb 1.35 -0.24 -0.08 0.00 -0.41 0.00 0.00 32.23 32.85 2abe h LYS 168 CO 0.48 0.71 -0.59 0.95 -2.27 0.00 0.00 179.45 178.72 2abe s THR 169 N -6.06 4.05 0.15 1.00 -4.23 -1.26 -0.50 115.64 108.79 2abe s THR 169 Ca -0.13 -1.45 -0.34 0.00 -1.18 0.00 0.00 61.69 58.59 2abe s THR 169 Cb 0.19 -3.12 -0.15 0.00 1.34 0.00 0.00 72.50 70.76 2abe s THR 169 CO 0.80 -0.24 1.33 1.17 -0.54 0.00 0.00 174.62 177.14 2abe n LYS 170 N -0.66 1.45 0.00 3.99 4.81 -0.28 -2.20 118.16 125.27 2abe n LYS 170 Ca -0.08 0.52 0.00 0.00 -0.87 0.00 0.00 58.31 57.88 2abe n LYS 170 Cb 0.57 -2.14 0.00 0.00 0.02 0.00 0.00 35.03 33.48 2abe n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2abe n GLY 171 N 2.44 3.29 3.76 3.14 0.00 0.50 -4.48 105.19 113.86 2abe n GLY 171 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 2abe n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2abe s LYS 172 N -0.78 4.61 0.07 1.61 1.02 -0.94 -4.87 119.74 120.47 2abe s LYS 172 Ca 0.00 1.57 -0.00 0.00 0.02 0.00 0.00 55.97 57.55 2abe s LYS 172 Cb 0.00 -3.03 -0.04 0.00 -0.52 0.00 0.00 37.83 34.24 2abe s LYS 172 CO 0.00 0.26 -0.03 -1.54 -0.92 0.00 0.00 175.35 173.11 2abe s SER 173 N -1.23 0.63 -0.04 2.83 1.04 -1.26 -1.49 113.70 114.18 2abe s SER 173 Ca 0.47 -1.01 -0.15 0.00 0.48 0.00 0.00 55.95 55.74 2abe s SER 173 Cb -0.26 0.18 0.03 0.00 0.10 0.00 0.00 66.02 66.07 2abe s SER 173 CO 0.33 -0.58 0.33 0.00 0.98 0.00 0.00 173.24 174.30 2abe s ALA 174 N -3.86 -0.83 0.34 5.32 0.00 -0.39 -4.95 121.76 117.39 2abe s ALA 174 Ca 0.09 0.47 -0.29 0.00 0.00 0.00 0.00 51.96 52.23 2abe s ALA 174 Cb 0.07 -0.04 -0.11 0.00 0.00 0.00 0.00 23.12 23.04 2abe s ALA 174 CO -0.08 -0.25 1.55 -0.25 0.00 0.00 0.00 175.76 176.73 2abe n ASP 175 N 1.54 3.89 -3.06 0.00 8.00 -1.26 -1.41 116.55 124.25 2abe n ASP 175 Ca -0.20 1.19 -0.17 0.00 0.71 0.00 0.00 54.79 56.32 2abe n ASP 175 Cb 0.56 -1.62 -0.04 0.00 -0.02 0.00 0.00 41.12 40.01 2abe n ASP 175 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2abe n PHE 176 N 1.21 -2.00 -3.29 1.24 7.35 -0.84 -4.76 117.46 116.37 2abe n PHE 176 Ca 0.04 -2.58 -0.21 0.00 -0.76 0.00 0.00 57.45 53.94 2abe n PHE 176 Cb 0.38 0.67 0.00 0.00 0.35 0.00 0.00 39.48 40.89 2abe n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2abe s THR 177 N 0.09 4.29 -1.46 -2.13 -4.23 -1.26 -3.21 115.64 107.72 2abe s THR 177 Ca 0.33 -0.71 -0.05 0.00 -1.18 0.00 0.00 61.69 60.08 2abe s THR 177 Cb 0.10 -3.54 0.02 0.00 1.34 0.00 0.00 72.50 70.42 2abe s THR 177 CO -0.15 -0.30 0.46 0.59 -0.54 0.00 0.00 174.62 174.67 2abe n ASN 178 N -1.83 -5.27 -4.73 3.99 4.13 -1.26 -4.96 115.26 105.33 2abe n ASN 178 Ca -0.01 -0.24 -0.37 0.00 1.68 0.00 0.00 54.58 55.64 2abe n ASN 178 Cb 0.58 -4.31 -0.07 0.00 -1.54 0.00 0.00 39.78 34.44 2abe n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 2abe s PHE 179 N -3.05 3.49 -0.40 3.10 5.36 -1.26 -5.02 117.98 120.20 2abe s PHE 179 Ca 0.27 0.70 -0.15 0.00 -0.96 0.00 0.00 56.93 56.79 2abe s PHE 179 Cb -0.13 -2.40 0.01 0.00 -0.34 0.00 0.00 43.02 40.17 2abe s PHE 179 CO 0.33 0.24 0.30 0.34 -1.46 0.00 0.00 175.22 174.97 2abe s ASP 180 N 0.43 6.11 0.43 6.13 -1.08 -1.26 -4.47 116.67 122.96 2abe s ASP 180 Ca 0.20 -0.81 0.30 0.00 -0.52 0.00 0.00 52.55 51.72 2abe s ASP 180 Cb -0.14 -2.16 1.40 0.00 -1.46 0.00 0.00 42.92 40.56 2abe s ASP 180 CO 0.06 -0.43 1.90 1.55 0.52 0.00 0.00 175.17 178.77 2abe h PRO 181 N 8.62 0.00 0.00 4.34 0.13 -1.97 -2.85 132.00 140.27 2abe h PRO 181 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2abe h PRO 181 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2abe h PRO 181 CO 0.72 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.49 2abe h ARG 182 N 0.00 0.00 0.00 0.86 3.08 -1.93 -0.76 114.38 115.63 2abe h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2abe h ARG 182 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2abe h ARG 182 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 2abe n GLY 183 N -0.98 -1.05 0.80 0.04 0.00 -1.08 -3.02 105.19 99.91 2abe n GLY 183 Ca -0.03 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 45.98 2abe n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2abe n LEU 184 N -1.30 2.73 -4.81 0.99 4.77 -0.29 -4.42 117.00 114.67 2abe n LEU 184 Ca 0.10 -1.18 -0.38 0.00 -0.03 0.00 0.00 56.01 54.52 2abe n LEU 184 Cb 0.19 -0.07 -0.06 0.00 -2.33 0.00 0.00 43.42 41.15 2abe n LEU 184 CO 0.18 0.53 0.33 -0.76 -1.33 0.00 0.00 177.39 176.33 2abe s LEU 185 N -1.45 4.51 1.06 2.23 1.43 -1.17 -4.94 118.68 120.36 2abe s LEU 185 Ca 0.25 1.35 -0.16 0.00 -1.03 0.00 0.00 54.13 54.54 2abe s LEU 185 Cb 0.16 -3.09 0.22 0.00 0.03 0.00 0.00 46.19 43.52 2abe s LEU 185 CO 0.24 0.22 1.16 -2.16 0.23 0.00 0.00 176.35 176.04 2abe s PRO 186 N -1.28 -0.11 0.04 1.29 0.04 -1.26 -4.97 135.00 128.74 2abe s PRO 186 Ca 0.33 -0.00 -0.19 0.00 0.04 0.00 0.00 61.00 61.18 2abe s PRO 186 Cb -0.20 -1.72 -0.16 0.00 0.04 0.00 0.00 34.50 32.46 2abe s PRO 186 CO 0.21 -2.99 1.27 1.05 0.04 0.00 0.00 177.00 176.58 2abe h GLU 187 N -2.06 0.47 -6.22 4.56 4.11 -1.92 -3.44 114.58 110.07 2abe h GLU 187 Ca -0.47 -0.33 -0.57 0.00 0.07 0.00 0.00 59.36 58.06 2abe h GLU 187 Cb 1.29 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.55 2abe h GLU 187 CO 0.44 0.94 -0.19 0.45 0.07 0.00 0.00 179.01 180.72 2abe s SER 188 N -6.47 6.67 -0.21 3.06 0.15 -1.26 -5.00 113.70 110.64 2abe s SER 188 Ca -0.13 0.87 0.15 0.00 0.70 0.00 0.00 55.95 57.53 2abe s SER 188 Cb 0.05 -2.21 0.57 0.00 -1.71 0.00 0.00 66.02 62.73 2abe s SER 188 CO 0.80 0.10 1.50 0.18 1.20 0.00 0.00 173.24 177.02 2abe n LEU 189 N 0.64 4.31 -4.76 3.45 4.77 -1.26 -4.71 117.00 119.43 2abe n LEU 189 Ca -0.05 -3.14 -0.38 0.00 -0.03 0.00 0.00 56.01 52.41 2abe n LEU 189 Cb 0.52 -0.59 0.01 0.00 -2.33 0.00 0.00 43.42 41.03 2abe n LEU 189 CO 0.43 0.76 0.92 -1.81 -1.33 0.00 0.00 177.39 176.37 2abe s ASP 190 N -1.84 5.80 0.27 -1.43 1.01 -1.26 -4.77 116.67 114.45 2abe s ASP 190 Ca 0.45 2.57 -0.13 0.00 0.71 0.00 0.00 52.55 56.15 2abe s ASP 190 Cb 0.37 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.68 2abe s ASP 190 CO 0.09 -1.19 0.53 -0.72 0.21 0.00 0.00 175.17 174.09 2abe s TYR 191 N -1.39 0.35 0.15 4.23 -0.85 -1.26 -1.71 117.35 116.87 2abe s TYR 191 Ca 0.66 -0.74 0.10 0.00 -0.52 0.00 0.00 57.07 56.57 2abe s TYR 191 Cb -0.35 0.28 -0.04 0.00 0.38 0.00 0.00 41.96 42.22 2abe s TYR 191 CO 0.43 -1.09 -0.19 -1.58 -1.52 0.00 0.00 175.55 171.60 2abe s TRP 192 N -3.76 2.46 -0.09 -3.49 0.51 -0.39 -0.89 118.94 113.29 2abe s TRP 192 Ca 0.21 -0.30 -0.09 0.00 -2.12 0.00 0.00 56.10 53.80 2abe s TRP 192 Cb -0.02 -1.27 0.03 0.00 -0.81 0.00 0.00 33.47 31.40 2abe s TRP 192 CO 0.10 0.43 0.27 -0.08 -0.51 0.00 0.00 176.95 177.16 2abe s THR 193 N -1.37 0.01 0.12 2.01 -1.32 0.01 -1.24 115.64 113.85 2abe s THR 193 Ca 0.19 -0.05 -0.21 0.00 -1.21 0.00 0.00 61.69 60.42 2abe s THR 193 Cb -0.09 -0.39 0.05 0.00 -1.51 0.00 0.00 72.50 70.56 2abe s THR 193 CO 0.10 -0.03 0.52 -0.72 -2.21 0.00 0.00 174.62 172.28 2abe s TYR 194 N 0.02 -0.40 0.01 9.09 1.13 -1.01 -1.69 117.35 124.50 2abe s TYR 194 Ca -0.01 0.21 -0.28 0.00 -1.41 0.00 0.00 57.07 55.58 2abe s TYR 194 Cb -0.02 0.41 -0.04 0.00 -1.10 0.00 0.00 41.96 41.21 2abe s TYR 194 CO 0.01 -0.75 0.90 -1.25 -2.51 0.00 0.00 175.55 171.95 2abe s PRO 195 N -3.47 4.56 0.00 -3.49 0.04 -1.26 -0.89 135.00 130.49 2abe s PRO 195 Ca 0.00 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.33 2abe s PRO 195 Cb 0.00 -3.43 0.00 0.00 0.04 0.00 0.00 34.50 31.11 2abe s PRO 195 CO -0.10 0.05 0.00 0.41 0.04 0.00 0.00 177.00 177.40 2abe n GLY 196 N 2.77 4.39 3.32 0.56 0.00 0.14 -4.84 105.19 111.52 2abe n GLY 196 Ca 0.03 -0.80 -0.19 0.00 0.00 0.00 0.00 46.02 45.07 2abe n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2abe s SER 197 N 1.51 1.49 0.60 1.61 1.04 -1.09 -2.43 113.70 116.44 2abe s SER 197 Ca 0.00 -1.60 -0.16 0.00 0.48 0.00 0.00 55.95 54.67 2abe s SER 197 Cb 0.00 0.44 -0.03 0.00 0.10 0.00 0.00 66.02 66.53 2abe s SER 197 CO 0.00 -0.93 1.08 -0.76 0.98 0.00 0.00 173.24 173.60 2abe s LEU 198 N -3.36 3.50 0.00 2.42 1.43 -0.82 -4.45 118.68 117.40 2abe s LEU 198 Ca 0.37 1.90 0.21 0.00 -1.03 0.00 0.00 54.13 55.58 2abe s LEU 198 Cb 0.04 -4.54 0.53 0.00 0.03 0.00 0.00 46.19 42.25 2abe s LEU 198 CO 0.19 -1.28 1.45 0.35 0.23 0.00 0.00 176.35 177.29 2abe n THR 199 N -2.03 0.56 -4.16 5.49 -2.24 -1.26 -4.50 114.28 106.15 2abe n THR 199 Ca 0.09 -0.69 -0.14 0.00 -2.27 0.00 0.00 64.05 61.05 2abe n THR 199 Cb 0.52 0.63 -0.11 0.00 -2.10 0.00 0.00 70.33 69.28 2abe n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2abe s THR 200 N -1.44 0.85 0.51 4.28 -4.23 -1.26 -4.75 115.64 109.60 2abe s THR 200 Ca 0.38 -1.59 -0.21 0.00 -1.18 0.00 0.00 61.69 59.09 2abe s THR 200 Cb 0.21 -1.29 -0.08 0.00 1.34 0.00 0.00 72.50 72.68 2abe s THR 200 CO 0.29 -0.57 0.85 -2.65 -0.54 0.00 0.00 174.62 172.00 2abe n PRO 201 N 0.62 0.96 0.00 3.99 -0.02 -1.26 -0.19 135.00 139.10 2abe n PRO 201 Ca -0.17 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 2abe n PRO 201 Cb 0.58 -1.97 0.01 0.00 -0.02 0.00 0.00 33.50 32.10 2abe n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2abe n PRO 202 N -0.24 0.66 -3.58 0.52 -0.04 -1.26 -4.98 135.00 126.07 2abe n PRO 202 Ca 0.11 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.31 2abe n PRO 202 Cb 0.44 -1.01 0.01 0.00 -0.04 0.00 0.00 33.50 32.90 2abe n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2abe n LEU 203 N -0.51 -2.08 -4.74 1.53 4.77 0.74 -4.90 117.00 111.82 2abe n LEU 203 Ca 0.00 -0.56 -0.42 0.00 -0.03 0.00 0.00 56.01 55.00 2abe n LEU 203 Cb 0.00 -2.39 -0.02 0.00 -2.33 0.00 0.00 43.42 38.67 2abe n LEU 203 CO 0.00 0.29 1.15 -0.76 -1.33 0.00 0.00 177.39 176.74 2abe s LEU 204 N -6.87 4.38 -1.36 2.23 1.43 -1.26 -4.48 118.68 112.75 2abe s LEU 204 Ca 0.51 2.70 -0.07 0.00 -1.03 0.00 0.00 54.13 56.24 2abe s LEU 204 Cb -0.26 -3.62 0.10 0.00 0.03 0.00 0.00 46.19 42.44 2abe s LEU 204 CO 0.63 -0.76 2.36 -0.62 0.23 0.00 0.00 176.35 178.20 2abe n GLU 205 N 2.62 4.25 -0.04 1.70 1.02 -1.26 -1.95 120.64 126.98 2abe n GLU 205 Ca 0.08 -3.28 0.04 0.00 -0.02 0.00 0.00 57.16 53.98 2abe n GLU 205 Cb 0.39 -2.73 0.06 0.00 -0.02 0.00 0.00 31.44 29.15 2abe n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2abe s VAL 207 N -1.75 4.89 -0.39 0.00 1.01 -1.02 -0.80 120.40 122.35 2abe s VAL 207 Ca 0.13 -0.00 -0.15 0.00 0.00 0.00 0.00 61.98 61.96 2abe s VAL 207 Cb 0.12 -3.19 0.01 0.00 0.00 0.00 0.00 36.38 33.31 2abe s VAL 207 CO 0.01 0.48 0.34 -0.89 0.00 0.00 0.00 175.10 175.04 2abe s THR 208 N 0.20 5.19 0.08 3.92 2.01 -0.18 0.25 115.64 127.11 2abe s THR 208 Ca 0.05 -0.33 -0.23 0.00 0.31 0.00 0.00 61.69 61.49 2abe s THR 208 Cb -0.12 -3.90 -0.06 0.00 0.01 0.00 0.00 72.50 68.43 2abe s THR 208 CO 0.00 -0.24 0.68 0.26 -0.69 0.00 0.00 174.62 174.64 2abe s TRP 209 N 1.90 3.79 -0.27 4.92 0.52 -0.06 -2.49 118.94 127.25 2abe s TRP 209 Ca 0.09 1.41 -0.00 0.00 0.02 0.00 0.00 56.10 57.62 2abe s TRP 209 Cb -0.18 -2.68 0.08 0.00 -1.15 0.00 0.00 33.47 29.55 2abe s TRP 209 CO 0.12 0.44 0.05 0.42 0.02 0.00 0.00 176.95 177.99 2abe s ILE 210 N -0.66 1.06 -0.27 2.03 1.09 -0.64 -2.40 121.20 121.41 2abe s ILE 210 Ca 0.34 -1.26 -0.07 0.00 -1.10 0.00 0.00 60.65 58.56 2abe s ILE 210 Cb -0.21 -1.64 -0.01 0.00 -1.06 0.00 0.00 42.46 39.54 2abe s ILE 210 CO 0.22 -0.44 0.07 -0.69 -0.10 0.00 0.00 174.94 174.00 2abe s VAL 211 N 1.56 4.12 0.25 2.92 1.01 -0.37 0.24 120.40 130.13 2abe s VAL 211 Ca 0.04 -0.44 -0.30 0.00 0.00 0.00 0.00 61.98 61.29 2abe s VAL 211 Cb -0.18 -3.02 -0.09 0.00 0.00 0.00 0.00 36.38 33.09 2abe s VAL 211 CO -0.16 0.21 1.18 -0.76 0.00 0.00 0.00 175.10 175.57 2abe s LEU 212 N 1.56 4.49 0.15 3.92 1.43 -0.24 -1.26 118.68 128.73 2abe s LEU 212 Ca 0.05 2.34 -0.11 0.00 -1.03 0.00 0.00 54.13 55.38 2abe s LEU 212 Cb -0.16 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.43 2abe s LEU 212 CO 0.03 -0.31 1.54 0.50 0.23 0.00 0.00 176.35 178.34 2abe h LYS 213 N 4.31 0.98 -5.86 1.70 3.64 -1.67 -3.43 116.57 116.24 2abe h LYS 213 Ca -0.46 -0.43 -0.59 0.00 -1.27 0.00 0.00 60.65 57.90 2abe h LYS 213 Cb 1.21 -0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.93 2abe h LYS 213 CO 0.70 1.10 0.54 -2.00 -2.27 0.00 0.00 179.45 177.52 2abe s GLU 214 N -4.65 4.21 0.50 1.90 2.12 -1.26 -5.01 118.70 116.51 2abe s GLU 214 Ca -0.11 1.04 -0.05 0.00 0.36 0.00 0.00 54.97 56.20 2abe s GLU 214 Cb 0.12 -3.64 -0.03 0.00 0.26 0.00 0.00 34.13 30.84 2abe s GLU 214 CO 0.87 -0.53 0.81 -1.25 -0.54 0.00 0.00 175.26 174.62 2abe s PRO 215 N 2.88 3.40 0.16 4.30 0.04 -1.26 -4.66 135.00 139.86 2abe s PRO 215 Ca 0.37 0.14 0.03 0.00 0.04 0.00 0.00 61.00 61.58 2abe s PRO 215 Cb -0.15 -2.36 -0.04 0.00 0.04 0.00 0.00 34.50 32.00 2abe s PRO 215 CO 0.07 -0.32 0.25 0.96 0.04 0.00 0.00 177.00 178.01 2abe s ILE 216 N -2.79 5.08 -0.10 0.56 -4.36 -0.31 -4.93 121.20 114.36 2abe s ILE 216 Ca 0.49 -0.82 -0.05 0.00 -0.26 0.00 0.00 60.65 60.00 2abe s ILE 216 Cb -0.10 -3.63 -0.04 0.00 1.25 0.00 0.00 42.46 39.94 2abe s ILE 216 CO 0.45 -0.12 0.10 -0.44 0.24 0.00 0.00 174.94 175.17 2abe s SER 217 N -3.26 6.06 0.10 4.36 0.01 -1.26 -1.21 113.70 118.48 2abe s SER 217 Ca 0.34 0.36 0.05 0.00 1.31 0.00 0.00 55.95 58.01 2abe s SER 217 Cb -0.11 -1.89 -0.03 0.00 0.21 0.00 0.00 66.02 64.20 2abe s SER 217 CO 0.27 0.39 -0.13 0.68 0.41 0.00 0.00 173.24 174.86 2abe s VAL 218 N -1.02 1.14 0.61 3.43 -7.23 0.06 -3.61 120.40 113.79 2abe s VAL 218 Ca 0.16 -1.53 -0.12 0.00 -1.81 0.00 0.00 61.98 58.68 2abe s VAL 218 Cb -0.12 -1.30 -0.04 0.00 0.56 0.00 0.00 36.38 35.48 2abe s VAL 218 CO 0.05 -0.38 1.03 -0.94 -0.31 0.00 0.00 175.10 174.55 2abe s SER 219 N -2.17 6.25 0.25 4.85 1.04 -1.19 0.09 113.70 122.83 2abe s SER 219 Ca 0.04 1.44 -0.04 0.00 0.48 0.00 0.00 55.95 57.87 2abe s SER 219 Cb -0.06 -2.47 0.37 0.00 0.10 0.00 0.00 66.02 63.95 2abe s SER 219 CO 0.02 -0.85 1.87 -1.28 0.98 0.00 0.00 173.24 173.98 2abe h SER 220 N -0.21 0.95 -0.84 7.02 0.87 -1.94 -1.79 113.55 117.62 2abe h SER 220 Ca -0.44 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.12 2abe h SER 220 Cb 1.19 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 62.92 2abe h SER 220 CO 0.62 0.61 0.49 -0.33 -0.53 0.00 0.00 176.83 177.69 2abe h GLU 221 N 1.09 1.15 -0.23 2.24 3.07 -1.96 -0.14 114.58 119.81 2abe h GLU 221 Ca 0.41 -0.12 -0.05 0.00 -0.50 0.00 0.00 59.36 59.10 2abe h GLU 221 Cb 0.16 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 27.83 2abe h GLU 221 CO -0.17 0.82 -0.06 1.96 -1.40 0.00 0.00 179.01 180.17 2abe h GLN 222 N 1.17 0.44 -0.41 2.33 4.20 -1.72 -2.95 115.11 118.18 2abe h GLN 222 Ca 0.30 -0.17 -0.08 0.00 0.06 0.00 0.00 58.65 58.76 2abe h GLN 222 Cb -0.02 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 2abe h GLN 222 CO -0.05 0.68 -0.08 0.28 -0.67 0.00 0.00 178.83 178.98 2abe h VAL 223 N 0.17 1.25 -0.99 -0.54 2.07 -1.18 -2.86 116.25 114.18 2abe h VAL 223 Ca 0.06 -1.09 0.06 0.00 0.82 0.00 0.00 66.70 66.55 2abe h VAL 223 Cb 0.52 1.03 -0.06 0.00 -1.52 0.00 0.00 31.29 31.25 2abe h VAL 223 CO 0.02 0.37 0.64 -0.07 0.02 0.00 0.00 177.57 178.55 2abe h LEU 224 N 0.65 1.03 -1.44 2.57 3.38 -0.96 -2.10 115.31 118.44 2abe h LEU 224 Ca 0.12 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 2abe h LEU 224 Cb 0.53 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2abe h LEU 224 CO 0.03 0.66 -0.28 0.11 0.09 0.00 0.00 178.44 179.05 2abe h LYS 225 N 1.17 0.00 -0.84 1.13 1.57 -1.33 -2.09 116.57 116.18 2abe h LYS 225 Ca 0.42 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.16 2abe h LYS 225 Cb 0.15 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.42 2abe h LYS 225 CO -0.16 0.28 0.38 0.74 -0.57 0.00 0.00 179.45 180.12 2abe h PHE 226 N 0.00 1.23 0.00 -1.35 -1.00 -1.40 -2.69 116.94 111.73 2abe h PHE 226 Ca -0.00 -0.07 0.00 0.00 2.81 0.00 0.00 57.97 60.70 2abe h PHE 226 Cb 0.50 -0.38 0.00 0.00 3.61 0.00 0.00 35.95 39.68 2abe h PHE 226 CO 0.00 0.90 0.00 0.54 -1.61 0.00 0.00 178.31 178.14 2abe n ARG 227 N -4.29 0.29 -0.00 1.51 1.74 -0.79 -2.68 116.66 112.43 2abe n ARG 227 Ca 0.08 0.11 0.13 0.00 -0.77 0.00 0.00 57.85 57.40 2abe n ARG 227 Cb 0.16 -1.50 0.34 0.00 -1.02 0.00 0.00 32.46 30.44 2abe n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2abe n LYS 228 N -1.24 1.96 -1.60 5.56 5.02 -1.01 -4.40 118.16 122.45 2abe n LYS 228 Ca 0.09 -1.39 -0.31 0.00 -2.02 0.00 0.00 58.31 54.68 2abe n LYS 228 Cb 0.12 -1.47 0.06 0.00 -0.02 0.00 0.00 35.03 33.72 2abe n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2abe s LEU 229 N -1.99 2.91 0.02 -0.35 1.43 -1.09 -4.87 118.68 114.74 2abe s LEU 229 Ca 0.34 1.45 0.07 0.00 -1.03 0.00 0.00 54.13 54.96 2abe s LEU 229 Cb 0.21 -4.23 -0.03 0.00 0.03 0.00 0.00 46.19 42.17 2abe s LEU 229 CO 0.32 -1.62 -0.20 0.20 0.23 0.00 0.00 176.35 175.28 2abe s ASN 230 N -3.89 3.61 0.07 2.29 0.02 0.35 0.72 114.94 118.10 2abe s ASN 230 Ca 0.59 -0.43 -0.06 0.00 -1.02 0.00 0.00 52.86 51.93 2abe s ASN 230 Cb -0.14 -0.54 -0.27 0.00 0.02 0.00 0.00 41.25 40.31 2abe s ASN 230 CO 0.54 0.28 1.14 -0.26 0.02 0.00 0.00 177.10 178.82 2abe h PHE 231 N 4.83 0.60 -4.17 2.20 0.04 -1.19 -3.36 116.94 115.88 2abe h PHE 231 Ca -0.47 -0.42 -0.49 0.00 2.80 0.00 0.00 57.97 59.39 2abe h PHE 231 Cb 1.15 -0.03 0.14 0.00 2.20 0.00 0.00 35.95 39.40 2abe h PHE 231 CO 0.50 1.31 0.28 0.54 -0.60 0.00 0.00 178.31 180.35 2abe s ASN 232 N -7.22 3.94 0.55 2.17 4.22 -1.26 -4.36 114.94 112.98 2abe s ASN 232 Ca -0.05 1.53 -0.03 0.00 -2.14 0.00 0.00 52.86 52.18 2abe s ASN 232 Cb 0.07 -2.23 0.02 0.00 1.28 0.00 0.00 41.25 40.38 2abe s ASN 232 CO 0.89 -2.35 0.81 -0.83 -2.04 0.00 0.00 177.10 173.59 2abe s GLY 233 N -3.51 1.64 0.31 0.45 0.00 -1.26 -1.13 107.32 103.82 2abe s GLY 233 Ca 0.62 -0.96 -0.30 0.00 0.00 0.00 0.00 44.72 44.08 2abe s GLY 233 CO 0.56 -0.70 1.54 1.85 0.00 0.00 0.00 173.10 176.35 2abe s GLU 234 N -4.83 4.15 0.00 2.90 2.12 -1.26 -2.60 118.70 119.17 2abe s GLU 234 Ca 0.53 2.53 0.00 0.00 0.36 0.00 0.00 54.97 58.39 2abe s GLU 234 Cb -0.10 -3.02 0.00 0.00 0.26 0.00 0.00 34.13 31.26 2abe s GLU 234 CO 0.41 -0.57 0.00 0.41 -0.54 0.00 0.00 175.26 174.98 2abe n GLY 235 N 1.75 0.58 3.42 -1.50 0.00 -1.26 -5.06 105.19 103.12 2abe n GLY 235 Ca 0.06 -0.58 -0.21 0.00 0.00 0.00 0.00 46.02 45.29 2abe n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2abe s GLU 236 N -1.13 1.54 0.22 1.61 2.02 -1.07 -5.10 118.70 116.79 2abe s GLU 236 Ca 0.00 -1.78 -0.32 0.00 0.02 0.00 0.00 54.97 52.89 2abe s GLU 236 Cb 0.00 -1.13 -0.13 0.00 0.10 0.00 0.00 34.13 32.96 2abe s GLU 236 CO 0.00 0.03 1.47 -2.30 0.02 0.00 0.00 175.26 174.48 2abe n PRO 237 N -0.58 2.13 -2.30 0.39 -0.02 -1.26 -4.88 135.00 128.48 2abe n PRO 237 Ca -0.05 0.76 -0.42 0.00 -2.02 0.00 0.00 63.50 61.76 2abe n PRO 237 Cb 0.63 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.63 2abe n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2abe s GLU 238 N -0.03 4.28 -0.24 -0.52 2.12 -1.26 -4.75 118.70 118.29 2abe s GLU 238 Ca 0.71 1.85 0.01 0.00 0.36 0.00 0.00 54.97 57.90 2abe s GLU 238 Cb -0.64 -3.66 0.06 0.00 0.26 0.00 0.00 34.13 30.15 2abe s GLU 238 CO 0.46 -0.61 -0.05 -1.21 -0.54 0.00 0.00 175.26 173.32 2abe s GLU 239 N 2.80 1.58 0.33 4.30 2.02 -1.26 -5.05 118.70 123.41 2abe s GLU 239 Ca 0.61 -1.01 -0.29 0.00 0.02 0.00 0.00 54.97 54.30 2abe s GLU 239 Cb -0.28 -2.58 -0.11 0.00 0.10 0.00 0.00 34.13 31.26 2abe s GLU 239 CO 0.23 -0.62 1.51 -0.51 0.02 0.00 0.00 175.26 175.89 2abe s LEU 240 N 1.39 4.35 -0.87 1.80 1.43 -1.26 -0.74 118.68 124.78 2abe s LEU 240 Ca -0.05 2.93 -0.25 0.00 -1.03 0.00 0.00 54.13 55.74 2abe s LEU 240 Cb -0.19 -3.65 0.04 0.00 0.03 0.00 0.00 46.19 42.43 2abe s LEU 240 CO -0.07 -0.84 1.34 -0.32 0.23 0.00 0.00 176.35 176.69 2abe s MET 241 N -1.26 3.38 0.05 1.70 -2.45 0.22 -4.62 119.30 116.32 2abe s MET 241 Ca 0.57 -0.72 -0.03 0.00 -1.25 0.00 0.00 55.69 54.26 2abe s MET 241 Cb -0.46 -4.74 -0.02 0.00 1.25 0.00 0.00 34.83 30.85 2abe s MET 241 CO 0.54 -2.15 0.03 0.14 1.05 0.00 0.00 175.02 174.64 2abe s VAL 242 N 5.20 0.17 -1.36 10.11 -7.23 -1.26 -4.48 120.40 121.55 2abe s VAL 242 Ca 0.39 -1.38 -0.03 0.00 -1.81 0.00 0.00 61.98 59.16 2abe s VAL 242 Cb -0.05 -1.11 0.02 0.00 0.56 0.00 0.00 36.38 35.80 2abe s VAL 242 CO 0.03 -0.76 0.71 0.47 -0.31 0.00 0.00 175.10 175.23 2abe n ASP 243 N 0.53 -1.65 -2.66 4.85 8.00 -0.25 -4.86 116.55 120.50 2abe n ASP 243 Ca -0.17 -0.84 -0.31 0.00 0.71 0.00 0.00 54.79 54.17 2abe n ASP 243 Cb 0.59 -3.87 -0.03 0.00 -0.02 0.00 0.00 41.12 37.80 2abe n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2abe n ASN 244 N -3.01 6.84 -4.36 -2.24 6.94 -1.08 -4.92 115.26 113.44 2abe n ASN 244 Ca -0.24 -3.40 -0.26 0.00 -0.02 0.00 0.00 54.58 50.66 2abe n ASN 244 Cb 0.65 -1.19 -0.12 0.00 -2.36 0.00 0.00 39.78 36.76 2abe n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 2abe s TRP 245 N -2.44 2.09 -0.08 -2.53 1.48 -1.26 -4.63 118.94 111.58 2abe s TRP 245 Ca 0.57 -0.40 -0.06 0.00 -1.06 0.00 0.00 56.10 55.14 2abe s TRP 245 Cb 0.39 -1.11 -0.04 0.00 -1.16 0.00 0.00 33.47 31.56 2abe s TRP 245 CO -0.28 0.33 0.18 0.50 -4.06 0.00 0.00 176.95 173.62 2abe s ARG 246 N -2.24 3.48 0.81 3.25 3.52 -1.26 -4.98 118.95 121.54 2abe s ARG 246 Ca 0.13 -0.14 -0.11 0.00 -0.13 0.00 0.00 55.73 55.49 2abe s ARG 246 Cb -0.09 -3.16 0.08 0.00 -1.56 0.00 0.00 34.95 30.22 2abe s ARG 246 CO 0.06 0.74 1.12 -2.14 -0.81 0.00 0.00 175.30 174.28 2abe s PRO 247 N -1.31 1.84 0.41 5.12 0.02 -1.26 -4.72 135.00 135.10 2abe s PRO 247 Ca 0.19 1.38 -0.26 0.00 0.02 0.00 0.00 61.00 62.33 2abe s PRO 247 Cb -0.13 -1.83 -0.09 0.00 0.02 0.00 0.00 34.50 32.47 2abe s PRO 247 CO 0.09 -1.99 1.36 0.00 -0.33 0.00 0.00 177.00 176.12 2abe s ALA 248 N -2.69 3.29 0.28 -1.55 0.00 -1.26 -4.40 121.76 115.43 2abe s ALA 248 Ca 0.65 1.34 0.08 0.00 0.00 0.00 0.00 51.96 54.02 2abe s ALA 248 Cb -0.20 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.35 2abe s ALA 248 CO 0.55 -0.95 0.15 -0.65 0.00 0.00 0.00 175.76 174.86 2abe s GLN 249 N -2.27 2.65 0.26 0.00 -1.52 0.12 -4.95 119.66 113.96 2abe s GLN 249 Ca 0.57 -1.26 -0.30 0.00 -1.95 0.00 0.00 55.36 52.43 2abe s GLN 249 Cb -0.41 -2.39 -0.11 0.00 -0.22 0.00 0.00 33.01 29.89 2abe s GLN 249 CO 0.53 0.30 1.52 -1.25 -0.25 0.00 0.00 175.29 176.14 2abe s PRO 250 N -3.82 4.19 0.25 2.91 0.04 -1.26 -4.55 135.00 132.75 2abe s PRO 250 Ca 0.34 2.44 0.01 0.00 0.04 0.00 0.00 61.00 63.84 2abe s PRO 250 Cb -0.06 -3.07 0.29 0.00 0.04 0.00 0.00 34.50 31.70 2abe s PRO 250 CO 0.24 -0.53 1.62 1.25 0.04 0.00 0.00 177.00 179.62 2abe h LEU 251 N 5.05 0.47 0.00 -3.56 5.85 -1.94 -3.44 115.31 117.73 2abe h LEU 251 Ca -0.46 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.05 2abe h LEU 251 Cb 1.22 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.12 2abe h LEU 251 CO 0.79 0.83 0.00 0.29 -0.34 0.00 0.00 178.44 180.02 2abe n LYS 252 N -4.02 0.00 -1.74 1.25 5.02 -1.26 -3.23 118.16 114.19 2abe n LYS 252 Ca -0.02 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.88 2abe n LYS 252 Cb 0.51 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.51 2abe n LYS 252 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2abe n ASN 253 N 2.75 8.32 -3.98 4.39 4.13 -1.26 -4.90 115.26 124.72 2abe n ASN 253 Ca 0.00 -2.93 -0.11 0.00 1.68 0.00 0.00 54.58 53.21 2abe n ASN 253 Cb 0.00 -1.43 -0.12 0.00 -1.54 0.00 0.00 39.78 36.69 2abe n ASN 253 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2abe s ARG 254 N 0.06 0.31 -0.08 3.52 0.52 -1.20 -5.11 118.95 116.97 2abe s ARG 254 Ca 0.60 -0.48 0.03 0.00 -0.52 0.00 0.00 55.73 55.37 2abe s ARG 254 Cb 0.18 -0.07 -0.02 0.00 0.52 0.00 0.00 34.95 35.57 2abe s ARG 254 CO -0.08 0.00 -0.17 -1.14 0.02 0.00 0.00 175.30 173.92 2abe s GLN 255 N -1.05 2.84 -0.23 3.54 0.74 -1.26 -5.03 119.66 119.22 2abe s GLN 255 Ca -0.09 -0.76 -0.12 0.00 0.05 0.00 0.00 55.36 54.43 2abe s GLN 255 Cb -0.07 -2.40 -0.05 0.00 1.10 0.00 0.00 33.01 31.60 2abe s GLN 255 CO -0.00 0.39 0.25 0.42 -0.55 0.00 0.00 175.29 175.80 2abe s ILE 256 N -0.15 5.30 0.13 -2.34 1.01 -1.26 -4.70 121.20 119.18 2abe s ILE 256 Ca -0.02 0.37 0.04 0.00 0.00 0.00 0.00 60.65 61.04 2abe s ILE 256 Cb -0.14 -3.59 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 2abe s ILE 256 CO 0.04 0.31 0.14 -0.54 0.00 0.00 0.00 174.94 174.88 2abe s LYS 257 N 1.18 2.99 0.05 2.79 1.02 -0.68 -1.50 119.74 125.60 2abe s LYS 257 Ca 0.12 -0.75 0.08 0.00 0.02 0.00 0.00 55.97 55.44 2abe s LYS 257 Cb -0.14 -2.74 -0.03 0.00 -0.52 0.00 0.00 37.83 34.40 2abe s LYS 257 CO 0.06 0.53 -0.20 0.00 -0.92 0.00 0.00 175.35 174.81 2abe s ALA 258 N -1.61 2.51 -1.52 5.17 0.00 0.17 -0.81 121.76 125.68 2abe s ALA 258 Ca 0.31 -1.24 0.25 0.00 0.00 0.00 0.00 51.96 51.29 2abe s ALA 258 Cb -0.11 -0.65 0.58 0.00 0.00 0.00 0.00 23.12 22.94 2abe s ALA 258 CO 0.24 0.56 1.46 -1.13 0.00 0.00 0.00 175.76 176.89 2abe n SER 259 N 1.50 0.95 -4.21 0.00 3.41 -0.07 -1.35 113.62 113.85 2abe n SER 259 Ca -0.16 -0.76 -0.17 0.00 -0.26 0.00 0.00 58.87 57.51 2abe n SER 259 Cb 0.52 0.24 -0.11 0.00 -0.26 0.00 0.00 64.21 64.59 2abe n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2abe s PHE 260 N -2.67 1.28 -2.09 7.33 -0.71 -1.26 -4.88 117.98 114.98 2abe s PHE 260 Ca 0.19 -0.54 0.17 0.00 -1.04 0.00 0.00 56.93 55.71 2abe s PHE 260 Cb 0.18 -0.69 0.13 0.00 -1.21 0.00 0.00 43.02 41.44 2abe s PHE 260 CO 0.59 0.09 1.03 1.17 -1.34 0.00 0.00 175.22 176.76