#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b3b s LYS 2 N 0.00 0.94 -0.14 0.03 1.02 -1.26 -0.75 119.74 119.57 2b3b s LYS 2 Ca 0.00 -1.26 -0.04 0.00 0.02 0.00 0.00 55.97 54.69 2b3b s LYS 2 Cb 0.00 -0.63 0.07 0.00 -0.52 0.00 0.00 37.83 36.75 2b3b s LYS 2 CO 0.00 0.10 0.17 -1.17 -0.92 0.00 0.00 175.35 173.53 2b3b s LEU 3 N -2.66 -0.02 -0.42 3.17 2.96 -0.44 -4.77 118.68 116.51 2b3b s LEU 3 Ca 0.09 -0.02 -0.15 0.00 -0.22 0.00 0.00 54.13 53.83 2b3b s LEU 3 Cb -0.02 0.23 0.03 0.00 0.50 0.00 0.00 46.19 46.93 2b3b s LEU 3 CO 0.01 -0.29 0.31 -0.70 -1.32 0.00 0.00 176.35 174.35 2b3b s GLU 4 N 2.28 2.96 -0.27 1.98 2.12 -1.26 -0.45 118.70 126.07 2b3b s GLU 4 Ca 0.04 -1.06 -0.10 0.00 0.36 0.00 0.00 54.97 54.21 2b3b s GLU 4 Cb -0.14 -3.99 -0.05 0.00 0.26 0.00 0.00 34.13 30.21 2b3b s GLU 4 CO -0.09 -0.78 0.16 0.42 -0.54 0.00 0.00 175.26 174.44 2b3b s ILE 5 N 1.67 5.15 -0.19 -3.70 1.01 -0.38 -2.12 121.20 122.64 2b3b s ILE 5 Ca 0.05 0.12 -0.09 0.00 0.00 0.00 0.00 60.65 60.73 2b3b s ILE 5 Cb -0.20 -3.44 -0.05 0.00 0.01 0.00 0.00 42.46 38.79 2b3b s ILE 5 CO 0.09 0.28 0.10 0.12 0.00 0.00 0.00 174.94 175.53 2b3b s PHE 6 N 1.61 3.33 0.32 3.97 5.36 -0.61 -0.06 117.98 131.89 2b3b s PHE 6 Ca 0.07 0.19 -0.18 0.00 -0.96 0.00 0.00 56.93 56.05 2b3b s PHE 6 Cb -0.15 -2.12 0.06 0.00 -0.34 0.00 0.00 43.02 40.46 2b3b s PHE 6 CO 0.09 0.21 0.84 -1.54 -1.46 0.00 0.00 175.22 173.36 2b3b s SER 7 N 0.38 -0.03 -0.29 6.13 1.04 -0.95 -0.91 113.70 119.07 2b3b s SER 7 Ca 0.05 -0.96 0.09 0.00 0.48 0.00 0.00 55.95 55.62 2b3b s SER 7 Cb -0.12 0.75 0.52 0.00 0.10 0.00 0.00 66.02 67.28 2b3b s SER 7 CO -0.01 -1.48 1.49 -2.67 0.98 0.00 0.00 173.24 171.55 2b3b n TRP 8 N -0.55 1.20 -2.29 5.02 2.14 -1.26 -0.70 117.44 121.00 2b3b n TRP 8 Ca -0.07 -1.55 -0.41 0.00 2.07 0.00 0.00 57.50 57.55 2b3b n TRP 8 Cb 0.60 -0.51 0.01 0.00 -0.81 0.00 0.00 31.31 30.60 2b3b n TRP 8 CO 0.00 0.00 0.00 0.91 2.07 0.00 0.00 177.69 180.67 2b3b n TRP 9 N -1.07 2.67 -2.67 -2.67 8.01 -1.26 -4.60 117.44 115.86 2b3b n TRP 9 Ca 0.34 -2.71 -0.26 0.00 -1.31 0.00 0.00 57.50 53.56 2b3b n TRP 9 Cb 1.06 -1.57 0.01 0.00 -2.01 0.00 0.00 31.31 28.81 2b3b n TRP 9 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2b3b s ALA 10 N -2.45 3.45 0.00 6.99 0.00 -1.26 -3.25 121.76 125.24 2b3b s ALA 10 Ca 0.47 -0.68 0.00 0.00 0.00 0.00 0.00 51.96 51.75 2b3b s ALA 10 Cb 0.18 -2.49 0.00 0.00 0.00 0.00 0.00 23.12 20.81 2b3b s ALA 10 CO -0.10 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 175.59 2b3b n GLY 11 N -2.30 3.01 0.00 0.00 0.00 -1.26 -1.60 105.19 103.04 2b3b n GLY 11 Ca 0.02 -0.29 0.08 0.00 0.00 0.00 0.00 46.02 45.82 2b3b n GLY 11 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2b3b n ASP 12 N 1.64 0.00 -0.10 1.61 5.68 -1.26 -0.37 116.55 123.75 2b3b n ASP 12 Ca 0.00 -0.22 0.14 0.00 -0.50 0.00 0.00 54.79 54.21 2b3b n ASP 12 Cb 0.00 -0.14 0.53 0.00 -1.14 0.00 0.00 41.12 40.37 2b3b n ASP 12 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2b3b n GLU 13 N -1.14 0.50 0.16 0.11 1.02 -0.63 -4.49 120.64 116.17 2b3b n GLU 13 Ca 0.10 -0.19 0.03 0.00 -0.02 0.00 0.00 57.16 57.07 2b3b n GLU 13 Cb 0.09 -1.50 0.20 0.00 -0.02 0.00 0.00 31.44 30.21 2b3b n GLU 13 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2b3b h GLY 14 N 4.97 0.00 0.02 0.62 0.00 -0.68 -3.39 103.07 104.61 2b3b h GLY 14 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 47.33 47.47 2b3b h GLY 14 CO 0.00 0.00 0.13 -2.55 0.00 0.00 0.00 176.54 174.12 2b3b h PRO 15 N 0.00 0.23 -0.31 4.80 0.11 -1.79 0.12 132.00 135.17 2b3b h PRO 15 Ca -0.01 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.06 2b3b h PRO 15 Cb 1.13 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2b3b h PRO 15 CO 0.07 0.16 0.08 0.00 -0.21 0.00 0.00 178.00 178.09 2b3b h ALA 16 N 1.55 0.41 -0.23 -0.75 0.00 -1.83 -1.99 119.26 116.43 2b3b h ALA 16 Ca 0.36 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2b3b h ALA 16 Cb 0.58 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2b3b h ALA 16 CO -0.47 0.06 0.14 1.25 0.00 0.00 0.00 179.25 180.23 2b3b h LEU 17 N 0.34 0.27 -1.06 0.00 5.85 -1.72 -2.64 115.31 116.35 2b3b h LEU 17 Ca 0.10 -0.03 0.13 0.00 0.84 0.00 0.00 57.88 58.92 2b3b h LEU 17 Cb 0.28 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.16 2b3b h LEU 17 CO -0.00 0.22 0.62 -0.33 -0.34 0.00 0.00 178.44 178.61 2b3b h GLU 18 N 0.29 0.90 -0.38 1.25 5.08 -0.59 0.36 114.58 121.49 2b3b h GLU 18 Ca 0.08 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.30 2b3b h GLU 18 Cb -0.00 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 2b3b h GLU 18 CO -0.02 0.59 -0.12 0.00 -1.00 0.00 0.00 179.01 178.47 2b3b h ALA 19 N 1.56 1.08 -0.50 3.43 0.00 -1.19 -0.73 119.26 122.91 2b3b h ALA 19 Ca 0.50 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 2b3b h ALA 19 Cb 0.57 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2b3b h ALA 19 CO -0.27 0.57 -0.11 -0.07 0.00 0.00 0.00 179.25 179.37 2b3b h LEU 20 N 0.61 0.92 -0.45 0.00 3.38 -0.73 -1.21 115.31 117.83 2b3b h LEU 20 Ca 0.11 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 2b3b h LEU 20 Cb 0.56 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2b3b h LEU 20 CO 0.04 1.04 -0.08 0.40 0.09 0.00 0.00 178.44 179.93 2b3b h ILE 21 N 0.83 1.27 -0.35 1.22 2.04 -0.76 0.98 117.51 122.75 2b3b h ILE 21 Ca 0.13 -1.18 0.01 0.00 1.00 0.00 0.00 64.86 64.83 2b3b h ILE 21 Cb 0.64 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 2b3b h ILE 21 CO 0.04 0.40 0.21 0.03 0.00 0.00 0.00 178.15 178.83 2b3b h ARG 22 N 0.68 0.41 -0.94 2.37 3.08 -1.11 -0.26 114.38 118.62 2b3b h ARG 22 Ca 0.12 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2b3b h ARG 22 Cb 0.61 -0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.52 2b3b h ARG 22 CO 0.04 0.27 0.59 1.25 -1.07 0.00 0.00 179.97 181.05 2b3b h LEU 23 N 0.42 1.11 -0.62 3.04 5.85 -1.02 -1.27 115.31 122.81 2b3b h LEU 23 Ca 0.14 -0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.75 2b3b h LEU 23 Cb -0.01 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.72 2b3b h LEU 23 CO -0.06 0.83 0.16 0.22 -0.34 0.00 0.00 178.44 179.25 2b3b h TYR 24 N 1.29 1.04 -0.15 1.25 3.20 -0.53 -2.58 116.97 120.49 2b3b h TYR 24 Ca 0.34 -0.12 -0.14 0.00 3.14 0.00 0.00 58.73 61.95 2b3b h TYR 24 Cb -0.09 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 37.87 2b3b h TYR 24 CO 0.00 0.87 -0.51 0.87 -1.64 0.00 0.00 178.16 177.75 2b3b h LYS 25 N 0.91 0.40 -0.78 1.82 1.57 -0.41 0.94 116.57 121.02 2b3b h LYS 25 Ca 0.20 -0.24 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2b3b h LYS 25 Cb 0.35 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 2b3b h LYS 25 CO 0.00 0.82 0.38 0.37 -0.57 0.00 0.00 179.45 180.44 2b3b h GLN 26 N 0.32 1.11 0.00 3.15 4.15 -1.23 -2.67 115.11 119.94 2b3b h GLN 26 Ca 0.01 -0.16 -0.17 0.00 0.77 0.00 0.00 58.65 59.11 2b3b h GLN 26 Cb 1.00 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 28.46 2b3b h GLN 26 CO 0.09 0.85 -0.80 0.87 -1.93 0.00 0.00 178.83 177.91 2b3b h LYS 27 N 1.10 0.00 -2.40 1.69 1.57 -1.02 -3.41 116.57 114.11 2b3b h LYS 27 Ca 0.27 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.46 2b3b h LYS 27 Cb 0.11 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 32.03 2b3b h LYS 27 CO -0.03 0.80 -0.93 0.66 -0.57 0.00 0.00 179.45 179.38 2b3b n TYR 28 N -3.32 -0.06 0.30 -1.35 4.01 0.28 -5.01 117.16 112.01 2b3b n TYR 28 Ca 0.01 -3.52 0.18 0.00 -0.16 0.00 0.00 57.90 54.41 2b3b n TYR 28 Cb 0.85 0.00 0.95 0.00 -0.31 0.00 0.00 39.34 40.84 2b3b n TYR 28 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2b3b h PRO 29 N 5.26 0.00 -0.02 -0.72 0.11 -1.72 -3.09 132.00 131.83 2b3b h PRO 29 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 2b3b h PRO 29 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2b3b h PRO 29 CO 0.45 0.03 0.00 0.41 -0.21 0.00 0.00 178.00 178.68 2b3b n GLY 30 N -0.75 -0.49 3.47 -0.55 0.00 -1.26 -4.86 105.19 100.75 2b3b n GLY 30 Ca -0.02 -0.31 -0.36 0.00 0.00 0.00 0.00 46.02 45.33 2b3b n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b3b s VAL 31 N -1.98 4.27 -0.23 1.61 1.01 -1.17 -3.90 120.40 120.01 2b3b s VAL 31 Ca 0.41 -0.20 -0.29 0.00 0.00 0.00 0.00 61.98 61.90 2b3b s VAL 31 Cb 0.20 -2.97 0.00 0.00 0.00 0.00 0.00 36.38 33.62 2b3b s VAL 31 CO 0.33 0.38 1.16 -1.61 0.00 0.00 0.00 175.10 175.36 2b3b s GLU 32 N 1.27 4.18 -0.24 2.72 0.41 0.07 -4.91 118.70 122.19 2b3b s GLU 32 Ca 0.04 1.41 -0.18 0.00 -0.41 0.00 0.00 54.97 55.83 2b3b s GLU 32 Cb -0.15 -3.73 -0.03 0.00 -1.78 0.00 0.00 34.13 28.45 2b3b s GLU 32 CO 0.03 -0.76 0.53 0.08 -0.49 0.00 0.00 175.26 174.65 2b3b s VAL 33 N 3.52 5.07 -0.30 2.63 1.01 -1.26 -1.32 120.40 129.74 2b3b s VAL 33 Ca 0.49 0.94 -0.15 0.00 0.00 0.00 0.00 61.98 63.26 2b3b s VAL 33 Cb -0.17 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.34 2b3b s VAL 33 CO 0.13 0.11 0.39 -0.63 0.00 0.00 0.00 175.10 175.09 2b3b s ILE 34 N 2.11 5.15 -0.94 2.22 1.09 0.40 -4.97 121.20 126.27 2b3b s ILE 34 Ca 0.23 0.37 -0.14 0.00 -1.10 0.00 0.00 60.65 60.01 2b3b s ILE 34 Cb -0.16 -3.77 0.20 0.00 -1.06 0.00 0.00 42.46 37.67 2b3b s ILE 34 CO 0.09 0.03 0.98 0.21 -0.10 0.00 0.00 174.94 176.15 2b3b s ASN 35 N 1.69 6.86 -1.16 3.58 3.84 -1.26 -1.25 114.94 127.23 2b3b s ASN 35 Ca 0.14 -2.72 -0.14 0.00 0.21 0.00 0.00 52.86 50.35 2b3b s ASN 35 Cb -0.16 -2.28 0.17 0.00 -0.55 0.00 0.00 41.25 38.43 2b3b s ASN 35 CO 0.11 -0.66 1.37 0.00 -2.79 0.00 0.00 177.10 175.13 2b3b s ALA 36 N 0.68 3.93 0.15 1.71 0.00 0.91 -5.00 121.76 124.13 2b3b s ALA 36 Ca 0.26 -3.29 -0.15 0.00 0.00 0.00 0.00 51.96 48.79 2b3b s ALA 36 Cb -0.08 -4.10 -0.07 0.00 0.00 0.00 0.00 23.12 18.87 2b3b s ALA 36 CO -0.08 -2.78 0.56 0.95 0.00 0.00 0.00 175.76 174.40 2b3b s THR 37 N 1.66 4.84 -0.25 0.00 -4.23 -1.26 -2.24 115.64 114.15 2b3b s THR 37 Ca 0.41 0.86 -0.02 0.00 -1.18 0.00 0.00 61.69 61.76 2b3b s THR 37 Cb -0.03 -3.75 0.02 0.00 1.34 0.00 0.00 72.50 70.08 2b3b s THR 37 CO -0.02 0.25 -0.04 -0.69 -0.54 0.00 0.00 174.62 173.58 2b3b s VAL 38 N -1.46 3.02 0.10 2.29 1.01 0.13 -4.94 120.40 120.55 2b3b s VAL 38 Ca 0.38 -0.97 -0.31 0.00 0.00 0.00 0.00 61.98 61.08 2b3b s VAL 38 Cb -0.15 -2.53 -0.08 0.00 0.00 0.00 0.00 36.38 33.62 2b3b s VAL 38 CO 0.19 0.19 1.42 -0.89 0.00 0.00 0.00 175.10 176.01 2b3b s THR 39 N 1.35 3.30 0.00 3.92 2.01 -1.26 -4.37 115.64 120.59 2b3b s THR 39 Ca 0.01 0.90 0.00 0.00 0.31 0.00 0.00 61.69 62.90 2b3b s THR 39 Cb -0.17 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 68.77 2b3b s THR 39 CO -0.04 0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.56 2b3b n GLY 40 N 3.56 3.13 3.56 4.40 0.00 -1.26 -4.72 105.19 113.86 2b3b n GLY 40 Ca 0.12 -0.04 -0.45 0.00 0.00 0.00 0.00 46.02 45.65 2b3b n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b3b n GLY 41 N 0.00 -0.45 2.70 -0.02 0.00 -1.26 -2.61 105.19 103.55 2b3b n GLY 41 Ca 0.00 0.34 -0.07 0.00 0.00 0.00 0.00 46.02 46.29 2b3b n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b3b n ALA 42 N 0.24 -0.10 -1.26 4.61 0.00 -1.26 -3.25 120.51 119.49 2b3b n ALA 42 Ca 0.11 0.11 -0.09 0.00 0.00 0.00 0.00 53.44 53.57 2b3b n ALA 42 Cb 0.31 -1.46 -0.04 0.00 0.00 0.00 0.00 19.45 18.26 2b3b n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b3b n GLY 43 N -0.15 1.05 0.07 0.00 0.00 -1.07 -4.92 105.19 100.16 2b3b n GLY 43 Ca -0.07 -0.45 -0.12 0.00 0.00 0.00 0.00 46.02 45.38 2b3b n GLY 43 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2b3b h VAL 44 N 0.00 1.19 -0.38 1.61 2.07 -1.74 -0.58 116.25 118.42 2b3b h VAL 44 Ca -0.18 -0.58 -0.09 0.00 0.82 0.00 0.00 66.70 66.66 2b3b h VAL 44 Cb 0.67 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 2b3b h VAL 44 CO 0.27 0.16 -0.12 0.78 0.02 0.00 0.00 177.57 178.68 2b3b h ASN 45 N -0.12 0.77 -0.71 0.57 2.35 -1.84 -3.19 115.58 113.41 2b3b h ASN 45 Ca 0.02 -0.38 0.10 0.00 -0.55 0.00 0.00 56.30 55.49 2b3b h ASN 45 Cb 0.24 -0.21 -0.07 0.00 0.05 0.00 0.00 38.32 38.33 2b3b h ASN 45 CO 0.00 0.97 0.34 0.00 -1.65 0.00 0.00 177.43 177.09 2b3b h ALA 46 N 0.82 0.98 -0.51 -0.83 0.00 -1.76 -1.94 119.26 116.02 2b3b h ALA 46 Ca 0.09 0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.17 2b3b h ALA 46 Cb 0.65 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.31 2b3b h ALA 46 CO 0.04 -0.08 -0.18 0.00 0.00 0.00 0.00 179.25 179.03 2b3b h ARG 47 N 0.57 -0.06 -0.41 0.00 3.08 -1.09 0.20 114.38 116.66 2b3b h ARG 47 Ca 0.36 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.38 2b3b h ARG 47 Cb 0.41 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 2b3b h ARG 47 CO -0.29 -0.04 0.13 0.00 -1.07 0.00 0.00 179.97 178.70 2b3b h ALA 48 N 1.37 0.54 -0.35 0.04 0.00 -1.40 -0.80 119.26 118.65 2b3b h ALA 48 Ca 0.24 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 2b3b h ALA 48 Cb 0.44 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2b3b h ALA 48 CO -0.56 0.19 -0.37 0.28 0.00 0.00 0.00 179.25 178.79 2b3b h VAL 49 N 0.53 1.28 -0.51 0.00 2.07 -1.11 -2.53 116.25 115.98 2b3b h VAL 49 Ca 0.13 -1.54 0.02 0.00 0.82 0.00 0.00 66.70 66.13 2b3b h VAL 49 Cb 0.26 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2b3b h VAL 49 CO -0.00 0.51 0.31 0.25 0.02 0.00 0.00 177.57 178.65 2b3b h LEU 50 N 0.68 0.49 -0.95 2.57 5.85 -0.55 -2.28 115.31 121.13 2b3b h LEU 50 Ca 0.05 0.00 0.11 0.00 0.84 0.00 0.00 57.88 58.89 2b3b h LEU 50 Cb 0.96 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.81 2b3b h LEU 50 CO 0.09 0.35 0.58 0.50 -0.34 0.00 0.00 178.44 179.62 2b3b h LYS 51 N 0.61 0.90 -0.55 1.25 3.64 -0.98 0.11 116.57 121.55 2b3b h LYS 51 Ca 0.21 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 2b3b h LYS 51 Cb 0.02 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.61 2b3b h LYS 51 CO -0.09 0.60 0.19 1.15 -2.27 0.00 0.00 179.45 179.02 2b3b h THR 52 N 0.93 1.23 -0.15 1.00 2.02 -1.01 -1.39 112.91 115.54 2b3b h THR 52 Ca 0.46 -0.76 -0.07 0.00 0.77 0.00 0.00 66.41 66.81 2b3b h THR 52 Cb 0.44 0.69 -0.00 0.00 -1.74 0.00 0.00 68.15 67.54 2b3b h THR 52 CO -0.26 0.29 -0.19 0.03 0.37 0.00 0.00 175.52 175.76 2b3b h ARG 53 N 0.76 0.39 -0.33 6.66 3.08 -0.85 -2.02 114.38 122.06 2b3b h ARG 53 Ca 0.18 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 2b3b h ARG 53 Cb 0.25 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 2b3b h ARG 53 CO -0.01 0.79 0.16 0.52 -1.07 0.00 0.00 179.97 180.36 2b3b h MET 54 N 0.02 0.48 0.00 0.04 2.86 -0.78 0.25 114.93 117.80 2b3b h MET 54 Ca 0.02 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2b3b h MET 54 Cb 0.74 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.31 2b3b h MET 54 CO 0.04 0.44 0.00 -0.07 1.06 0.00 0.00 176.91 178.39 2b3b h LEU 55 N 0.40 0.00 -0.54 1.22 3.38 -1.31 -2.15 115.31 116.32 2b3b h LEU 55 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2b3b h LEU 55 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2b3b h LEU 55 CO -0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.13 2b3b n GLY 56 N 0.56 -0.43 2.16 0.83 0.00 -0.76 -4.94 105.19 102.62 2b3b n GLY 56 Ca 0.02 -0.32 -0.08 0.00 0.00 0.00 0.00 46.02 45.65 2b3b n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b3b n GLY 57 N 1.07 0.15 2.44 -0.02 0.00 -0.81 -4.99 105.19 103.03 2b3b n GLY 57 Ca 0.20 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 2b3b n GLY 57 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2b3b n ASP 58 N 0.43 2.19 -4.77 1.61 2.03 0.85 -5.03 116.55 113.87 2b3b n ASP 58 Ca -0.07 -3.21 -0.34 0.00 0.52 0.00 0.00 54.79 51.70 2b3b n ASP 58 Cb 0.56 -0.61 0.04 0.00 -0.72 0.00 0.00 41.12 40.39 2b3b n ASP 58 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2b3b s PRO 59 N -2.50 2.82 0.94 -0.67 0.04 -1.25 -4.47 135.00 129.90 2b3b s PRO 59 Ca 0.42 1.47 -0.14 0.00 0.04 0.00 0.00 61.00 62.79 2b3b s PRO 59 Cb 0.27 -1.95 0.19 0.00 0.04 0.00 0.00 34.50 33.05 2b3b s PRO 59 CO -0.09 -1.25 1.29 -1.25 0.04 0.00 0.00 177.00 175.74 2b3b s PRO 60 N -3.93 0.74 0.29 0.56 0.04 -1.26 -4.69 135.00 126.75 2b3b s PRO 60 Ca 0.69 -0.50 0.07 0.00 0.04 0.00 0.00 61.00 61.29 2b3b s PRO 60 Cb -0.22 -1.90 0.44 0.00 0.04 0.00 0.00 34.50 32.85 2b3b s PRO 60 CO 0.39 -2.31 1.68 -0.44 0.04 0.00 0.00 177.00 176.36 2b3b h ASP 61 N -1.52 0.22 -4.87 6.66 3.32 -1.82 -3.44 116.42 114.97 2b3b h ASP 61 Ca -0.43 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 56.51 2b3b h ASP 61 Cb 1.24 -0.06 -0.16 0.00 0.22 0.00 0.00 39.33 40.56 2b3b h ASP 61 CO 0.38 0.64 0.27 0.28 -1.72 0.00 0.00 179.24 179.10 2b3b s THR 62 N -4.05 0.00 -0.01 0.35 -1.32 -1.19 -4.23 115.64 105.19 2b3b s THR 62 Ca -0.04 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.43 2b3b s THR 62 Cb 0.13 -1.00 -0.00 0.00 -1.51 0.00 0.00 72.50 70.12 2b3b s THR 62 CO 0.77 0.00 0.02 0.72 -2.21 0.00 0.00 174.62 173.93 2b3b s PHE 63 N -2.45 0.02 0.13 9.09 -0.12 -1.26 -1.58 117.98 121.81 2b3b s PHE 63 Ca -0.03 -0.02 -0.34 0.00 -0.05 0.00 0.00 56.93 56.49 2b3b s PHE 63 Cb -0.01 -0.02 -0.13 0.00 -0.63 0.00 0.00 43.02 42.23 2b3b s PHE 63 CO -0.02 -0.05 1.65 0.94 -0.05 0.00 0.00 175.22 177.68 2b3b n GLN 64 N 2.78 2.24 -3.74 1.99 7.27 -0.09 -4.09 117.38 123.73 2b3b n GLN 64 Ca -0.14 0.81 -0.13 0.00 0.07 0.00 0.00 57.00 57.60 2b3b n GLN 64 Cb 0.59 -2.60 -0.09 0.00 2.41 0.00 0.00 30.24 30.54 2b3b n GLN 64 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2b3b s VAL 65 N 1.50 0.02 0.09 1.69 0.11 0.16 -4.93 120.40 119.04 2b3b s VAL 65 Ca 0.81 -0.16 -0.30 0.00 -2.93 0.00 0.00 61.98 59.40 2b3b s VAL 65 Cb -0.66 -0.59 -0.06 0.00 -1.53 0.00 0.00 36.38 33.54 2b3b s VAL 65 CO 0.39 -0.09 1.12 -1.00 -3.33 0.00 0.00 175.10 172.19 2b3b s HIS 66 N -0.37 3.55 0.35 1.54 3.76 -1.26 -1.21 115.29 121.64 2b3b s HIS 66 Ca -0.05 1.50 -0.29 0.00 -0.15 0.00 0.00 55.06 56.07 2b3b s HIS 66 Cb -0.03 -3.30 -0.11 0.00 1.11 0.00 0.00 32.58 30.24 2b3b s HIS 66 CO 0.02 -0.76 1.54 0.00 -0.85 0.00 0.00 174.74 174.69 2b3b n ALA 67 N 3.32 2.51 0.00 -1.40 0.00 -0.75 -2.45 120.51 121.74 2b3b n ALA 67 Ca 0.06 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2b3b n ALA 67 Cb 0.47 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.48 2b3b n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b3b n GLY 68 N 1.04 0.25 0.19 0.00 0.00 -0.85 -3.71 105.19 102.11 2b3b n GLY 68 Ca 0.04 -1.90 0.02 0.00 0.00 0.00 0.00 46.02 44.18 2b3b n GLY 68 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2b3b h MET 69 N 0.00 0.04 -0.23 1.61 2.86 -0.99 -1.42 114.93 116.79 2b3b h MET 69 Ca 0.00 -0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.64 2b3b h MET 69 Cb 0.00 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 2b3b h MET 69 CO 0.00 0.38 0.12 1.49 1.06 0.00 0.00 176.91 179.96 2b3b h GLU 70 N 0.03 0.25 0.64 1.72 4.81 -1.24 0.22 114.58 121.02 2b3b h GLU 70 Ca 0.00 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 2b3b h GLU 70 Cb 0.63 -0.06 0.01 0.00 0.63 0.00 0.00 28.75 29.96 2b3b h GLU 70 CO 0.05 0.17 -0.31 1.25 -0.73 0.00 0.00 179.01 179.44 2b3b h LEU 71 N 0.26 -0.73 -0.17 1.64 5.85 -1.09 -3.23 115.31 117.84 2b3b h LEU 71 Ca 0.09 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 2b3b h LEU 71 Cb 0.01 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 2b3b h LEU 71 CO -0.05 -0.49 0.03 0.40 -0.34 0.00 0.00 178.44 177.98 2b3b h ILE 72 N -0.91 1.22 0.00 4.05 1.08 -1.20 -3.24 117.51 118.52 2b3b h ILE 72 Ca -0.09 -0.73 0.00 0.00 -0.39 0.00 0.00 64.86 63.65 2b3b h ILE 72 Cb 0.68 1.37 0.00 0.00 -3.07 0.00 0.00 36.82 35.80 2b3b h ILE 72 CO 0.14 0.22 0.00 0.61 -0.69 0.00 0.00 178.15 178.44 2b3b n GLY 73 N -0.43 -1.19 0.00 5.37 0.00 0.75 -1.52 105.19 108.17 2b3b n GLY 73 Ca -0.05 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2b3b n GLY 73 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2b3b n THR 74 N -1.33 0.00 0.14 2.61 -1.04 -1.22 -4.78 114.28 108.66 2b3b n THR 74 Ca 0.11 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.17 2b3b n THR 74 Cb 0.23 -0.40 0.04 0.00 -1.82 0.00 0.00 70.33 68.38 2b3b n THR 74 CO 0.00 0.00 0.00 -0.50 -0.64 0.00 0.00 175.07 173.93 2b3b h TRP 75 N 0.00 0.00 0.22 -1.42 4.06 -1.77 -2.76 115.95 114.27 2b3b h TRP 75 Ca 0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 2b3b h TRP 75 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 2b3b h TRP 75 CO 0.00 0.35 -0.10 0.28 -3.56 0.00 0.00 178.44 175.40 2b3b h VAL 76 N 0.00 0.74 -0.22 1.49 2.07 -1.63 -0.85 116.25 117.84 2b3b h VAL 76 Ca -0.02 -0.96 0.06 0.00 0.82 0.00 0.00 66.70 66.60 2b3b h VAL 76 Cb 1.29 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 32.25 2b3b h VAL 76 CO 0.04 0.18 0.18 0.58 0.02 0.00 0.00 177.57 178.57 2b3b h VAL 77 N -0.86 0.72 -0.01 2.57 2.07 -1.38 -0.59 116.25 118.78 2b3b h VAL 77 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2b3b h VAL 77 Cb 0.51 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2b3b h VAL 77 CO 0.05 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.64 2b3b n ALA 78 N -2.49 2.65 -3.23 1.67 0.00 -1.04 -4.93 120.51 113.13 2b3b n ALA 78 Ca 0.02 -0.20 -0.23 0.00 0.00 0.00 0.00 53.44 53.03 2b3b n ALA 78 Cb 0.32 -1.40 0.05 0.00 0.00 0.00 0.00 19.45 18.42 2b3b n ALA 78 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2b3b n ASN 79 N -0.79 -6.19 -0.43 0.00 5.03 -0.23 -4.91 115.26 107.75 2b3b n ASN 79 Ca 0.20 -0.38 0.07 0.00 0.87 0.00 0.00 54.58 55.34 2b3b n ASN 79 Cb 0.12 -4.95 0.03 0.00 -1.02 0.00 0.00 39.78 33.95 2b3b n ASN 79 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2b3b n ARG 80 N -4.37 1.49 -4.45 3.52 5.12 -0.34 -4.97 116.66 112.66 2b3b n ARG 80 Ca -0.07 -1.01 -0.31 0.00 -1.93 0.00 0.00 57.85 54.53 2b3b n ARG 80 Cb 0.60 -1.24 -0.11 0.00 -1.16 0.00 0.00 32.46 30.55 2b3b n ARG 80 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 2b3b s MET 81 N -1.51 2.17 0.30 5.56 -1.94 -1.24 -0.97 119.30 121.67 2b3b s MET 81 Ca 0.14 -0.95 -0.28 0.00 -1.71 0.00 0.00 55.69 52.89 2b3b s MET 81 Cb 0.12 -2.29 -0.09 0.00 2.01 0.00 0.00 34.83 34.57 2b3b s MET 81 CO 0.28 0.54 0.98 -1.21 -0.01 0.00 0.00 175.02 175.60 2b3b s GLU 82 N -1.73 4.63 0.05 2.03 2.02 0.94 -4.76 118.70 121.89 2b3b s GLU 82 Ca 0.17 1.48 -0.31 0.00 0.02 0.00 0.00 54.97 56.34 2b3b s GLU 82 Cb -0.11 -2.99 -0.06 0.00 0.10 0.00 0.00 34.13 31.07 2b3b s GLU 82 CO 0.09 0.30 1.37 0.34 0.02 0.00 0.00 175.26 177.37 2b3b s ASP 83 N -1.35 6.88 -0.11 -0.19 2.15 -1.26 -4.67 116.67 118.11 2b3b s ASP 83 Ca 0.47 2.18 0.17 0.00 0.43 0.00 0.00 52.55 55.80 2b3b s ASP 83 Cb -0.24 -2.57 0.70 0.00 -0.30 0.00 0.00 42.92 40.51 2b3b s ASP 83 CO 0.30 -0.66 1.60 0.18 -0.17 0.00 0.00 175.17 176.43 2b3b n LEU 84 N 4.62 4.65 -0.19 -1.34 4.77 0.99 -4.65 117.00 125.85 2b3b n LEU 84 Ca 0.12 -2.35 0.06 0.00 -0.03 0.00 0.00 56.01 53.81 2b3b n LEU 84 Cb 0.44 -0.58 0.34 0.00 -2.33 0.00 0.00 43.42 41.29 2b3b n LEU 84 CO 0.58 0.78 1.22 0.28 -1.33 0.00 0.00 177.39 178.91 2b3b h SER 85 N 3.96 0.68 -0.28 -1.43 0.02 -1.92 -0.72 113.55 113.86 2b3b h SER 85 Ca 0.00 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.79 2b3b h SER 85 Cb 1.43 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 63.82 2b3b h SER 85 CO 0.24 0.44 -0.45 0.00 -1.14 0.00 0.00 176.83 175.92 2b3b h ALA 86 N 1.60 0.58 -0.42 3.77 0.00 -1.96 -2.07 119.26 120.76 2b3b h ALA 86 Ca 0.32 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2b3b h ALA 86 Cb 0.25 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2b3b h ALA 86 CO -0.11 0.68 0.17 1.25 0.00 0.00 0.00 179.25 181.24 2b3b h LEU 87 N 0.68 0.58 -0.81 0.00 5.85 -1.66 -0.86 115.31 119.10 2b3b h LEU 87 Ca 0.04 -0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.65 2b3b h LEU 87 Cb 1.04 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.86 2b3b h LEU 87 CO 0.10 0.59 0.49 -0.26 -0.34 0.00 0.00 178.44 179.02 2b3b h PHE 88 N 0.54 0.91 -0.13 1.25 -1.00 -1.04 -0.63 116.94 116.84 2b3b h PHE 88 Ca 0.14 0.03 -0.00 0.00 2.81 0.00 0.00 57.97 60.94 2b3b h PHE 88 Cb 0.18 -0.29 -0.01 0.00 3.61 0.00 0.00 35.95 39.44 2b3b h PHE 88 CO -0.00 0.47 0.07 0.00 -1.61 0.00 0.00 178.31 177.24 2b3b h ARG 89 N 0.91 0.18 -0.80 1.51 3.08 -1.10 -1.81 114.38 116.35 2b3b h ARG 89 Ca 0.35 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.43 2b3b h ARG 89 Cb 0.15 -0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.10 2b3b h ARG 89 CO -0.16 0.21 0.50 0.37 -1.07 0.00 0.00 179.97 179.81 2b3b h GLN 90 N 0.11 0.90 -0.01 0.04 4.15 -0.69 -2.90 115.11 116.71 2b3b h GLN 90 Ca 0.05 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.41 2b3b h GLN 90 Cb 0.08 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 27.57 2b3b h GLN 90 CO -0.01 0.60 -0.24 0.39 -1.93 0.00 0.00 178.83 177.64 2b3b n GLU 91 N -4.64 0.87 -1.66 1.69 -0.58 -0.29 -4.92 120.64 111.11 2b3b n GLU 91 Ca 0.11 -0.50 -0.09 0.00 -0.42 0.00 0.00 57.16 56.25 2b3b n GLU 91 Cb 0.15 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.50 2b3b n GLU 91 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2b3b n GLY 92 N 1.33 0.62 0.23 0.62 0.00 -0.80 -4.92 105.19 102.28 2b3b n GLY 92 Ca 0.13 -0.56 0.10 0.00 0.00 0.00 0.00 46.02 45.68 2b3b n GLY 92 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2b3b h TRP 93 N 0.00 0.00 0.00 1.61 6.55 -1.64 -2.29 115.95 120.19 2b3b h TRP 93 Ca -0.21 0.00 -0.02 0.00 0.95 0.00 0.00 58.89 59.62 2b3b h TRP 93 Cb 0.85 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 29.15 2b3b h TRP 93 CO 0.26 0.22 -0.08 -0.07 -1.05 0.00 0.00 178.44 177.71 2b3b h LEU 94 N 0.00 0.00 0.00 -4.49 3.38 -1.92 -1.83 115.31 110.45 2b3b h LEU 94 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2b3b h LEU 94 Cb 0.55 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 2b3b h LEU 94 CO 0.03 0.08 -1.63 0.00 0.09 0.00 0.00 178.44 177.01 2b3b n GLN 95 N -3.38 0.64 0.13 1.13 3.00 -0.91 -4.54 117.38 113.45 2b3b n GLN 95 Ca -0.01 -0.08 0.05 0.00 -0.01 0.00 0.00 57.00 56.96 2b3b n GLN 95 Cb 0.25 -1.64 0.03 0.00 0.00 0.00 0.00 30.24 28.88 2b3b n GLN 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2b3b h ALA 96 N 1.99 0.71 -3.49 -1.58 0.00 -0.82 -3.46 119.26 112.61 2b3b h ALA 96 Ca -0.01 -0.36 -0.66 0.00 0.00 0.00 0.00 54.91 53.88 2b3b h ALA 96 Cb 1.01 0.03 -0.15 0.00 0.00 0.00 0.00 17.79 18.68 2b3b h ALA 96 CO 0.00 0.45 -0.70 -0.06 0.00 0.00 0.00 179.25 178.94 2b3b s PHE 97 N -3.07 2.88 0.55 0.00 0.08 -0.97 -0.81 117.98 116.62 2b3b s PHE 97 Ca 0.03 -0.07 -0.21 0.00 0.12 0.00 0.00 56.93 56.79 2b3b s PHE 97 Cb 0.08 -1.52 -0.05 0.00 -0.57 0.00 0.00 43.02 40.95 2b3b s PHE 97 CO 0.75 0.44 1.25 -0.35 -0.10 0.00 0.00 175.22 177.20 2b3b n PRO 98 N 0.86 1.49 -0.23 0.24 -0.04 -1.26 -4.82 135.00 131.24 2b3b n PRO 98 Ca -0.13 0.55 -0.00 0.00 -0.04 0.00 0.00 63.50 63.88 2b3b n PRO 98 Cb 0.52 -2.44 0.11 0.00 -0.04 0.00 0.00 33.50 31.66 2b3b n PRO 98 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2b3b h LYS 99 N 1.25 0.60 -0.96 0.54 3.64 -1.98 -1.71 116.57 117.96 2b3b h LYS 99 Ca -0.50 -0.04 0.17 0.00 -1.27 0.00 0.00 60.65 59.02 2b3b h LYS 99 Cb 1.32 -0.14 -0.08 0.00 -0.41 0.00 0.00 32.23 32.92 2b3b h LYS 99 CO 0.56 0.40 0.60 0.78 -2.27 0.00 0.00 179.45 179.52 2b3b h GLY 100 N 0.62 1.42 1.30 5.01 0.00 -2.00 -0.21 103.07 109.21 2b3b h GLY 100 Ca 0.32 -0.32 -0.21 0.00 0.00 0.00 0.00 47.33 47.12 2b3b h GLY 100 CO -0.23 0.03 -0.72 -2.00 0.00 0.00 0.00 176.54 173.62 2b3b h LEU 101 N 0.71 0.82 -0.58 3.11 5.85 -1.68 -2.95 115.31 120.59 2b3b h LEU 101 Ca 0.51 -0.52 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 2b3b h LEU 101 Cb 0.84 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 2b3b h LEU 101 CO -0.27 1.30 0.27 0.40 -0.34 0.00 0.00 178.44 179.80 2b3b h ILE 102 N 0.49 1.21 -0.91 4.05 1.08 -0.92 -2.18 117.51 120.33 2b3b h ILE 102 Ca -0.04 -0.60 0.11 0.00 -0.39 0.00 0.00 64.86 63.95 2b3b h ILE 102 Cb 1.33 0.54 -0.07 0.00 -3.07 0.00 0.00 36.82 35.55 2b3b h ILE 102 CO 0.14 0.24 0.58 0.44 -0.69 0.00 0.00 178.15 178.87 2b3b h ASP 103 N 0.79 0.79 0.54 1.72 3.32 -1.04 -2.17 116.42 120.37 2b3b h ASP 103 Ca 0.20 0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.21 2b3b h ASP 103 Cb 0.13 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2b3b h ASP 103 CO -0.02 0.45 -0.31 -0.07 -1.72 0.00 0.00 179.24 177.56 2b3b h LEU 104 N 0.86 0.00 -2.08 1.55 3.38 -1.22 -2.92 115.31 114.89 2b3b h LEU 104 Ca 0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.40 2b3b h LEU 104 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2b3b h LEU 104 CO -0.20 0.31 0.00 2.30 0.09 0.00 0.00 178.44 180.94 2b3b n ILE 105 N -3.77 0.25 -4.21 1.22 -5.35 -0.91 -2.01 119.36 104.58 2b3b n ILE 105 Ca -0.01 -0.63 -0.33 0.00 -0.27 0.00 0.00 62.75 61.51 2b3b n ILE 105 Cb 0.40 1.21 -0.08 0.00 -1.74 0.00 0.00 39.64 39.43 2b3b n ILE 105 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2b3b s SER 106 N -1.60 5.37 -0.28 7.28 0.01 -0.87 -0.84 113.70 122.77 2b3b s SER 106 Ca 0.30 0.07 -0.18 0.00 1.31 0.00 0.00 55.95 57.46 2b3b s SER 106 Cb 0.19 -1.47 0.11 0.00 0.21 0.00 0.00 66.02 65.06 2b3b s SER 106 CO 0.28 0.28 0.84 -0.47 0.41 0.00 0.00 173.24 174.58 2b3b s TYR 107 N -1.12 -0.79 -1.55 2.43 5.04 -0.26 -4.94 117.35 116.16 2b3b s TYR 107 Ca 0.20 1.63 -0.11 0.00 -2.44 0.00 0.00 57.07 56.36 2b3b s TYR 107 Cb -0.12 0.47 0.09 0.00 0.35 0.00 0.00 41.96 42.75 2b3b s TYR 107 CO 0.11 -0.39 0.76 1.63 -1.34 0.00 0.00 175.55 176.32 2b3b n LYS 108 N 3.76 -4.09 -0.94 4.97 4.76 -1.26 -1.23 118.16 124.13 2b3b n LYS 108 Ca -0.18 0.47 0.00 0.00 -2.87 0.00 0.00 58.31 55.73 2b3b n LYS 108 Cb 0.58 -5.09 0.00 0.00 -1.84 0.00 0.00 35.03 28.67 2b3b n LYS 108 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2b3b n GLY 109 N -1.64 0.63 3.74 0.72 0.00 -1.26 -5.01 105.19 102.37 2b3b n GLY 109 Ca -0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 2b3b n GLY 109 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b3b s GLY 110 N -2.00 2.01 -0.08 -0.02 0.00 -0.37 -5.00 107.32 101.86 2b3b s GLY 110 Ca 0.00 -1.87 0.03 0.00 0.00 0.00 0.00 44.72 42.88 2b3b s GLY 110 CO 0.00 -1.78 -0.17 -0.42 0.00 0.00 0.00 173.10 170.73 2b3b s ILE 111 N -2.45 1.51 -0.05 0.90 1.01 -1.26 -1.10 121.20 119.75 2b3b s ILE 111 Ca 0.39 -0.70 0.01 0.00 0.00 0.00 0.00 60.65 60.34 2b3b s ILE 111 Cb -0.02 -1.33 -0.01 0.00 0.01 0.00 0.00 42.46 41.11 2b3b s ILE 111 CO 0.23 0.44 0.04 0.79 0.00 0.00 0.00 174.94 176.44 2b3b n TRP 112 N 3.63 0.00 -3.90 3.97 7.02 -0.02 -0.00 117.44 128.13 2b3b n TRP 112 Ca -0.21 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.18 2b3b n TRP 112 Cb 0.52 -0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.39 2b3b n TRP 112 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 2b3b s SER 113 N -1.20 -0.05 -0.24 -0.99 1.04 -1.26 -4.48 113.70 106.52 2b3b s SER 113 Ca 0.00 -0.90 0.00 0.00 0.48 0.00 0.00 55.95 55.53 2b3b s SER 113 Cb 0.01 0.73 0.04 0.00 0.10 0.00 0.00 66.02 66.89 2b3b s SER 113 CO 0.05 -1.39 -0.10 -0.69 0.98 0.00 0.00 173.24 172.08 2b3b s VAL 114 N -3.43 2.51 0.16 5.02 1.01 0.14 -4.91 120.40 120.90 2b3b s VAL 114 Ca 0.16 -1.20 -0.31 0.00 0.00 0.00 0.00 61.98 60.64 2b3b s VAL 114 Cb -0.04 -2.30 -0.09 0.00 0.00 0.00 0.00 36.38 33.95 2b3b s VAL 114 CO 0.10 0.19 1.46 -2.84 0.00 0.00 0.00 175.10 174.01 2b3b s PRO 115 N 1.25 4.28 -0.01 2.72 0.02 -1.26 -1.69 135.00 140.29 2b3b s PRO 115 Ca -0.02 2.22 0.22 0.00 0.02 0.00 0.00 61.00 63.44 2b3b s PRO 115 Cb -0.17 -3.18 -0.30 0.00 0.02 0.00 0.00 34.50 30.86 2b3b s PRO 115 CO -0.06 -0.49 0.57 1.55 -0.33 0.00 0.00 177.00 178.24 2b3b n VAL 116 N 3.61 0.03 -3.82 3.83 3.14 0.23 -4.60 118.33 120.75 2b3b n VAL 116 Ca 0.11 -0.43 -0.08 0.00 -2.96 0.00 0.00 64.34 60.98 2b3b n VAL 116 Cb 0.40 0.12 0.02 0.00 -1.06 0.00 0.00 33.84 33.32 2b3b n VAL 116 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2b3b s ASN 117 N -4.35 -0.04 -0.09 6.55 2.20 -1.22 -4.11 114.94 113.89 2b3b s ASN 117 Ca -0.05 -1.04 0.00 0.00 -0.94 0.00 0.00 52.86 50.82 2b3b s ASN 117 Cb 0.14 0.82 0.02 0.00 -2.00 0.00 0.00 41.25 40.23 2b3b s ASN 117 CO 0.90 -1.61 -0.07 -0.63 -2.94 0.00 0.00 177.10 172.75 2b3b s ILE 118 N -2.54 0.86 0.14 0.54 -1.09 0.60 -4.17 121.20 115.54 2b3b s ILE 118 Ca 0.15 -0.23 0.04 0.00 -2.23 0.00 0.00 60.65 58.39 2b3b s ILE 118 Cb -0.05 -0.89 -0.04 0.00 -1.58 0.00 0.00 42.46 39.90 2b3b s ILE 118 CO 0.10 0.33 0.12 -1.00 -1.23 0.00 0.00 174.94 173.26 2b3b s HIS 119 N 1.45 3.17 -0.14 3.97 3.76 -0.13 -1.31 115.29 126.06 2b3b s HIS 119 Ca -0.01 0.01 -0.03 0.00 -0.15 0.00 0.00 55.06 54.89 2b3b s HIS 119 Cb -0.13 -1.55 -0.03 0.00 1.11 0.00 0.00 32.58 31.98 2b3b s HIS 119 CO -0.04 0.52 -0.04 0.50 -0.85 0.00 0.00 174.74 174.83 2b3b s ARG 120 N -2.90 3.53 -0.06 1.40 3.52 -1.26 -1.50 118.95 121.68 2b3b s ARG 120 Ca 0.31 -0.51 -0.13 0.00 -0.13 0.00 0.00 55.73 55.26 2b3b s ARG 120 Cb -0.11 -2.87 -0.30 0.00 -1.56 0.00 0.00 34.95 30.11 2b3b s ARG 120 CO 0.23 0.32 0.66 1.03 -0.81 0.00 0.00 175.30 176.74 2b3b h SER 121 N 6.43 0.58 -1.67 -2.12 0.87 -0.66 -2.44 113.55 114.54 2b3b h SER 121 Ca -0.34 -0.92 -0.77 0.00 -1.23 0.00 0.00 61.79 58.53 2b3b h SER 121 Cb 1.19 -0.19 -0.18 0.00 -0.44 0.00 0.00 62.40 62.78 2b3b h SER 121 CO 0.61 1.74 1.81 -0.46 -0.53 0.00 0.00 176.83 180.01 2b3b n ASN 122 N -3.69 5.88 -4.15 6.23 6.94 -1.26 -3.72 115.26 121.48 2b3b n ASN 122 Ca -0.24 -3.20 -0.28 0.00 -0.02 0.00 0.00 54.58 50.84 2b3b n ASN 122 Cb 1.03 -1.41 -0.17 0.00 -2.36 0.00 0.00 39.78 36.88 2b3b n ASN 122 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2b3b s VAL 123 N -0.64 1.65 -0.23 3.53 1.01 -1.26 -1.28 120.40 123.18 2b3b s VAL 123 Ca 0.40 -0.80 -0.10 0.00 0.00 0.00 0.00 61.98 61.47 2b3b s VAL 123 Cb 0.10 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 35.00 2b3b s VAL 123 CO 0.01 0.47 0.15 -0.32 0.00 0.00 0.00 175.10 175.41 2b3b s MET 124 N 0.27 4.11 0.00 2.72 1.75 0.93 -2.15 119.30 126.93 2b3b s MET 124 Ca -0.11 -0.25 0.01 0.00 -1.25 0.00 0.00 55.69 54.09 2b3b s MET 124 Cb -0.15 -3.50 -0.04 0.00 2.84 0.00 0.00 34.83 33.98 2b3b s MET 124 CO 0.05 0.14 0.01 -1.58 -0.65 0.00 0.00 175.02 172.99 2b3b s TRP 125 N 0.84 3.09 0.29 4.11 0.52 0.04 -1.36 118.94 126.47 2b3b s TRP 125 Ca 0.08 0.09 -0.20 0.00 0.02 0.00 0.00 56.10 56.09 2b3b s TRP 125 Cb -0.13 -1.67 0.04 0.00 -1.15 0.00 0.00 33.47 30.56 2b3b s TRP 125 CO 0.02 0.47 0.79 1.52 0.02 0.00 0.00 176.95 179.77 2b3b s TYR 126 N -1.11 -0.08 -0.28 -1.98 -0.85 -0.99 -2.12 117.35 109.93 2b3b s TYR 126 Ca 0.20 -0.41 -0.07 0.00 -0.52 0.00 0.00 57.07 56.27 2b3b s TYR 126 Cb -0.12 0.74 -0.00 0.00 0.38 0.00 0.00 41.96 42.96 2b3b s TYR 126 CO 0.11 -1.26 0.08 -0.51 -1.52 0.00 0.00 175.55 172.44 2b3b s LEU 127 N -2.99 3.72 0.48 -3.49 1.43 -1.26 -0.41 118.68 116.17 2b3b s LEU 127 Ca 0.13 -0.57 0.15 0.00 -1.03 0.00 0.00 54.13 52.81 2b3b s LEU 127 Cb -0.05 -1.89 1.15 0.00 0.03 0.00 0.00 46.19 45.43 2b3b s LEU 127 CO 0.08 -0.15 2.08 1.55 0.23 0.00 0.00 176.35 180.14 2b3b h PRO 128 N 8.24 0.19 0.36 1.29 0.13 -1.83 -2.19 132.00 138.18 2b3b h PRO 128 Ca -0.34 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.77 2b3b h PRO 128 Cb 1.14 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2b3b h PRO 128 CO 0.60 0.12 -0.17 0.00 -0.23 0.00 0.00 178.00 178.32 2b3b h ALA 129 N 1.86 -0.49 -0.07 -0.56 0.00 -1.94 -2.30 119.26 115.76 2b3b h ALA 129 Ca 0.11 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.90 2b3b h ALA 129 Cb 0.19 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2b3b h ALA 129 CO -0.02 -0.73 -0.06 0.87 0.00 0.00 0.00 179.25 179.32 2b3b h LYS 130 N -0.58 -0.06 -0.44 0.00 1.79 -1.83 0.44 116.57 115.89 2b3b h LYS 130 Ca -0.05 0.00 0.09 0.00 -2.18 0.00 0.00 60.65 58.51 2b3b h LYS 130 Cb 0.43 0.01 -0.08 0.00 -1.58 0.00 0.00 32.23 31.02 2b3b h LYS 130 CO 0.08 -0.04 -0.04 -0.07 -1.08 0.00 0.00 179.45 178.29 2b3b h LEU 131 N -0.07 -0.28 -0.22 2.94 3.38 -1.54 0.37 115.31 119.89 2b3b h LEU 131 Ca 0.05 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2b3b h LEU 131 Cb 0.14 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2b3b h LEU 131 CO -0.11 -0.10 0.14 0.11 0.09 0.00 0.00 178.44 178.57 2b3b h LYS 132 N 0.06 0.30 -0.72 1.13 1.57 -0.73 0.10 116.57 118.29 2b3b h LYS 132 Ca 0.22 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 59.02 2b3b h LYS 132 Cb 0.33 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 2b3b h LYS 132 CO -0.41 0.21 0.47 0.78 -0.57 0.00 0.00 179.45 179.94 2b3b h GLY 133 N 0.29 0.97 1.82 3.86 0.00 0.47 -1.42 103.07 109.07 2b3b h GLY 133 Ca 0.08 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2b3b h GLY 133 CO -0.02 0.27 -0.04 0.79 0.00 0.00 0.00 176.54 177.54 2b3b n TRP 134 N -4.47 0.00 -1.81 5.60 8.01 0.12 -4.91 117.44 119.99 2b3b n TRP 134 Ca 0.10 0.00 -0.02 0.00 -1.31 0.00 0.00 57.50 56.27 2b3b n TRP 134 Cb 0.16 -0.43 -0.00 0.00 -2.01 0.00 0.00 31.31 29.03 2b3b n TRP 134 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2b3b n GLY 135 N 1.45 0.35 3.20 6.99 0.00 -0.51 -5.02 105.19 111.65 2b3b n GLY 135 Ca 0.08 -0.86 -0.25 0.00 0.00 0.00 0.00 46.02 44.99 2b3b n GLY 135 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2b3b s VAL 136 N -2.08 1.48 0.30 1.61 -7.23 0.25 -5.02 120.40 109.71 2b3b s VAL 136 Ca 0.00 -0.91 -0.03 0.00 -1.81 0.00 0.00 61.98 59.23 2b3b s VAL 136 Cb 0.00 -1.26 -0.05 0.00 0.56 0.00 0.00 36.38 35.64 2b3b s VAL 136 CO 0.00 0.33 0.54 0.20 -0.31 0.00 0.00 175.10 175.86 2b3b s ASN 137 N -0.67 6.40 -0.19 4.85 0.01 -1.26 -3.81 114.94 120.27 2b3b s ASN 137 Ca 0.07 0.63 -0.35 0.00 -0.71 0.00 0.00 52.86 52.50 2b3b s ASN 137 Cb -0.08 -2.11 -0.12 0.00 0.41 0.00 0.00 41.25 39.36 2b3b s ASN 137 CO 0.00 -0.22 1.96 -2.65 -1.51 0.00 0.00 177.10 174.69 2b3b n PRO 138 N -1.14 1.77 -1.93 -0.60 -0.02 -1.26 -4.93 135.00 126.89 2b3b n PRO 138 Ca -0.03 0.61 -0.41 0.00 -2.02 0.00 0.00 63.50 61.65 2b3b n PRO 138 Cb 0.54 -2.58 -0.02 0.00 -0.02 0.00 0.00 33.50 31.43 2b3b n PRO 138 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2b3b s PRO 139 N 4.69 4.22 -0.03 0.52 0.04 -1.26 -4.93 135.00 138.24 2b3b s PRO 139 Ca 0.98 2.41 0.22 0.00 0.04 0.00 0.00 61.00 64.65 2b3b s PRO 139 Cb -0.75 -3.05 -0.33 0.00 0.04 0.00 0.00 34.50 30.40 2b3b s PRO 139 CO 0.52 -0.45 0.52 0.54 0.04 0.00 0.00 177.00 178.16 2b3b n ARG 140 N 1.66 0.61 -4.38 4.56 1.74 -1.26 -4.44 116.66 115.14 2b3b n ARG 140 Ca 0.05 -0.18 -0.19 0.00 -0.77 0.00 0.00 57.85 56.75 2b3b n ARG 140 Cb 0.40 -1.52 -0.10 0.00 -1.02 0.00 0.00 32.46 30.21 2b3b n ARG 140 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2b3b s THR 141 N -3.48 1.25 0.23 0.55 -4.23 -1.26 -0.66 115.64 108.04 2b3b s THR 141 Ca -0.07 -2.05 0.02 0.00 -1.18 0.00 0.00 61.69 58.41 2b3b s THR 141 Cb 0.14 -2.47 -0.04 0.00 1.34 0.00 0.00 72.50 71.47 2b3b s THR 141 CO 0.91 -0.25 1.55 -0.50 -0.54 0.00 0.00 174.62 175.79 2b3b h TRP 142 N 2.34 0.45 -0.29 3.99 4.06 -1.94 -1.20 115.95 123.37 2b3b h TRP 142 Ca -0.39 -0.16 0.04 0.00 2.06 0.00 0.00 58.89 60.44 2b3b h TRP 142 Cb 1.23 -0.08 -0.04 0.00 -1.00 0.00 0.00 29.16 29.27 2b3b h TRP 142 CO 0.61 0.84 0.04 -0.44 -3.56 0.00 0.00 178.44 175.92 2b3b h ASP 143 N 0.27 -0.03 -0.39 -3.49 3.32 -1.99 0.66 116.42 114.77 2b3b h ASP 143 Ca 0.00 0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.04 2b3b h ASP 143 Cb 1.07 0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.68 2b3b h ASP 143 CO 0.09 0.02 0.02 0.11 -1.72 0.00 0.00 179.24 177.77 2b3b h LYS 144 N 0.14 0.76 -0.18 3.56 1.57 -1.93 -1.27 116.57 119.22 2b3b h LYS 144 Ca 0.14 -0.19 0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2b3b h LYS 144 Cb 0.16 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2b3b h LYS 144 CO -0.20 0.76 0.05 0.35 -0.57 0.00 0.00 179.45 179.84 2b3b h PHE 145 N 0.72 0.09 -0.43 -1.35 3.57 -0.75 0.20 116.94 118.98 2b3b h PHE 145 Ca 0.15 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 2b3b h PHE 145 Cb 0.41 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.11 2b3b h PHE 145 CO 0.02 0.04 0.17 -0.07 -2.23 0.00 0.00 178.31 176.24 2b3b h LEU 146 N 0.13 0.61 -0.51 0.59 3.38 -0.54 0.20 115.31 119.16 2b3b h LEU 146 Ca 0.08 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 2b3b h LEU 146 Cb 0.06 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2b3b h LEU 146 CO -0.09 0.62 0.23 0.00 0.09 0.00 0.00 178.44 179.28 2b3b h ALA 147 N 1.01 0.67 -0.43 1.53 0.00 -1.07 -1.78 119.26 119.19 2b3b h ALA 147 Ca 0.14 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 2b3b h ALA 147 Cb 0.21 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2b3b h ALA 147 CO -0.01 0.25 -0.13 1.15 0.00 0.00 0.00 179.25 180.51 2b3b h THR 148 N 0.69 1.26 -0.83 0.00 2.02 -0.40 -2.15 112.91 113.50 2b3b h THR 148 Ca 0.17 -1.21 -0.04 0.00 0.77 0.00 0.00 66.41 66.10 2b3b h THR 148 Cb 0.15 1.07 -0.04 0.00 -1.74 0.00 0.00 68.15 67.60 2b3b h THR 148 CO -0.02 0.41 0.37 0.00 0.37 0.00 0.00 175.52 176.65 2b3b h GLN 150 N 1.20 0.56 -0.28 0.00 1.08 -1.05 0.17 115.11 116.78 2b3b h GLN 150 Ca 0.28 -0.08 0.05 0.00 -1.45 0.00 0.00 58.65 57.45 2b3b h GLN 150 Cb 0.16 -0.10 -0.05 0.00 -0.05 0.00 0.00 27.48 27.44 2b3b h GLN 150 CO -0.03 0.49 -0.05 1.15 -0.95 0.00 0.00 178.83 179.44 2b3b h THR 151 N 0.49 0.75 -0.81 -0.54 2.02 -1.19 -0.67 112.91 112.94 2b3b h THR 151 Ca 0.13 -0.01 -0.03 0.00 0.77 0.00 0.00 66.41 67.28 2b3b h THR 151 Cb 0.12 0.72 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 2b3b h THR 151 CO -0.02 0.00 0.39 -0.07 0.37 0.00 0.00 175.52 176.20 2b3b h LEU 152 N 0.02 1.05 -0.87 2.58 3.38 -0.54 -1.49 115.31 119.44 2b3b h LEU 152 Ca 0.13 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2b3b h LEU 152 Cb 0.20 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 2b3b h LEU 152 CO -0.27 0.88 0.53 0.11 0.09 0.00 0.00 178.44 179.78 2b3b h LYS 153 N 1.15 1.18 0.00 1.13 1.57 -0.32 -0.83 116.57 120.45 2b3b h LYS 153 Ca 0.28 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 2b3b h LYS 153 Cb 0.10 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.16 2b3b h LYS 153 CO -0.04 0.83 -0.04 1.96 -0.57 0.00 0.00 179.45 181.59 2b3b h GLN 154 N 1.20 0.00 -0.18 3.15 4.20 -0.24 -1.55 115.11 121.69 2b3b h GLN 154 Ca 0.31 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.02 2b3b h GLN 154 Cb -0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.73 2b3b h GLN 154 CO -0.06 0.04 0.00 1.63 -0.67 0.00 0.00 178.83 179.77 2b3b n LYS 155 N -4.44 1.64 -0.43 1.46 5.02 -0.64 -4.93 118.16 115.83 2b3b n LYS 155 Ca -0.03 -0.97 0.00 0.00 -2.02 0.00 0.00 58.31 55.29 2b3b n LYS 155 Cb 0.12 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 2b3b n LYS 155 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b3b n GLY 156 N 1.05 0.77 3.43 0.72 0.00 -0.58 -5.03 105.19 105.55 2b3b n GLY 156 Ca 0.14 -0.13 -0.44 0.00 0.00 0.00 0.00 46.02 45.60 2b3b n GLY 156 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2b3b s LEU 157 N 0.00 4.95 0.14 0.99 2.96 -0.36 -4.95 118.68 122.41 2b3b s LEU 157 Ca 0.00 -1.04 -0.15 0.00 -0.22 0.00 0.00 54.13 52.72 2b3b s LEU 157 Cb 0.00 -2.43 0.01 0.00 0.50 0.00 0.00 46.19 44.26 2b3b s LEU 157 CO 0.00 -1.06 1.68 -0.08 -1.32 0.00 0.00 176.35 175.57 2b3b h GLU 158 N 9.15 0.65 -2.86 1.98 4.81 -1.86 -3.21 114.58 123.24 2b3b h GLU 158 Ca -0.28 -0.12 -0.61 0.00 -0.13 0.00 0.00 59.36 58.22 2b3b h GLU 158 Cb 1.09 -0.10 -0.40 0.00 0.63 0.00 0.00 28.75 29.96 2b3b h GLU 158 CO 1.05 0.61 -0.74 0.00 -0.73 0.00 0.00 179.01 179.20 2b3b s ALA 159 N -5.51 2.61 0.40 2.92 0.00 -1.26 -4.91 121.76 116.01 2b3b s ALA 159 Ca -0.13 -3.05 0.29 0.00 0.00 0.00 0.00 51.96 49.06 2b3b s ALA 159 Cb 0.11 -1.92 1.50 0.00 0.00 0.00 0.00 23.12 22.80 2b3b s ALA 159 CO 0.76 -2.05 2.08 -1.35 0.00 0.00 0.00 175.76 175.20 2b3b h PRO 160 N 5.90 0.00 -5.24 0.00 0.11 -1.65 -3.39 132.00 127.73 2b3b h PRO 160 Ca 0.13 0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.62 2b3b h PRO 160 Cb 0.85 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 31.83 2b3b h PRO 160 CO 0.55 0.10 -0.32 -1.17 -0.21 0.00 0.00 178.00 176.95 2b3b s LEU 161 N -7.13 4.12 0.17 2.35 2.96 -0.40 -0.62 118.68 120.13 2b3b s LEU 161 Ca -0.03 0.32 -0.28 0.00 -0.22 0.00 0.00 54.13 53.92 2b3b s LEU 161 Cb 0.13 -2.34 -0.08 0.00 0.50 0.00 0.00 46.19 44.40 2b3b s LEU 161 CO 0.57 -0.04 0.89 0.00 -1.32 0.00 0.00 176.35 176.45 2b3b s ALA 162 N 1.36 3.34 -0.03 5.97 0.00 0.65 -2.51 121.76 130.55 2b3b s ALA 162 Ca 0.14 0.52 -0.15 0.00 0.00 0.00 0.00 51.96 52.47 2b3b s ALA 162 Cb -0.15 -3.15 0.03 0.00 0.00 0.00 0.00 23.12 19.85 2b3b s ALA 162 CO 0.07 0.16 0.32 -1.17 0.00 0.00 0.00 175.76 175.14 2b3b s LEU 163 N -0.77 0.80 0.00 0.00 2.96 -1.26 -4.52 118.68 115.89 2b3b s LEU 163 Ca 0.41 0.16 0.00 0.00 -0.22 0.00 0.00 54.13 54.48 2b3b s LEU 163 Cb -0.24 1.29 0.00 0.00 0.50 0.00 0.00 46.19 47.74 2b3b s LEU 163 CO 0.29 -0.42 0.00 0.61 -1.32 0.00 0.00 176.35 175.51 2b3b n GLY 164 N 1.41 5.00 3.49 7.98 0.00 -1.26 -4.37 105.19 117.43 2b3b n GLY 164 Ca -0.21 -1.73 -0.28 0.00 0.00 0.00 0.00 46.02 43.80 2b3b n GLY 164 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2b3b s GLU 165 N 3.27 -1.03 0.26 1.61 -1.05 0.30 -4.08 118.70 117.98 2b3b s GLU 165 Ca 0.00 0.74 -0.12 0.00 -0.15 0.00 0.00 54.97 55.44 2b3b s GLU 165 Cb 0.00 -1.55 0.36 0.00 -0.44 0.00 0.00 34.13 32.50 2b3b s GLU 165 CO 0.00 -3.77 1.56 -0.97 0.95 0.00 0.00 175.26 173.03 2b3b h ASN 166 N -2.65 -1.10 0.29 0.83 -0.73 -1.87 0.11 115.58 110.46 2b3b h ASN 166 Ca -0.62 0.30 -0.04 0.00 1.87 0.00 0.00 56.30 57.81 2b3b h ASN 166 Cb 1.34 0.66 -0.01 0.00 0.27 0.00 0.00 38.32 40.58 2b3b h ASN 166 CO 0.51 -0.31 -0.21 4.11 -0.37 0.00 0.00 177.43 181.16 2b3b h TRP 167 N -0.01 0.00 0.00 0.67 5.08 -1.97 -0.72 115.95 119.01 2b3b h TRP 167 Ca 0.42 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 60.32 2b3b h TRP 167 Cb 0.67 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.82 2b3b h TRP 167 CO -0.79 0.21 -0.30 1.79 -1.28 0.00 0.00 178.44 178.07 2b3b h THR 168 N 0.00 0.79 -0.15 0.12 1.35 -1.06 0.05 112.91 114.01 2b3b h THR 168 Ca -0.00 -1.25 -0.20 0.00 -0.55 0.00 0.00 66.41 64.41 2b3b h THR 168 Cb 0.41 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 68.61 2b3b h THR 168 CO 0.03 0.29 -0.71 1.56 -0.25 0.00 0.00 175.52 176.45 2b3b h GLN 169 N 0.00 0.65 -0.56 4.72 4.20 -0.95 -0.98 115.11 122.19 2b3b h GLN 169 Ca -0.00 -0.50 -0.02 0.00 0.06 0.00 0.00 58.65 58.18 2b3b h GLN 169 Cb 0.75 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.60 2b3b h GLN 169 CO 0.04 1.12 0.26 1.96 -0.67 0.00 0.00 178.83 181.54 2b3b h GLN 170 N 0.46 0.82 -0.03 1.46 4.20 -1.10 -1.22 115.11 119.70 2b3b h GLN 170 Ca -0.03 -0.13 0.03 0.00 0.06 0.00 0.00 58.65 58.58 2b3b h GLN 170 Cb 1.31 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.90 2b3b h GLN 170 CO 0.14 0.68 -0.17 1.25 -0.67 0.00 0.00 178.83 180.06 2b3b h HIS 171 N 0.77 -0.45 -0.66 2.96 2.76 -0.84 -0.81 115.15 118.88 2b3b h HIS 171 Ca 0.19 0.02 0.08 0.00 -2.20 0.00 0.00 60.37 58.46 2b3b h HIS 171 Cb 0.14 0.20 -0.06 0.00 1.55 0.00 0.00 27.41 29.24 2b3b h HIS 171 CO 0.00 -0.25 0.33 1.25 -1.30 0.00 0.00 177.93 177.96 2b3b h LEU 172 N -0.27 0.45 -0.94 0.26 5.85 -1.14 -2.71 115.31 116.82 2b3b h LEU 172 Ca 0.06 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.89 2b3b h LEU 172 Cb 0.35 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.29 2b3b h LEU 172 CO -0.19 0.28 0.60 -0.25 -0.34 0.00 0.00 178.44 178.54 2b3b h TRP 173 N 0.59 1.12 -0.02 1.25 7.01 -0.41 -1.93 115.95 123.56 2b3b h TRP 173 Ca 0.31 0.03 -0.09 0.00 2.11 0.00 0.00 58.89 61.25 2b3b h TRP 173 Cb 0.28 -0.37 -0.01 0.00 -2.10 0.00 0.00 29.16 26.96 2b3b h TRP 173 CO -0.10 0.59 -0.41 1.05 -2.79 0.00 0.00 178.44 176.77 2b3b h GLU 174 N 1.11 0.04 -0.35 2.65 4.11 -0.84 0.33 114.58 121.62 2b3b h GLU 174 Ca 0.40 -0.02 -0.06 0.00 0.07 0.00 0.00 59.36 59.76 2b3b h GLU 174 Cb 0.13 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2b3b h GLU 174 CO -0.16 0.44 0.00 0.77 0.07 0.00 0.00 179.01 180.13 2b3b h SER 175 N 0.03 0.61 -0.05 3.06 0.02 -1.34 -1.44 113.55 114.43 2b3b h SER 175 Ca -0.00 -0.31 -0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2b3b h SER 175 Cb 0.74 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.12 2b3b h SER 175 CO 0.05 0.76 0.02 0.58 -1.14 0.00 0.00 176.83 177.11 2b3b h VAL 176 N 0.43 1.11 -0.53 2.27 2.07 -0.68 -2.50 116.25 118.42 2b3b h VAL 176 Ca 0.10 -0.33 0.10 0.00 0.82 0.00 0.00 66.70 67.39 2b3b h VAL 176 Cb 0.45 1.25 -0.09 0.00 -1.52 0.00 0.00 31.29 31.38 2b3b h VAL 176 CO 0.02 0.09 0.02 0.00 0.02 0.00 0.00 177.57 177.72 2b3b h ALA 177 N 0.89 0.53 -0.72 1.67 0.00 -0.38 -0.87 119.26 120.38 2b3b h ALA 177 Ca 0.02 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.09 2b3b h ALA 177 Cb 0.13 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 2b3b h ALA 177 CO -0.00 -0.37 0.48 1.25 0.00 0.00 0.00 179.25 180.60 2b3b h LEU 178 N 0.14 0.82 -0.11 0.00 5.85 -1.18 0.46 115.31 121.30 2b3b h LEU 178 Ca 0.27 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.87 2b3b h LEU 178 Cb 0.41 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.24 2b3b h LEU 178 CO -0.43 0.59 -0.33 0.00 -0.34 0.00 0.00 178.44 177.93 2b3b h ALA 179 N 1.55 0.19 -0.48 1.25 0.00 -0.97 0.16 119.26 120.96 2b3b h ALA 179 Ca 0.27 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 2b3b h ALA 179 Cb -0.10 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2b3b h ALA 179 CO -0.06 0.24 0.10 0.28 0.00 0.00 0.00 179.25 179.81 2b3b h VAL 180 N -0.01 1.24 0.05 0.00 2.07 -1.02 -3.33 116.25 115.26 2b3b h VAL 180 Ca -0.01 -0.87 -0.31 0.00 0.82 0.00 0.00 66.70 66.33 2b3b h VAL 180 Cb 0.95 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 2b3b h VAL 180 CO 0.07 0.31 -1.72 -0.07 0.02 0.00 0.00 177.57 176.19 2b3b h LEU 181 N 0.65 0.15 0.00 2.57 3.38 -0.95 -3.50 115.31 117.62 2b3b h LEU 181 Ca 0.15 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2b3b h LEU 181 Cb 0.36 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2b3b h LEU 181 CO 0.01 1.27 0.00 0.61 0.09 0.00 0.00 178.44 180.41 2b3b n GLY 182 N 1.66 -2.23 0.18 0.83 0.00 0.54 -4.20 105.19 101.98 2b3b n GLY 182 Ca -0.19 -1.48 0.02 0.00 0.00 0.00 0.00 46.02 44.37 2b3b n GLY 182 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2b3b h PRO 183 N 0.00 0.00 -0.02 1.61 0.13 -1.96 -0.56 132.00 131.20 2b3b h PRO 183 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2b3b h PRO 183 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2b3b h PRO 183 CO 0.00 0.38 0.00 -0.44 -0.23 0.00 0.00 178.00 177.71 2b3b h ASP 184 N 0.00 0.04 0.44 1.44 3.32 -1.96 -0.91 116.42 118.79 2b3b h ASP 184 Ca -0.00 -0.29 -0.12 0.00 0.02 0.00 0.00 57.03 56.64 2b3b h ASP 184 Cb 0.68 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 2b3b h ASP 184 CO 0.05 0.32 -0.52 0.44 -1.72 0.00 0.00 179.24 177.80 2b3b h ASP 185 N -0.25 0.10 0.20 6.45 3.32 -1.70 -0.63 116.42 123.92 2b3b h ASP 185 Ca 0.01 -0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.01 2b3b h ASP 185 Cb 0.30 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 2b3b h ASP 185 CO 0.00 0.61 -0.22 -0.25 -1.72 0.00 0.00 179.24 177.66 2b3b h TRP 186 N 0.07 -0.58 -0.90 4.55 2.91 -1.01 -2.41 115.95 118.58 2b3b h TRP 186 Ca -0.00 0.01 0.13 0.00 1.13 0.00 0.00 58.89 60.15 2b3b h TRP 186 Cb 0.95 0.23 -0.07 0.00 -0.51 0.00 0.00 29.16 29.76 2b3b h TRP 186 CO 0.01 -0.32 0.58 -0.91 -1.03 0.00 0.00 178.44 176.76 2b3b h ASN 187 N -0.46 0.72 0.74 2.65 2.35 -0.79 -2.34 115.58 118.46 2b3b h ASN 187 Ca 0.00 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2b3b h ASN 187 Cb 0.44 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.70 2b3b h ASN 187 CO -0.07 0.38 -0.11 0.78 -1.65 0.00 0.00 177.43 176.76 2b3b h ASN 188 N 0.77 0.00 -0.99 5.81 2.35 -0.65 -2.06 115.58 120.81 2b3b h ASN 188 Ca 0.44 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 56.23 2b3b h ASN 188 Cb 0.61 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.93 2b3b h ASN 188 CO -0.21 0.11 0.65 -0.07 -1.65 0.00 0.00 177.43 176.26 2b3b h LEU 189 N 0.00 1.09 0.00 1.61 3.38 -1.00 0.64 115.31 121.03 2b3b h LEU 189 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2b3b h LEU 189 Cb 0.51 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2b3b h LEU 189 CO 0.01 0.75 -0.61 0.79 0.09 0.00 0.00 178.44 179.48 2b3b n TRP 190 N -4.43 0.26 0.26 1.13 7.02 -0.79 -3.15 117.44 117.74 2b3b n TRP 190 Ca 0.13 0.08 0.08 0.00 -1.02 0.00 0.00 57.50 56.77 2b3b n TRP 190 Cb 0.08 -0.44 0.13 0.00 -2.42 0.00 0.00 31.31 28.66 2b3b n TRP 190 CO 0.00 0.00 0.00 0.27 -2.02 0.00 0.00 177.69 175.94 2b3b n ASN 191 N -1.81 2.76 0.00 -0.99 0.23 -1.16 -4.19 115.26 110.11 2b3b n ASN 191 Ca 0.04 -1.81 0.00 0.00 -0.53 0.00 0.00 54.58 52.28 2b3b n ASN 191 Cb 0.39 -0.14 0.00 0.00 -2.08 0.00 0.00 39.78 37.95 2b3b n ASN 191 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2b3b n GLY 192 N 0.91 0.68 0.10 4.83 0.00 -1.01 -4.84 105.19 105.87 2b3b n GLY 192 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.12 2b3b n GLY 192 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b3b h LYS 193 N 1.92 0.00 -5.18 1.61 1.57 -1.23 -3.42 116.57 111.83 2b3b h LYS 193 Ca 0.00 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 58.13 2b3b h LYS 193 Cb 0.00 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 32.04 2b3b h LYS 193 CO 0.00 0.74 -0.74 -1.17 -0.57 0.00 0.00 179.45 177.72 2b3b s LEU 194 N -6.71 2.84 0.41 2.94 2.96 -0.12 -4.98 118.68 116.02 2b3b s LEU 194 Ca 0.02 -0.34 -0.22 0.00 -0.22 0.00 0.00 54.13 53.37 2b3b s LEU 194 Cb 0.09 -1.68 -0.11 0.00 0.50 0.00 0.00 46.19 45.00 2b3b s LEU 194 CO 0.78 0.09 0.95 -0.54 -1.32 0.00 0.00 176.35 176.31 2b3b s LYS 195 N 0.82 4.28 0.57 1.98 1.02 -1.26 -4.15 119.74 123.01 2b3b s LYS 195 Ca -0.03 1.16 0.33 0.00 0.02 0.00 0.00 55.97 57.45 2b3b s LYS 195 Cb -0.15 -2.28 1.72 0.00 -0.52 0.00 0.00 37.83 36.60 2b3b s LYS 195 CO 0.01 0.02 2.15 0.74 -0.92 0.00 0.00 175.35 177.35 2b3b h PHE 196 N 2.11 0.00 -0.01 3.18 0.04 -1.94 -2.11 116.94 118.22 2b3b h PHE 196 Ca -0.49 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.28 2b3b h PHE 196 Cb 1.18 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.33 2b3b h PHE 196 CO 0.62 0.06 -0.12 0.25 -0.60 0.00 0.00 178.31 178.51 2b3b n THR 197 N -3.44 0.00 -1.86 -1.55 -2.24 -1.26 -3.68 114.28 100.25 2b3b n THR 197 Ca -0.02 -0.12 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 2b3b n THR 197 Cb 0.19 0.17 -0.02 0.00 -2.10 0.00 0.00 70.33 68.57 2b3b n THR 197 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2b3b s ASP 198 N -2.34 6.47 0.40 3.42 -1.08 -0.79 -4.74 116.67 118.00 2b3b s ASP 198 Ca 0.31 2.85 0.20 0.00 -0.52 0.00 0.00 52.55 55.39 2b3b s ASP 198 Cb 0.20 -2.63 1.16 0.00 -1.46 0.00 0.00 42.92 40.19 2b3b s ASP 198 CO 0.45 -0.84 1.73 -0.65 0.52 0.00 0.00 175.17 176.38 2b3b h PRO 199 N 4.85 0.32 -0.40 4.34 0.11 -1.90 0.26 132.00 139.59 2b3b h PRO 199 Ca -0.47 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.67 2b3b h PRO 199 Cb 1.22 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 2b3b h PRO 199 CO 0.78 0.21 0.16 0.87 -0.21 0.00 0.00 178.00 179.81 2b3b h LYS 200 N 0.33 0.32 -0.06 1.05 1.57 -1.94 -1.80 116.57 116.06 2b3b h LYS 200 Ca 0.66 -0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 59.23 2b3b h LYS 200 Cb 1.73 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.96 2b3b h LYS 200 CO -0.36 0.21 -0.77 0.00 -0.57 0.00 0.00 179.45 177.96 2b3b h ALA 201 N 1.25 0.57 -0.97 3.86 0.00 -0.83 -3.05 119.26 120.09 2b3b h ALA 201 Ca 0.18 -0.63 0.01 0.00 0.00 0.00 0.00 54.91 54.47 2b3b h ALA 201 Cb 0.15 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 2b3b h ALA 201 CO -0.17 0.79 0.64 0.28 0.00 0.00 0.00 179.25 180.79 2b3b h VAL 202 N 0.24 1.24 -0.49 0.00 2.07 -0.87 -2.55 116.25 115.89 2b3b h VAL 202 Ca -0.04 -0.45 0.08 0.00 0.82 0.00 0.00 66.70 67.11 2b3b h VAL 202 Cb 1.36 -0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 2b3b h VAL 202 CO 0.13 0.24 0.33 -0.09 0.02 0.00 0.00 177.57 178.20 2b3b h ARG 203 N 1.30 0.34 -0.96 1.57 2.43 -1.22 -1.20 114.38 116.64 2b3b h ARG 203 Ca 0.36 -0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.61 2b3b h ARG 203 Cb -0.13 -0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 29.27 2b3b h ARG 203 CO -0.08 0.22 0.61 0.00 -1.51 0.00 0.00 179.97 179.21 2b3b h ALA 204 N 1.74 1.56 -0.11 2.80 0.00 -1.47 -0.01 119.26 123.76 2b3b h ALA 204 Ca 0.22 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.99 2b3b h ALA 204 Cb 0.43 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2b3b h ALA 204 CO -0.05 0.24 -0.57 -1.49 0.00 0.00 0.00 179.25 177.37 2b3b h TRP 205 N 0.98 0.43 -0.32 0.00 4.06 -1.33 -1.51 115.95 118.26 2b3b h TRP 205 Ca 0.45 -0.16 -0.06 0.00 2.06 0.00 0.00 58.89 61.19 2b3b h TRP 205 Cb 0.40 -0.08 -0.01 0.00 -1.00 0.00 0.00 29.16 28.47 2b3b h TRP 205 CO -0.00 0.83 -0.02 0.93 -3.56 0.00 0.00 178.44 176.62 2b3b h GLU 206 N 0.26 0.58 -0.28 0.49 5.08 -0.96 -0.41 114.58 119.33 2b3b h GLU 206 Ca -0.00 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.14 2b3b h GLU 206 Cb 1.08 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.27 2b3b h GLU 206 CO 0.09 0.72 0.06 0.28 -1.00 0.00 0.00 179.01 179.16 2b3b h VAL 207 N 0.37 1.22 -0.86 3.13 2.07 -1.05 -2.91 116.25 118.23 2b3b h VAL 207 Ca 0.09 -0.75 0.06 0.00 0.82 0.00 0.00 66.70 66.92 2b3b h VAL 207 Cb 0.47 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 31.37 2b3b h VAL 207 CO 0.02 0.24 0.54 0.15 0.02 0.00 0.00 177.57 178.54 2b3b h PHE 208 N 0.28 0.99 -0.84 1.57 3.57 -1.18 -0.94 116.94 120.40 2b3b h PHE 208 Ca 0.09 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.70 2b3b h PHE 208 Cb 0.31 -0.32 -0.07 0.00 2.79 0.00 0.00 35.95 38.66 2b3b h PHE 208 CO 0.02 0.51 0.49 0.78 -2.23 0.00 0.00 178.31 177.88 2b3b h GLY 209 N 0.98 1.29 0.99 2.40 0.00 -1.00 0.88 103.07 108.61 2b3b h GLY 209 Ca 0.37 -0.34 -0.09 0.00 0.00 0.00 0.00 47.33 47.28 2b3b h GLY 209 CO -0.17 0.17 -0.07 3.21 0.00 0.00 0.00 176.54 179.68 2b3b h ARG 210 N 0.84 0.79 -0.62 4.80 3.08 -1.02 -2.94 114.38 119.32 2b3b h ARG 210 Ca 0.39 -0.29 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 2b3b h ARG 210 Cb 0.31 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 2b3b h ARG 210 CO -0.23 0.90 0.26 0.28 -1.07 0.00 0.00 179.97 180.11 2b3b h VAL 211 N 0.62 1.23 -0.72 2.04 2.07 -0.79 -2.56 116.25 118.14 2b3b h VAL 211 Ca 0.11 -0.70 0.13 0.00 0.82 0.00 0.00 66.70 67.06 2b3b h VAL 211 Cb 0.59 0.54 -0.05 0.00 -1.52 0.00 0.00 31.29 30.85 2b3b h VAL 211 CO 0.04 0.28 0.48 0.25 0.02 0.00 0.00 177.57 178.63 2b3b h LEU 212 N 0.86 0.43 0.00 2.57 5.85 -0.78 0.23 115.31 124.46 2b3b h LEU 212 Ca 0.21 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.94 2b3b h LEU 212 Cb 0.19 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.15 2b3b h LEU 212 CO -0.02 0.24 0.00 -0.67 -0.34 0.00 0.00 178.44 177.65 2b3b n ASP 213 N -4.48 0.00 -0.69 1.25 2.03 -0.96 -1.56 116.55 112.14 2b3b n ASP 213 Ca 0.13 0.03 0.12 0.00 0.52 0.00 0.00 54.79 55.59 2b3b n ASP 213 Cb 0.45 -0.27 0.20 0.00 -0.72 0.00 0.00 41.12 40.79 2b3b n ASP 213 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2b3b s ALA 215 N -2.15 3.82 0.31 0.00 0.00 -0.60 -1.28 121.76 121.86 2b3b s ALA 215 Ca 0.28 -1.00 -0.30 0.00 0.00 0.00 0.00 51.96 50.94 2b3b s ALA 215 Cb 0.20 -1.94 -0.12 0.00 0.00 0.00 0.00 23.12 21.26 2b3b s ALA 215 CO 0.38 0.20 1.48 0.27 0.00 0.00 0.00 175.76 178.10 2b3b n ASN 216 N -1.33 3.41 0.17 0.00 6.94 -1.04 -4.84 115.26 118.57 2b3b n ASN 216 Ca -0.06 1.17 0.13 0.00 -0.02 0.00 0.00 54.58 55.80 2b3b n ASN 216 Cb 0.56 -1.54 0.37 0.00 -2.36 0.00 0.00 39.78 36.80 2b3b n ASN 216 CO 0.00 0.00 0.00 0.11 -1.03 0.00 0.00 177.26 176.34 2b3b h LYS 217 N 3.91 0.00 -0.53 -3.83 1.79 -1.96 -2.97 116.57 112.98 2b3b h LYS 217 Ca -0.47 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 2b3b h LYS 217 Cb 1.25 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.90 2b3b h LYS 217 CO 0.73 0.00 0.00 -0.40 -1.08 0.00 0.00 179.45 178.70 2b3b n ASP 218 N -2.66 2.85 -0.32 0.86 5.75 -1.26 -4.60 116.55 117.17 2b3b n ASP 218 Ca 0.04 -2.09 0.16 0.00 -0.01 0.00 0.00 54.79 52.89 2b3b n ASP 218 Cb 0.42 -0.37 0.40 0.00 -1.03 0.00 0.00 41.12 40.54 2b3b n ASP 218 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2b3b h ALA 219 N 3.82 1.89 -0.44 2.12 0.00 -1.72 -2.92 119.26 122.00 2b3b h ALA 219 Ca 0.00 0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.07 2b3b h ALA 219 Cb 0.78 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2b3b h ALA 219 CO 0.05 -0.24 0.31 0.00 0.00 0.00 0.00 179.25 179.36 2b3b h ALA 220 N 1.63 2.24 -0.54 0.00 0.00 -1.82 -1.59 119.26 119.19 2b3b h ALA 220 Ca 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.45 2b3b h ALA 220 Cb 1.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2b3b h ALA 220 CO -0.31 -0.35 0.00 0.41 0.00 0.00 0.00 179.25 179.00 2b3b n GLY 221 N -1.58 2.91 3.78 0.00 0.00 -1.10 -4.18 105.19 105.02 2b3b n GLY 221 Ca 0.07 -0.76 -0.36 0.00 0.00 0.00 0.00 46.02 44.97 2b3b n GLY 221 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b3b s LEU 222 N -1.68 3.99 0.85 0.99 1.43 -0.67 -4.96 118.68 118.63 2b3b s LEU 222 Ca 0.43 0.31 -0.11 0.00 -1.03 0.00 0.00 54.13 53.73 2b3b s LEU 222 Cb 0.27 -1.95 0.10 0.00 0.03 0.00 0.00 46.19 44.65 2b3b s LEU 222 CO 0.22 0.39 1.09 -0.94 0.23 0.00 0.00 176.35 177.34 2b3b s SER 223 N -0.94 3.90 0.30 2.29 1.04 -1.26 -0.54 113.70 118.50 2b3b s SER 223 Ca 0.14 1.52 -0.01 0.00 0.48 0.00 0.00 55.95 58.08 2b3b s SER 223 Cb -0.12 -2.22 0.47 0.00 0.10 0.00 0.00 66.02 64.26 2b3b s SER 223 CO 0.03 -2.37 1.96 4.11 0.98 0.00 0.00 173.24 177.95 2b3b h TRP 224 N -1.36 1.03 -0.78 5.02 5.08 -1.97 -2.29 115.95 120.67 2b3b h TRP 224 Ca -0.48 0.02 -0.02 0.00 1.08 0.00 0.00 58.89 59.50 2b3b h TRP 224 Cb 1.27 -0.35 -0.04 0.00 -3.00 0.00 0.00 29.16 27.05 2b3b h TRP 224 CO 0.47 0.63 0.42 1.96 -1.28 0.00 0.00 178.44 180.63 2b3b h GLN 225 N 1.09 1.09 -0.37 0.12 7.50 -1.99 -1.60 115.11 120.96 2b3b h GLN 225 Ca 0.32 -0.13 -0.07 0.00 0.50 0.00 0.00 58.65 59.26 2b3b h GLN 225 Cb -0.06 -0.21 -0.02 0.00 0.05 0.00 0.00 27.48 27.24 2b3b h GLN 225 CO -0.08 0.82 -0.05 1.96 -1.50 0.00 0.00 178.83 179.98 2b3b h GLN 226 N 1.08 0.60 -0.48 1.46 4.20 -1.82 0.47 115.11 120.63 2b3b h GLN 226 Ca 0.27 -0.16 -0.09 0.00 0.06 0.00 0.00 58.65 58.73 2b3b h GLN 226 Cb 0.05 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 2b3b h GLN 226 CO -0.04 0.67 -0.06 0.00 -0.67 0.00 0.00 178.83 178.72 2b3b h ALA 227 N 1.38 0.66 -0.79 3.87 0.00 -1.03 -2.47 119.26 120.87 2b3b h ALA 227 Ca 0.11 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.72 2b3b h ALA 227 Cb 0.44 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2b3b h ALA 227 CO 0.02 0.52 0.52 0.28 0.00 0.00 0.00 179.25 180.58 2b3b h VAL 228 N 0.74 1.17 -0.91 0.00 2.07 -0.94 -2.56 116.25 115.83 2b3b h VAL 228 Ca 0.13 -0.35 0.13 0.00 0.82 0.00 0.00 66.70 67.42 2b3b h VAL 228 Cb 0.60 0.04 -0.07 0.00 -1.52 0.00 0.00 31.29 30.34 2b3b h VAL 228 CO 0.04 0.19 0.58 0.44 0.02 0.00 0.00 177.57 178.84 2b3b h ASP 229 N 1.03 0.74 -0.91 0.57 3.32 -0.63 -0.96 116.42 119.58 2b3b h ASP 229 Ca 0.30 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.40 2b3b h ASP 229 Cb -0.06 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.33 2b3b h ASP 229 CO -0.09 0.40 0.61 0.03 -1.72 0.00 0.00 179.24 178.47 2b3b h ARG 230 N 0.80 1.20 -0.03 3.56 3.08 -1.01 0.32 114.38 122.30 2b3b h ARG 230 Ca 0.45 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.42 2b3b h ARG 230 Cb 0.59 -0.27 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 2b3b h ARG 230 CO -0.21 0.80 -0.00 0.28 -1.07 0.00 0.00 179.97 179.76 2b3b h VAL 231 N 1.24 1.27 -0.88 2.04 2.07 -1.18 0.11 116.25 120.92 2b3b h VAL 231 Ca 0.33 -0.82 0.10 0.00 0.82 0.00 0.00 66.70 67.13 2b3b h VAL 231 Cb -0.14 1.76 -0.06 0.00 -1.52 0.00 0.00 31.29 31.33 2b3b h VAL 231 CO -0.07 0.22 0.57 0.58 0.02 0.00 0.00 177.57 178.89 2b3b h VAL 232 N -0.27 0.96 -0.00 2.57 2.07 -0.64 -1.72 116.25 119.22 2b3b h VAL 232 Ca 0.01 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2b3b h VAL 232 Cb 0.36 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 2b3b h VAL 232 CO 0.00 0.16 -0.00 0.00 0.02 0.00 0.00 177.57 177.75 2b3b n GLN 233 N -4.53 0.25 -1.00 1.57 6.02 0.11 -4.91 117.38 114.89 2b3b n GLN 233 Ca 0.15 -0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 57.14 2b3b n GLN 233 Cb 0.32 -1.50 -0.00 0.00 1.02 0.00 0.00 30.24 30.08 2b3b n GLN 233 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2b3b n GLY 234 N 1.37 0.46 0.12 1.08 0.00 -0.65 -4.88 105.19 102.70 2b3b n GLY 234 Ca 0.11 -0.01 0.14 0.00 0.00 0.00 0.00 46.02 46.27 2b3b n GLY 234 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b3b n LYS 235 N -2.71 0.76 -3.72 1.61 5.02 0.34 -4.82 118.16 114.65 2b3b n LYS 235 Ca -0.00 -0.23 -0.13 0.00 -2.02 0.00 0.00 58.31 55.93 2b3b n LYS 235 Cb 0.04 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.48 2b3b n LYS 235 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2b3b s ALA 236 N -2.40 -0.85 -0.12 7.82 0.00 -0.86 -4.61 121.76 120.74 2b3b s ALA 236 Ca 0.31 0.22 0.02 0.00 0.00 0.00 0.00 51.96 52.50 2b3b s ALA 236 Cb 0.20 0.27 -0.24 0.00 0.00 0.00 0.00 23.12 23.35 2b3b s ALA 236 CO 0.45 -0.40 0.37 0.00 0.00 0.00 0.00 175.76 176.19 2b3b n ALA 237 N 0.70 1.16 -2.71 0.00 0.00 0.21 -4.27 120.51 115.60 2b3b n ALA 237 Ca -0.19 -0.75 -0.13 0.00 0.00 0.00 0.00 53.44 52.37 2b3b n ALA 237 Cb 0.59 -0.64 -0.11 0.00 0.00 0.00 0.00 19.45 19.29 2b3b n ALA 237 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2b3b s PHE 238 N -2.56 0.76 -0.07 0.00 0.08 -0.69 -4.38 117.98 111.12 2b3b s PHE 238 Ca -0.18 -0.58 -0.05 0.00 0.12 0.00 0.00 56.93 56.25 2b3b s PHE 238 Cb 0.07 -0.45 0.03 0.00 -0.57 0.00 0.00 43.02 42.10 2b3b s PHE 238 CO 0.77 -0.08 0.17 1.21 -0.10 0.00 0.00 175.22 177.18 2b3b s ASN 239 N -1.89 -0.16 -0.35 1.36 3.04 -0.90 -0.25 114.94 115.79 2b3b s ASN 239 Ca -0.05 0.34 -0.11 0.00 0.04 0.00 0.00 52.86 53.08 2b3b s ASN 239 Cb -0.07 0.29 0.00 0.00 -1.54 0.00 0.00 41.25 39.94 2b3b s ASN 239 CO -0.00 -0.10 0.21 -0.63 -3.04 0.00 0.00 177.10 173.54 2b3b s ILE 240 N 0.56 4.84 0.08 -5.21 -1.09 -1.26 -0.78 121.20 118.33 2b3b s ILE 240 Ca -0.04 -0.53 -0.25 0.00 -2.23 0.00 0.00 60.65 57.60 2b3b s ILE 240 Cb -0.05 -3.57 0.07 0.00 -1.58 0.00 0.00 42.46 37.32 2b3b s ILE 240 CO -0.03 -0.09 0.61 -0.32 -1.23 0.00 0.00 174.94 173.88 2b3b s MET 241 N 1.63 1.17 0.85 2.79 1.75 -0.91 -4.60 119.30 121.97 2b3b s MET 241 Ca 0.04 -0.21 -0.11 0.00 -1.25 0.00 0.00 55.69 54.16 2b3b s MET 241 Cb -0.18 0.54 0.10 0.00 2.84 0.00 0.00 34.83 38.13 2b3b s MET 241 CO 0.08 -0.46 1.10 0.20 -0.65 0.00 0.00 175.02 175.29 2b3b s GLY 242 N -2.15 1.66 0.00 2.11 0.00 -1.24 -3.99 107.32 103.71 2b3b s GLY 242 Ca -0.04 0.24 0.04 0.00 0.00 0.00 0.00 44.72 44.96 2b3b s GLY 242 CO -0.04 0.65 0.96 2.09 0.00 0.00 0.00 173.10 176.76 2b3b n ASP 243 N -3.81 0.00 0.32 1.64 5.68 -0.92 -1.51 116.55 117.95 2b3b n ASP 243 Ca 0.09 -1.45 0.20 0.00 -0.50 0.00 0.00 54.79 53.13 2b3b n ASP 243 Cb 0.53 0.00 1.09 0.00 -1.14 0.00 0.00 41.12 41.61 2b3b n ASP 243 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 2b3b h TRP 244 N 0.00 0.00 -0.30 2.11 0.09 -1.82 -2.06 115.95 113.97 2b3b h TRP 244 Ca 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 58.89 58.89 2b3b h TRP 244 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 29.16 29.22 2b3b h TRP 244 CO 0.00 0.00 -0.18 0.00 0.09 0.00 0.00 178.44 178.35 2b3b h ALA 245 N 1.93 1.13 -0.48 0.11 0.00 -1.55 -0.90 119.26 119.49 2b3b h ALA 245 Ca 0.01 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 2b3b h ALA 245 Cb 0.09 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2b3b h ALA 245 CO -0.00 0.54 0.06 0.00 0.00 0.00 0.00 179.25 179.85 2b3b h ALA 246 N 1.32 0.64 -0.66 0.00 0.00 -1.60 -1.18 119.26 117.77 2b3b h ALA 246 Ca 0.08 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2b3b h ALA 246 Cb 0.59 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2b3b h ALA 246 CO 0.04 0.40 0.30 0.78 0.00 0.00 0.00 179.25 180.76 2b3b h GLY 247 N 0.68 1.04 0.95 0.00 0.00 -1.43 -0.97 103.07 103.33 2b3b h GLY 247 Ca 0.14 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 2b3b h GLY 247 CO 0.01 0.51 0.13 -1.82 0.00 0.00 0.00 176.54 175.37 2b3b h TYR 248 N 0.93 0.34 -0.22 5.60 3.20 -1.01 0.47 116.97 126.27 2b3b h TYR 248 Ca 0.22 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.02 2b3b h TYR 248 Cb 0.15 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 2b3b h TYR 248 CO 0.01 0.29 -0.16 0.52 -1.64 0.00 0.00 178.16 177.18 2b3b h MET 249 N 0.28 0.37 0.00 1.82 2.86 -1.04 -1.39 114.93 117.83 2b3b h MET 249 Ca 0.09 -0.11 -0.08 0.00 -2.06 0.00 0.00 59.70 57.54 2b3b h MET 249 Cb 0.07 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 2b3b h MET 249 CO -0.01 0.53 -0.77 0.25 1.06 0.00 0.00 176.91 177.97 2b3b n THR 250 N -4.20 1.46 -0.06 2.22 -2.24 -0.38 -0.09 114.28 110.98 2b3b n THR 250 Ca -0.00 0.13 -0.10 0.00 -2.27 0.00 0.00 64.05 61.81 2b3b n THR 250 Cb 0.32 -2.27 0.04 0.00 -2.10 0.00 0.00 70.33 66.32 2b3b n THR 250 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2b3b h THR 251 N -1.00 1.29 0.00 4.28 2.02 -0.16 -2.13 112.91 117.21 2b3b h THR 251 Ca -0.12 -1.60 -0.24 0.00 0.77 0.00 0.00 66.41 65.22 2b3b h THR 251 Cb 0.78 1.51 -0.04 0.00 -1.74 0.00 0.00 68.15 68.67 2b3b h THR 251 CO -0.07 0.52 -1.62 0.41 0.37 0.00 0.00 175.52 175.12 2b3b n THR 252 N -4.03 1.51 1.15 3.16 -1.04 -0.59 -4.52 114.28 109.91 2b3b n THR 252 Ca -0.02 -0.10 0.13 0.00 -2.04 0.00 0.00 64.05 62.02 2b3b n THR 252 Cb 0.55 -2.10 0.49 0.00 -1.82 0.00 0.00 70.33 67.44 2b3b n THR 252 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2b3b n LEU 253 N -4.39 0.36 -3.26 -4.42 4.77 -0.78 -4.96 117.00 104.32 2b3b n LEU 253 Ca -0.33 0.14 -0.23 0.00 -0.03 0.00 0.00 56.01 55.55 2b3b n LEU 253 Cb 0.67 -0.30 0.02 0.00 -2.33 0.00 0.00 43.42 41.49 2b3b n LEU 253 CO 0.12 0.08 0.01 0.29 -1.33 0.00 0.00 177.39 176.56 2b3b n LYS 254 N -1.28 -4.68 -2.95 3.23 4.76 -0.80 -4.94 118.16 111.50 2b3b n LYS 254 Ca 0.09 0.73 -0.32 0.00 -2.87 0.00 0.00 58.31 55.94 2b3b n LYS 254 Cb 0.32 -5.56 -0.06 0.00 -1.84 0.00 0.00 35.03 27.89 2b3b n LYS 254 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2b3b s LEU 255 N -6.72 3.97 -0.26 -0.35 1.43 0.87 -4.97 118.68 112.64 2b3b s LEU 255 Ca 0.39 1.43 -0.18 0.00 -1.03 0.00 0.00 54.13 54.74 2b3b s LEU 255 Cb -0.19 -4.27 -0.03 0.00 0.03 0.00 0.00 46.19 41.74 2b3b s LEU 255 CO 0.48 -0.30 0.51 -0.54 0.23 0.00 0.00 176.35 176.73 2b3b s LYS 256 N -3.21 4.05 0.21 1.70 1.02 -1.26 -4.30 119.74 117.95 2b3b s LYS 256 Ca 0.57 0.30 -0.32 0.00 0.02 0.00 0.00 55.97 56.53 2b3b s LYS 256 Cb -0.10 -3.66 -0.13 0.00 -0.52 0.00 0.00 37.83 33.42 2b3b s LYS 256 CO 0.18 -0.36 1.54 -0.35 -0.92 0.00 0.00 175.35 175.44 2b3b n PRO 257 N 5.54 2.23 0.00 -1.68 -0.04 -1.26 -1.16 135.00 138.63 2b3b n PRO 257 Ca -0.04 0.80 0.00 0.00 -0.04 0.00 0.00 63.50 64.22 2b3b n PRO 257 Cb 0.50 -2.54 0.00 0.00 -0.04 0.00 0.00 33.50 31.42 2b3b n PRO 257 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2b3b n GLY 258 N 2.91 2.93 0.59 0.55 0.00 0.87 -4.75 105.19 108.29 2b3b n GLY 258 Ca 0.14 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.06 2b3b n GLY 258 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b3b n THR 259 N -0.27 1.01 0.13 2.61 -2.24 -1.11 -4.64 114.28 109.77 2b3b n THR 259 Ca 0.00 0.02 -0.01 0.00 -2.27 0.00 0.00 64.05 61.78 2b3b n THR 259 Cb 0.00 -1.80 0.16 0.00 -2.10 0.00 0.00 70.33 66.59 2b3b n THR 259 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2b3b h ASP 260 N -0.48 0.00 -5.16 3.42 3.32 -1.43 -3.42 116.42 112.67 2b3b h ASP 260 Ca -0.19 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.80 2b3b h ASP 260 Cb 0.94 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.37 2b3b h ASP 260 CO -0.12 0.63 -0.13 0.72 -1.72 0.00 0.00 179.24 178.62 2b3b s PHE 261 N -3.58 0.10 0.27 4.55 -0.12 -1.23 -4.68 117.98 113.29 2b3b s PHE 261 Ca -0.01 -0.45 0.02 0.00 -0.05 0.00 0.00 56.93 56.43 2b3b s PHE 261 Cb 0.13 0.18 -0.03 0.00 -0.63 0.00 0.00 43.02 42.67 2b3b s PHE 261 CO 0.76 -0.81 0.25 0.00 -0.05 0.00 0.00 175.22 175.37 2b3b s ALA 262 N -3.91 1.33 0.03 1.99 0.00 0.45 -0.09 121.76 121.56 2b3b s ALA 262 Ca 0.12 -1.79 -0.09 0.00 0.00 0.00 0.00 51.96 50.20 2b3b s ALA 262 Cb 0.01 1.38 0.00 0.00 0.00 0.00 0.00 23.12 24.52 2b3b s ALA 262 CO -0.03 -0.66 0.19 1.67 0.00 0.00 0.00 175.76 176.94 2b3b s TRP 263 N -3.75 0.05 0.16 0.00 -2.14 -1.26 -2.35 118.94 109.65 2b3b s TRP 263 Ca 0.38 -0.23 -0.08 0.00 2.66 0.00 0.00 56.10 58.83 2b3b s TRP 263 Cb 0.04 -0.03 -0.01 0.00 -3.10 0.00 0.00 33.47 30.37 2b3b s TRP 263 CO 0.19 -0.40 0.26 0.00 -2.66 0.00 0.00 176.95 174.34 2b3b s ALA 264 N -2.28 0.06 0.73 2.67 0.00 -0.47 -4.98 121.76 117.50 2b3b s ALA 264 Ca -0.07 -0.92 -0.16 0.00 0.00 0.00 0.00 51.96 50.81 2b3b s ALA 264 Cb -0.02 0.85 0.03 0.00 0.00 0.00 0.00 23.12 23.98 2b3b s ALA 264 CO -0.02 -0.63 1.12 -2.30 0.00 0.00 0.00 175.76 173.93 2b3b n PRO 265 N -0.20 0.54 -1.62 0.00 -0.02 -1.26 -0.05 135.00 132.39 2b3b n PRO 265 Ca -0.07 0.25 -0.43 0.00 -2.02 0.00 0.00 63.50 61.23 2b3b n PRO 265 Cb 0.63 -2.37 -0.00 0.00 -0.02 0.00 0.00 33.50 31.74 2b3b n PRO 265 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2b3b n SER 266 N -2.25 1.58 -4.56 2.55 7.64 -0.41 -4.30 113.62 113.87 2b3b n SER 266 Ca 0.14 1.13 -0.52 0.00 1.01 0.00 0.00 58.87 60.62 2b3b n SER 266 Cb 0.49 -1.35 -0.06 0.00 -1.01 0.00 0.00 64.21 62.28 2b3b n SER 266 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2b3b n PRO 267 N 0.47 0.87 -1.00 1.43 -0.02 -1.26 -1.45 135.00 134.04 2b3b n PRO 267 Ca 0.08 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 2b3b n PRO 267 Cb 0.36 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2b3b n PRO 267 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b3b n GLY 268 N 2.14 0.40 0.00 -1.23 0.00 0.17 -4.59 105.19 102.08 2b3b n GLY 268 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2b3b n GLY 268 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b3b n THR 269 N -2.79 0.39 -1.49 2.61 -2.24 -0.53 -4.37 114.28 105.87 2b3b n THR 269 Ca 0.00 -0.57 -0.58 0.00 -2.27 0.00 0.00 64.05 60.63 2b3b n THR 269 Cb 0.10 0.93 -0.08 0.00 -2.10 0.00 0.00 70.33 69.18 2b3b n THR 269 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b3b n GLN 270 N -0.19 0.00 -0.67 -0.78 3.00 -1.26 -1.16 117.38 116.31 2b3b n GLN 270 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2b3b n GLN 270 Cb 0.19 -1.44 0.00 0.00 0.00 0.00 0.00 30.24 28.99 2b3b n GLN 270 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2b3b n GLY 271 N 1.88 1.09 3.20 1.08 0.00 -1.26 -5.03 105.19 106.16 2b3b n GLY 271 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 2b3b n GLY 271 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b3b s VAL 272 N -3.46 2.12 -0.39 1.61 1.01 -0.31 -1.78 120.40 119.20 2b3b s VAL 272 Ca 0.00 -0.98 -0.10 0.00 0.00 0.00 0.00 61.98 60.90 2b3b s VAL 272 Cb 0.00 -1.83 0.05 0.00 0.00 0.00 0.00 36.38 34.60 2b3b s VAL 272 CO 0.00 0.55 0.23 0.12 0.00 0.00 0.00 175.10 176.00 2b3b s PHE 273 N 0.57 3.28 -0.53 5.22 5.99 0.28 -4.96 117.98 127.84 2b3b s PHE 273 Ca -0.13 -1.25 -0.25 0.00 0.00 0.00 0.00 56.93 55.31 2b3b s PHE 273 Cb -0.17 -2.67 0.04 0.00 0.00 0.00 0.00 43.02 40.22 2b3b s PHE 273 CO 0.04 -0.75 0.95 1.41 -0.00 0.00 0.00 175.22 176.87 2b3b s MET 274 N 1.49 3.39 0.26 10.12 -2.45 -1.26 -1.72 119.30 129.13 2b3b s MET 274 Ca 0.02 -0.12 0.06 0.00 -1.25 0.00 0.00 55.69 54.39 2b3b s MET 274 Cb -0.21 -4.02 -0.03 0.00 1.25 0.00 0.00 34.83 31.83 2b3b s MET 274 CO 0.04 -1.43 0.36 0.00 1.05 0.00 0.00 175.02 175.05 2b3b s MET 275 N 3.96 3.31 0.18 4.11 0.00 -0.05 0.11 119.30 130.92 2b3b s MET 275 Ca 0.33 -0.85 -0.12 0.00 0.00 0.00 0.00 55.69 55.06 2b3b s MET 275 Cb -0.12 -2.83 0.00 0.00 0.00 0.00 0.00 34.83 31.88 2b3b s MET 275 CO 0.21 0.36 0.37 -0.48 0.00 0.00 0.00 175.02 175.48 2b3b s LEU 276 N -4.00 0.66 -0.09 0.18 2.34 -0.56 -1.18 118.68 116.03 2b3b s LEU 276 Ca 0.36 -0.78 -0.04 0.00 0.06 0.00 0.00 54.13 53.74 2b3b s LEU 276 Cb -0.09 1.50 0.05 0.00 -0.56 0.00 0.00 46.19 47.09 2b3b s LEU 276 CO 0.29 -0.96 0.18 -0.55 -1.06 0.00 0.00 176.35 174.25 2b3b s SER 277 N -2.95 0.31 0.10 1.48 0.15 -1.26 -0.96 113.70 110.57 2b3b s SER 277 Ca 0.16 0.39 -0.30 0.00 0.70 0.00 0.00 55.95 56.89 2b3b s SER 277 Cb 0.02 0.33 -0.06 0.00 -1.71 0.00 0.00 66.02 64.60 2b3b s SER 277 CO 0.00 -0.21 0.98 -1.81 1.20 0.00 0.00 173.24 173.41 2b3b s ASP 278 N 1.85 7.46 0.05 5.45 1.01 -1.26 -1.81 116.67 129.42 2b3b s ASP 278 Ca -0.02 1.81 -0.01 0.00 0.71 0.00 0.00 52.55 55.03 2b3b s ASP 278 Cb -0.12 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.19 2b3b s ASP 278 CO -0.07 -0.11 -0.02 -0.94 0.21 0.00 0.00 175.17 174.24 2b3b s SER 279 N 0.12 0.46 -0.03 0.27 1.04 -0.35 -0.60 113.70 114.61 2b3b s SER 279 Ca 0.48 -0.95 0.04 0.00 0.48 0.00 0.00 55.95 56.01 2b3b s SER 279 Cb -0.24 0.20 -0.01 0.00 0.10 0.00 0.00 66.02 66.07 2b3b s SER 279 CO 0.30 -0.58 -0.15 -0.36 0.98 0.00 0.00 173.24 173.43 2b3b s PHE 280 N -3.71 1.43 0.00 5.02 0.08 -0.68 -0.67 117.98 119.44 2b3b s PHE 280 Ca 0.05 -0.34 0.00 0.00 0.12 0.00 0.00 56.93 56.76 2b3b s PHE 280 Cb 0.06 -0.95 0.00 0.00 -0.57 0.00 0.00 43.02 41.57 2b3b s PHE 280 CO -0.09 -0.09 0.00 0.41 -0.10 0.00 0.00 175.22 175.35 2b3b n GLY 281 N 2.96 5.34 2.94 4.36 0.00 -1.26 0.26 105.19 119.80 2b3b n GLY 281 Ca -0.16 -2.15 -0.31 0.00 0.00 0.00 0.00 46.02 43.40 2b3b n GLY 281 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2b3b s LEU 282 N 0.00 4.04 0.27 0.99 2.96 -1.26 -4.41 118.68 121.27 2b3b s LEU 282 Ca 0.00 -2.00 -0.30 0.00 -0.22 0.00 0.00 54.13 51.61 2b3b s LEU 282 Cb 0.00 -1.42 -0.10 0.00 0.50 0.00 0.00 46.19 45.17 2b3b s LEU 282 CO 0.00 -0.39 1.47 -2.84 -1.32 0.00 0.00 176.35 173.27 2b3b s PRO 283 N 1.10 4.23 0.38 0.98 0.02 -1.26 -0.04 135.00 140.41 2b3b s PRO 283 Ca 0.10 2.37 -0.28 0.00 0.02 0.00 0.00 61.00 63.21 2b3b s PRO 283 Cb -0.19 -3.08 -0.11 0.00 0.02 0.00 0.00 34.50 31.14 2b3b s PRO 283 CO -0.13 -0.46 1.45 1.63 -0.33 0.00 0.00 177.00 179.16 2b3b n LYS 284 N 2.19 2.57 -0.81 5.54 5.02 -0.15 -2.22 118.16 130.30 2b3b n LYS 284 Ca 0.07 0.90 0.00 0.00 -2.02 0.00 0.00 58.31 57.26 2b3b n LYS 284 Cb 0.40 -2.61 0.00 0.00 -0.02 0.00 0.00 35.03 32.79 2b3b n LYS 284 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b3b n GLY 285 N 0.51 0.76 3.61 0.72 0.00 -1.26 -4.86 105.19 104.67 2b3b n GLY 285 Ca 0.02 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.57 2b3b n GLY 285 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b3b n ALA 286 N 0.44 -0.13 0.09 4.61 0.00 -0.94 -4.81 120.51 119.76 2b3b n ALA 286 Ca 0.00 0.45 -0.06 0.00 0.00 0.00 0.00 53.44 53.83 2b3b n ALA 286 Cb 0.00 -2.11 0.01 0.00 0.00 0.00 0.00 19.45 17.35 2b3b n ALA 286 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2b3b h LYS 287 N 3.65 0.07 -2.21 0.00 1.57 -1.87 -3.34 116.57 114.44 2b3b h LYS 287 Ca -0.44 -0.08 -0.60 0.00 -1.87 0.00 0.00 60.65 57.67 2b3b h LYS 287 Cb 1.32 0.02 -0.42 0.00 0.08 0.00 0.00 32.23 33.23 2b3b h LYS 287 CO 0.72 0.87 -0.61 0.09 -0.57 0.00 0.00 179.45 179.95 2b3b n ASN 288 N -3.59 3.90 -0.08 0.86 3.02 -1.26 -4.95 115.26 113.16 2b3b n ASN 288 Ca -0.02 -3.50 -0.10 0.00 -0.03 0.00 0.00 54.58 50.94 2b3b n ASN 288 Cb 0.80 -0.65 -0.03 0.00 -0.61 0.00 0.00 39.78 39.29 2b3b n ASN 288 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 2b3b h ARG 289 N 3.90 0.38 -0.44 3.52 2.43 -1.94 -0.71 114.38 121.53 2b3b h ARG 289 Ca 0.18 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.17 2b3b h ARG 289 Cb 0.63 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 2b3b h ARG 289 CO 0.83 0.37 -0.21 0.37 -1.51 0.00 0.00 179.97 179.82 2b3b h GLN 290 N 0.30 0.90 -0.95 0.20 5.75 -1.94 -0.75 115.11 118.61 2b3b h GLN 290 Ca 0.09 -0.37 -0.00 0.00 -0.15 0.00 0.00 58.65 58.22 2b3b h GLN 290 Cb 0.12 -0.04 -0.05 0.00 1.07 0.00 0.00 27.48 28.58 2b3b h GLN 290 CO -0.01 1.02 0.58 -0.91 -2.65 0.00 0.00 178.83 176.86 2b3b h ASN 291 N 0.78 1.14 -0.33 -0.69 2.35 -1.79 -1.70 115.58 115.33 2b3b h ASN 291 Ca 0.10 -0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2b3b h ASN 291 Cb 0.76 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 2b3b h ASN 291 CO 0.06 0.87 0.12 0.00 -1.65 0.00 0.00 177.43 176.83 2b3b h ALA 292 N 1.32 0.43 -0.87 -0.83 0.00 -0.81 -1.25 119.26 117.24 2b3b h ALA 292 Ca 0.34 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 55.22 2b3b h ALA 292 Cb -0.06 -0.13 -0.08 0.00 0.00 0.00 0.00 17.79 17.52 2b3b h ALA 292 CO -0.06 0.05 0.50 0.82 0.00 0.00 0.00 179.25 180.56 2b3b h ILE 293 N 0.38 0.86 -0.30 0.00 2.04 -0.89 0.82 117.51 120.42 2b3b h ILE 293 Ca 0.11 -0.27 -0.09 0.00 1.00 0.00 0.00 64.86 65.61 2b3b h ILE 293 Cb 0.21 -0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.28 2b3b h ILE 293 CO -0.01 0.15 -0.18 0.78 0.00 0.00 0.00 178.15 178.89 2b3b h ASN 294 N 0.80 0.54 -0.08 1.72 2.35 -1.00 -0.74 115.58 119.17 2b3b h ASN 294 Ca 0.44 -0.16 0.01 0.00 -0.55 0.00 0.00 56.30 56.04 2b3b h ASN 294 Cb 0.47 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 2b3b h ASN 294 CO -0.28 0.73 0.00 -0.25 -1.65 0.00 0.00 177.43 175.98 2b3b h TRP 295 N 0.49 0.00 -0.95 1.19 2.91 0.07 -1.97 115.95 117.69 2b3b h TRP 295 Ca 0.08 0.01 0.05 0.00 1.13 0.00 0.00 58.89 60.15 2b3b h TRP 295 Cb 0.59 0.01 -0.06 0.00 -0.51 0.00 0.00 29.16 29.19 2b3b h TRP 295 CO 0.02 -0.00 0.62 -0.07 -1.03 0.00 0.00 178.44 177.98 2b3b h LEU 296 N 0.03 1.01 -0.32 0.65 3.38 -0.34 -0.07 115.31 119.66 2b3b h LEU 296 Ca 0.03 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2b3b h LEU 296 Cb 0.04 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2b3b h LEU 296 CO -0.06 0.67 0.15 0.03 0.09 0.00 0.00 178.44 179.33 2b3b h ARG 297 N 1.16 0.46 0.32 1.13 3.08 -0.93 -0.78 114.38 118.81 2b3b h ARG 297 Ca 0.39 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.36 2b3b h ARG 297 Cb 0.08 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2b3b h ARG 297 CO -0.13 0.43 -0.15 1.25 -1.07 0.00 0.00 179.97 180.29 2b3b h LEU 298 N 0.38 -0.37 -1.23 3.04 5.85 -0.73 -2.87 115.31 119.37 2b3b h LEU 298 Ca 0.11 0.01 0.21 0.00 0.84 0.00 0.00 57.88 59.05 2b3b h LEU 298 Cb 0.12 0.10 -0.09 0.00 0.37 0.00 0.00 40.66 41.15 2b3b h LEU 298 CO -0.01 -0.26 0.62 0.58 -0.34 0.00 0.00 178.44 179.02 2b3b h VAL 299 N -0.43 0.66 -0.01 1.05 2.07 -0.90 -1.20 116.25 117.50 2b3b h VAL 299 Ca -0.04 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.28 2b3b h VAL 299 Cb 0.33 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 2b3b h VAL 299 CO 0.07 0.11 -0.05 0.61 0.02 0.00 0.00 177.57 178.32 2b3b n GLY 300 N -1.42 -0.63 3.91 2.17 0.00 -0.31 -4.51 105.19 104.41 2b3b n GLY 300 Ca 0.22 -0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 2b3b n GLY 300 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b3b s SER 301 N -2.19 6.44 0.38 1.61 1.04 -0.45 -4.96 113.70 115.57 2b3b s SER 301 Ca 0.37 0.52 0.07 0.00 0.48 0.00 0.00 55.95 57.39 2b3b s SER 301 Cb 0.21 -2.06 0.76 0.00 0.10 0.00 0.00 66.02 65.02 2b3b s SER 301 CO 0.40 -0.02 1.94 0.50 0.98 0.00 0.00 173.24 177.04 2b3b h LYS 302 N 2.31 0.40 -0.09 4.02 3.64 -1.91 -1.36 116.57 123.57 2b3b h LYS 302 Ca -0.47 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 58.83 2b3b h LYS 302 Cb 1.18 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.93 2b3b h LYS 302 CO 0.70 0.42 0.03 1.49 -2.27 0.00 0.00 179.45 179.82 2b3b h GLU 303 N 0.39 0.14 -0.05 1.90 4.81 -1.95 -0.89 114.58 118.93 2b3b h GLU 303 Ca 0.09 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2b3b h GLU 303 Cb 0.24 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.60 2b3b h GLU 303 CO 0.00 0.27 0.01 0.78 -0.73 0.00 0.00 179.01 179.35 2b3b h GLY 304 N -0.02 0.09 1.36 1.92 0.00 -1.62 -2.35 103.07 102.44 2b3b h GLY 304 Ca 0.03 -0.05 -0.13 0.00 0.00 0.00 0.00 47.33 47.18 2b3b h GLY 304 CO -0.00 0.05 -0.33 1.46 0.00 0.00 0.00 176.54 177.72 2b3b h GLN 305 N -0.14 0.72 0.00 4.80 4.20 -1.28 -1.54 115.11 121.87 2b3b h GLN 305 Ca 0.02 -0.34 0.00 0.00 0.06 0.00 0.00 58.65 58.39 2b3b h GLN 305 Cb 0.24 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.01 2b3b h GLN 305 CO 0.00 0.95 -0.07 -0.25 -0.67 0.00 0.00 178.83 178.79 2b3b n ASP 306 N -4.07 0.42 0.00 1.46 9.92 -0.34 -1.88 116.55 122.06 2b3b n ASP 306 Ca -0.01 0.46 -0.19 0.00 -0.53 0.00 0.00 54.79 54.52 2b3b n ASP 306 Cb 0.49 -0.53 -0.14 0.00 -0.64 0.00 0.00 41.12 40.30 2b3b n ASP 306 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2b3b h THR 307 N 0.00 1.47 0.15 -3.53 2.02 -1.16 -3.41 112.91 108.43 2b3b h THR 307 Ca 0.00 -2.44 -0.32 0.00 0.77 0.00 0.00 66.41 64.42 2b3b h THR 307 Cb 0.62 3.11 0.00 0.00 -1.74 0.00 0.00 68.15 70.14 2b3b h THR 307 CO 0.00 0.66 -1.61 0.77 0.37 0.00 0.00 175.52 175.71 2b3b h SER 308 N -0.57 0.48 -0.48 4.18 4.64 -1.32 -3.40 113.55 117.09 2b3b h SER 308 Ca -0.15 -0.90 -0.07 0.00 -0.47 0.00 0.00 61.79 60.21 2b3b h SER 308 Cb 1.47 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 63.38 2b3b h SER 308 CO 0.07 1.71 0.06 0.78 -0.87 0.00 0.00 176.83 178.59 2b3b h ASN 309 N -0.11 0.83 -0.52 4.97 2.35 -1.61 -2.15 115.58 119.34 2b3b h ASN 309 Ca -0.33 -0.18 0.11 0.00 -0.55 0.00 0.00 56.30 55.34 2b3b h ASN 309 Cb 1.92 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 40.05 2b3b h ASN 309 CO 0.11 0.85 0.36 -0.65 -1.65 0.00 0.00 177.43 176.45 2b3b h PRO 310 N 0.82 0.22 -0.01 0.81 0.11 -1.78 -1.46 132.00 130.72 2b3b h PRO 310 Ca 0.17 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 66.11 2b3b h PRO 310 Cb 0.40 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.44 2b3b h PRO 310 CO 0.01 0.14 -0.71 -0.07 -0.21 0.00 0.00 178.00 177.17 2b3b h LEU 311 N 0.22 0.04 0.02 2.35 3.38 -1.61 -3.35 115.31 116.36 2b3b h LEU 311 Ca 0.25 -0.03 -0.25 0.00 0.09 0.00 0.00 57.88 57.94 2b3b h LEU 311 Cb 0.67 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 2b3b h LEU 311 CO -0.05 0.74 -1.29 0.50 0.09 0.00 0.00 178.44 178.44 2b3b h LYS 312 N 0.02 0.03 0.00 1.13 1.63 -0.99 -3.43 116.57 114.97 2b3b h LYS 312 Ca -0.01 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 2b3b h LYS 312 Cb 1.26 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.91 2b3b h LYS 312 CO 0.10 0.86 0.00 0.41 -3.45 0.00 0.00 179.45 177.36 2b3b n GLY 313 N 1.45 2.07 3.77 5.01 0.00 -0.73 -3.68 105.19 113.08 2b3b n GLY 313 Ca -0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 2b3b n GLY 313 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b3b s SER 314 N -2.19 3.94 0.36 1.61 1.04 -1.25 -4.61 113.70 112.59 2b3b s SER 314 Ca 0.00 1.31 0.05 0.00 0.48 0.00 0.00 55.95 57.79 2b3b s SER 314 Cb 0.00 -2.00 -0.01 0.00 0.10 0.00 0.00 66.02 64.11 2b3b s SER 314 CO 0.00 -2.32 0.51 0.27 0.98 0.00 0.00 173.24 172.68 2b3b s ILE 315 N -3.09 4.16 0.51 -1.02 -4.36 -0.43 -4.46 121.20 112.51 2b3b s ILE 315 Ca 0.62 -0.86 -0.21 0.00 -0.26 0.00 0.00 60.65 59.94 2b3b s ILE 315 Cb -0.16 -3.47 -0.07 0.00 1.25 0.00 0.00 42.46 40.02 2b3b s ILE 315 CO 0.55 -0.22 1.12 0.00 0.24 0.00 0.00 174.94 176.64 2b3b s ALA 316 N -2.26 2.82 0.12 2.27 0.00 -1.26 -0.30 121.76 123.15 2b3b s ALA 316 Ca 0.45 0.82 0.02 0.00 0.00 0.00 0.00 51.96 53.25 2b3b s ALA 316 Cb -0.10 -3.35 -0.17 0.00 0.00 0.00 0.00 23.12 19.50 2b3b s ALA 316 CO 0.33 -0.65 1.26 0.00 0.00 0.00 0.00 175.76 176.69 2b3b h ALA 317 N 1.55 0.31 -2.77 0.00 0.00 -1.77 -3.39 119.26 113.19 2b3b h ALA 317 Ca -0.50 -0.84 -0.53 0.00 0.00 0.00 0.00 54.91 53.04 2b3b h ALA 317 Cb 1.25 -0.07 0.07 0.00 0.00 0.00 0.00 17.79 19.04 2b3b h ALA 317 CO 0.58 1.05 0.84 1.03 0.00 0.00 0.00 179.25 182.75 2b3b s ARG 318 N -2.84 4.19 0.54 0.00 0.52 -1.26 -4.40 118.95 115.69 2b3b s ARG 318 Ca -0.02 2.46 0.19 0.00 -0.52 0.00 0.00 55.73 57.84 2b3b s ARG 318 Cb 0.09 -3.06 1.40 0.00 0.52 0.00 0.00 34.95 33.89 2b3b s ARG 318 CO 0.84 -0.55 2.17 -0.07 0.02 0.00 0.00 175.30 177.72 2b3b h LEU 319 N 5.04 0.00 -1.48 2.53 3.38 -1.31 -2.97 115.31 120.50 2b3b h LEU 319 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2b3b h LEU 319 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2b3b h LEU 319 CO 0.79 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.42 2b3b n ASP 320 N -4.38 2.15 -4.68 -0.43 5.75 -1.26 -4.96 116.55 108.75 2b3b n ASP 320 Ca -0.03 -2.01 -0.44 0.00 -0.01 0.00 0.00 54.79 52.30 2b3b n ASP 320 Cb 0.11 -0.27 -0.02 0.00 -1.03 0.00 0.00 41.12 39.91 2b3b n ASP 320 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 2b3b n SER 321 N 0.65 2.65 -4.53 -1.12 2.88 -1.12 -4.94 113.62 108.09 2b3b n SER 321 Ca 0.13 1.17 -0.43 0.00 -1.33 0.00 0.00 58.87 58.42 2b3b n SER 321 Cb 0.34 -1.44 -0.05 0.00 -0.75 0.00 0.00 64.21 62.32 2b3b n SER 321 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2b3b s ASP 322 N -0.02 6.37 0.51 -3.46 2.15 -1.26 -4.93 116.67 116.03 2b3b s ASP 322 Ca 0.62 -0.26 0.34 0.00 0.43 0.00 0.00 52.55 53.68 2b3b s ASP 322 Cb -0.62 -2.41 1.79 0.00 -0.30 0.00 0.00 42.92 41.38 2b3b s ASP 322 CO 0.56 -1.10 2.04 1.55 -0.17 0.00 0.00 175.17 178.05 2b3b h PRO 323 N 9.17 0.00 0.00 4.34 0.13 -1.96 -2.15 132.00 141.53 2b3b h PRO 323 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2b3b h PRO 323 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2b3b h PRO 323 CO 1.04 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.47 2b3b h SER 324 N 0.00 0.00 0.12 1.44 4.64 -2.00 -2.25 113.55 115.50 2b3b h SER 324 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b3b h SER 324 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2b3b h SER 324 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 2b3b n LYS 325 N -2.53 0.78 -5.06 4.77 4.76 -0.81 -4.89 118.16 115.18 2b3b n LYS 325 Ca 0.03 0.01 -0.31 0.00 -2.87 0.00 0.00 58.31 55.18 2b3b n LYS 325 Cb 0.36 -1.50 -0.15 0.00 -1.84 0.00 0.00 35.03 31.90 2b3b n LYS 325 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2b3b s TYR 326 N -2.13 2.34 0.50 2.13 2.02 -0.85 -4.73 117.35 116.62 2b3b s TYR 326 Ca 0.39 -0.42 -0.08 0.00 -0.37 0.00 0.00 57.07 56.59 2b3b s TYR 326 Cb 0.19 -1.44 0.12 0.00 -0.40 0.00 0.00 41.96 40.43 2b3b s TYR 326 CO 0.35 0.06 0.59 0.27 -1.57 0.00 0.00 175.55 175.26 2b3b n ASN 327 N 2.04 -0.41 0.27 2.29 0.23 -1.26 -4.58 115.26 113.83 2b3b n ASN 327 Ca -0.17 -1.10 0.11 0.00 -0.53 0.00 0.00 54.58 52.89 2b3b n ASN 327 Cb 0.52 -0.48 0.73 0.00 -2.08 0.00 0.00 39.78 38.46 2b3b n ASN 327 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2b3b h ALA 328 N -2.03 1.66 0.10 -2.53 0.00 -1.97 -1.38 119.26 113.10 2b3b h ALA 328 Ca -0.20 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2b3b h ALA 328 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2b3b h ALA 328 CO 0.14 0.07 -0.05 -0.92 0.00 0.00 0.00 179.25 178.49 2b3b h TYR 329 N 0.00 -0.13 -0.50 0.00 3.20 -1.91 -2.52 116.97 115.11 2b3b h TYR 329 Ca -0.00 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 61.96 2b3b h TYR 329 Cb 0.12 0.04 -0.08 0.00 1.54 0.00 0.00 36.73 38.35 2b3b h TYR 329 CO 0.00 0.39 0.05 0.78 -1.64 0.00 0.00 178.16 177.73 2b3b h GLY 330 N -0.84 0.56 1.16 1.82 0.00 -1.80 0.16 103.07 104.14 2b3b h GLY 330 Ca -0.01 0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.28 2b3b h GLY 330 CO 0.02 -0.11 0.15 1.46 0.00 0.00 0.00 176.54 178.06 2b3b h GLN 331 N 0.17 1.04 -0.32 4.80 4.20 -1.37 0.80 115.11 124.42 2b3b h GLN 331 Ca 0.26 -0.24 0.04 0.00 0.06 0.00 0.00 58.65 58.76 2b3b h GLN 331 Cb 0.37 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 2b3b h GLN 331 CO -0.38 0.92 0.11 1.03 -0.67 0.00 0.00 178.83 179.84 2b3b h SER 332 N 0.99 0.11 -0.57 1.46 0.87 -0.84 -2.43 113.55 113.14 2b3b h SER 332 Ca 0.21 0.04 -0.06 0.00 -1.23 0.00 0.00 61.79 60.74 2b3b h SER 332 Cb 0.36 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 2b3b h SER 332 CO 0.00 0.10 0.12 0.00 -0.53 0.00 0.00 176.83 176.52 2b3b h ALA 333 N 1.21 0.76 -0.80 6.23 0.00 -0.54 -2.18 119.26 123.93 2b3b h ALA 333 Ca 0.15 -0.24 0.11 0.00 0.00 0.00 0.00 54.91 54.92 2b3b h ALA 333 Cb 0.12 -0.22 -0.08 0.00 0.00 0.00 0.00 17.79 17.62 2b3b h ALA 333 CO -0.15 0.48 0.43 0.52 0.00 0.00 0.00 179.25 180.53 2b3b h MET 334 N 0.83 0.67 -0.30 0.00 2.07 -0.79 0.49 114.93 117.91 2b3b h MET 334 Ca 0.18 -0.04 -0.05 0.00 -2.07 0.00 0.00 59.70 57.71 2b3b h MET 334 Cb 0.38 -0.15 -0.01 0.00 -1.87 0.00 0.00 31.60 29.95 2b3b h MET 334 CO 0.01 0.45 -0.03 0.00 1.07 0.00 0.00 176.91 178.41 2b3b h ARG 335 N 0.69 0.55 -0.52 1.72 3.08 -1.04 -2.84 114.38 116.02 2b3b h ARG 335 Ca 0.40 -0.19 -0.09 0.00 0.07 0.00 0.00 59.98 60.17 2b3b h ARG 335 Cb 0.43 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 2b3b h ARG 335 CO -0.28 0.71 -0.04 -0.44 -1.07 0.00 0.00 179.97 178.85 2b3b h ASP 336 N 0.33 0.88 -0.99 7.04 3.32 -1.09 -2.25 116.42 123.66 2b3b h ASP 336 Ca 0.08 -0.25 0.16 0.00 0.02 0.00 0.00 57.03 57.04 2b3b h ASP 336 Cb 0.48 -0.24 -0.10 0.00 0.22 0.00 0.00 39.33 39.70 2b3b h ASP 336 CO 0.02 0.97 0.60 -0.25 -1.72 0.00 0.00 179.24 178.86 2b3b h TRP 337 N 0.83 1.08 0.00 4.55 -0.00 -0.78 0.18 115.95 121.80 2b3b h TRP 337 Ca 0.15 0.03 -0.12 0.00 -0.00 0.00 0.00 58.89 58.95 2b3b h TRP 337 Cb 0.55 -0.33 -0.02 0.00 -0.00 0.00 0.00 29.16 29.36 2b3b h TRP 337 CO 0.03 0.33 -0.70 0.00 -0.00 0.00 0.00 178.44 178.10 2b3b h ARG 338 N 0.85 0.00 0.00 2.65 2.47 -1.21 -3.37 114.38 115.77 2b3b h ARG 338 Ca 0.53 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 59.19 2b3b h ARG 338 Cb 0.69 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.00 2b3b h ARG 338 CO -0.33 0.46 -1.78 -1.13 0.56 0.00 0.00 179.97 177.75 2b3b n SER 339 N -3.15 1.40 -4.89 7.04 3.41 -0.89 -5.03 113.62 111.51 2b3b n SER 339 Ca -0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.32 2b3b n SER 339 Cb 0.76 1.53 -0.00 0.00 -0.26 0.00 0.00 64.21 66.23 2b3b n SER 339 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2b3b s ASN 340 N -4.03 6.31 0.21 4.04 -0.87 0.58 -5.04 114.94 116.14 2b3b s ASN 340 Ca -0.06 1.10 -0.31 0.00 -1.57 0.00 0.00 52.86 52.02 2b3b s ASN 340 Cb 0.09 -2.32 -0.11 0.00 -0.02 0.00 0.00 41.25 38.89 2b3b s ASN 340 CO 0.64 -0.62 1.59 -0.60 -2.57 0.00 0.00 177.10 175.55 2b3b s ARG 341 N -4.67 4.19 -0.19 -0.60 6.06 -0.73 -4.85 118.95 118.16 2b3b s ARG 341 Ca 0.50 2.45 -0.07 0.00 -2.50 0.00 0.00 55.73 56.11 2b3b s ARG 341 Cb -0.10 -3.11 -0.04 0.00 0.06 0.00 0.00 34.95 31.76 2b3b s ARG 341 CO 0.44 -0.62 0.04 0.42 -2.50 0.00 0.00 175.30 173.08 2b3b s ILE 342 N 0.83 4.54 0.35 4.11 -1.09 -1.26 -0.56 121.20 128.12 2b3b s ILE 342 Ca 0.69 -0.12 0.05 0.00 -2.23 0.00 0.00 60.65 59.03 2b3b s ILE 342 Cb -0.46 -3.04 -0.07 0.00 -1.58 0.00 0.00 42.46 37.31 2b3b s ILE 342 CO 0.35 0.45 0.05 0.68 -1.23 0.00 0.00 174.94 175.24 2b3b s VAL 343 N 0.54 1.39 0.15 2.92 -7.23 -0.70 -4.97 120.40 112.49 2b3b s VAL 343 Ca 0.02 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.21 2b3b s VAL 343 Cb -0.13 -2.84 -0.04 0.00 0.56 0.00 0.00 36.38 33.94 2b3b s VAL 343 CO 0.01 0.00 0.28 -0.83 -0.31 0.00 0.00 175.10 174.25 2b3b s GLY 344 N -3.55 1.70 0.17 2.32 0.00 -1.26 -0.87 107.32 105.83 2b3b s GLY 344 Ca 0.36 -1.04 -0.30 0.00 0.00 0.00 0.00 44.72 43.74 2b3b s GLY 344 CO 0.16 -1.04 0.94 -0.45 0.00 0.00 0.00 173.10 172.71 2b3b s SER 345 N -3.24 7.56 -0.04 1.64 0.15 -0.32 -4.77 113.70 114.68 2b3b s SER 345 Ca 0.34 1.86 -0.20 0.00 0.70 0.00 0.00 55.95 58.65 2b3b s SER 345 Cb -0.11 -2.59 -0.14 0.00 -1.71 0.00 0.00 66.02 61.46 2b3b s SER 345 CO 0.28 0.05 0.86 0.25 1.20 0.00 0.00 173.24 175.88 2b3b h LEU 346 N 4.89 -0.25 -1.60 3.45 5.85 -1.96 -1.32 115.31 124.37 2b3b h LEU 346 Ca -0.44 -0.27 -0.04 0.00 0.84 0.00 0.00 57.88 57.97 2b3b h LEU 346 Cb 1.21 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.29 2b3b h LEU 346 CO 0.70 0.27 -0.21 0.58 -0.34 0.00 0.00 178.44 179.44 2b3b h VAL 347 N -0.90 0.82 -0.45 1.05 2.07 -1.94 -2.84 116.25 114.07 2b3b h VAL 347 Ca -0.03 -0.82 -0.30 0.00 0.82 0.00 0.00 66.70 66.37 2b3b h VAL 347 Cb 0.50 1.49 -0.20 0.00 -1.52 0.00 0.00 31.29 31.56 2b3b h VAL 347 CO 0.05 0.21 -0.37 1.41 0.02 0.00 0.00 177.57 178.88 2b3b n HIS 348 N -3.81 1.54 -0.49 1.57 8.25 -1.26 -5.00 115.22 116.02 2b3b n HIS 348 Ca -0.02 -1.91 0.00 0.00 -0.26 0.00 0.00 57.72 55.53 2b3b n HIS 348 Cb 0.31 -0.46 0.00 0.00 1.12 0.00 0.00 29.99 30.96 2b3b n HIS 348 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2b3b n GLY 349 N -0.97 0.74 0.12 -1.41 0.00 -1.07 -4.63 105.19 97.98 2b3b n GLY 349 Ca 0.36 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.17 2b3b n GLY 349 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b3b h ALA 350 N 0.00 -0.07 0.00 4.61 0.00 -1.33 -0.94 119.26 121.54 2b3b h ALA 350 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.22 2b3b h ALA 350 Cb 0.00 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2b3b h ALA 350 CO 0.00 0.42 -1.66 1.33 0.00 0.00 0.00 179.25 179.34 2b3b n VAL 351 N -4.09 0.00 -4.18 0.00 0.24 -1.03 -2.02 118.33 107.26 2b3b n VAL 351 Ca -0.14 -0.34 -0.17 0.00 -2.04 0.00 0.00 64.34 61.66 2b3b n VAL 351 Cb 0.83 0.18 -0.12 0.00 -1.47 0.00 0.00 33.84 33.26 2b3b n VAL 351 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2b3b s ALA 352 N -3.03 0.94 0.70 2.33 0.00 -1.26 -4.85 121.76 116.59 2b3b s ALA 352 Ca -0.05 -0.84 -0.13 0.00 0.00 0.00 0.00 51.96 50.95 2b3b s ALA 352 Cb 0.10 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.16 2b3b s ALA 352 CO 0.63 0.12 1.09 -1.25 0.00 0.00 0.00 175.76 176.34 2b3b s PRO 353 N -1.44 2.69 0.48 0.00 0.04 -1.26 -3.60 135.00 131.91 2b3b s PRO 353 Ca -0.03 1.20 0.20 0.00 0.04 0.00 0.00 61.00 62.41 2b3b s PRO 353 Cb -0.09 -1.95 1.22 0.00 0.04 0.00 0.00 34.50 33.72 2b3b s PRO 353 CO 0.01 -1.31 1.96 0.93 0.04 0.00 0.00 177.00 178.63 2b3b h GLU 354 N -0.48 0.21 -0.79 4.56 5.08 -1.85 -0.57 114.58 120.74 2b3b h GLU 354 Ca -0.45 -0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.01 2b3b h GLU 354 Cb 1.23 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 30.35 2b3b h GLU 354 CO 0.54 0.14 0.42 0.66 -1.00 0.00 0.00 179.01 179.77 2b3b h SER 355 N 0.22 0.55 0.02 1.42 4.64 -1.92 0.30 113.55 118.78 2b3b h SER 355 Ca 0.31 0.07 -0.04 0.00 -0.47 0.00 0.00 61.79 61.66 2b3b h SER 355 Cb 0.92 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2b3b h SER 355 CO -0.06 0.29 -0.15 0.15 -0.87 0.00 0.00 176.83 176.19 2b3b h PHE 356 N 0.67 0.12 -0.66 4.77 3.57 -1.60 -3.31 116.94 120.50 2b3b h PHE 356 Ca 0.40 -0.08 0.13 0.00 3.53 0.00 0.00 57.97 61.95 2b3b h PHE 356 Cb 0.45 -0.01 -0.09 0.00 2.79 0.00 0.00 35.95 39.09 2b3b h PHE 356 CO -0.09 0.99 0.18 0.52 -2.23 0.00 0.00 178.31 177.68 2b3b h MET 357 N -0.79 0.30 -0.23 1.11 2.86 -0.85 -1.35 114.93 115.98 2b3b h MET 357 Ca -0.02 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.55 2b3b h MET 357 Cb 1.05 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.63 2b3b h MET 357 CO 0.03 0.20 -0.08 0.66 1.06 0.00 0.00 176.91 178.77 2b3b h SER 358 N 0.31 0.34 1.27 1.22 4.64 -0.56 -2.91 113.55 117.85 2b3b h SER 358 Ca 0.35 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 2b3b h SER 358 Cb 0.54 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 2b3b h SER 358 CO -0.42 0.46 -0.72 1.56 -0.87 0.00 0.00 176.83 176.85 2b3b h GLN 359 N 0.34 0.00 -0.09 4.77 4.20 -1.41 -3.33 115.11 119.59 2b3b h GLN 359 Ca 0.07 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 2b3b h GLN 359 Cb 0.36 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2b3b h GLN 359 CO 0.02 0.00 -0.11 0.35 -0.67 0.00 0.00 178.83 178.42 2b3b h PHE 360 N 0.00 0.14 -1.00 2.96 3.57 -1.07 -0.81 116.94 120.72 2b3b h PHE 360 Ca 0.00 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.52 2b3b h PHE 360 Cb 0.99 -0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.64 2b3b h PHE 360 CO 0.00 0.25 0.66 0.78 -2.23 0.00 0.00 178.31 177.77 2b3b h GLY 361 N 0.57 1.46 0.97 2.40 0.00 -1.67 0.31 103.07 107.10 2b3b h GLY 361 Ca 0.03 -0.50 -0.06 0.00 0.00 0.00 0.00 47.33 46.79 2b3b h GLY 361 CO 0.02 0.44 0.03 -0.84 0.00 0.00 0.00 176.54 176.19 2b3b h THR 362 N 1.28 1.26 -0.55 4.70 2.02 -1.36 0.11 112.91 120.37 2b3b h THR 362 Ca 0.39 -0.99 0.07 0.00 0.77 0.00 0.00 66.41 66.66 2b3b h THR 362 Cb -0.02 1.02 -0.06 0.00 -1.74 0.00 0.00 68.15 67.35 2b3b h THR 362 CO -0.12 0.34 0.22 0.58 0.37 0.00 0.00 175.52 176.92 2b3b h VAL 363 N 0.62 0.84 0.02 3.16 2.07 -0.99 -1.18 116.25 120.79 2b3b h VAL 363 Ca 0.13 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 2b3b h VAL 363 Cb 0.45 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2b3b h VAL 363 CO 0.02 0.08 -0.01 -0.03 0.02 0.00 0.00 177.57 177.64 2b3b h MET 364 N 0.42 -0.03 -0.84 1.57 4.05 -0.71 -0.23 114.93 119.16 2b3b h MET 364 Ca 0.26 0.00 0.21 0.00 -0.28 0.00 0.00 59.70 59.89 2b3b h MET 364 Cb 0.27 0.01 -0.13 0.00 -0.80 0.00 0.00 31.60 30.95 2b3b h MET 364 CO -0.25 0.31 0.25 1.49 0.23 0.00 0.00 176.91 178.94 2b3b h GLU 365 N -0.37 0.26 -0.10 0.39 4.81 -0.62 -0.10 114.58 118.85 2b3b h GLU 365 Ca -0.00 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.06 2b3b h GLU 365 Cb 0.35 -0.06 0.01 0.00 0.63 0.00 0.00 28.75 29.68 2b3b h GLU 365 CO 0.01 0.17 -0.54 0.82 -0.73 0.00 0.00 179.01 178.73 2b3b h ILE 366 N 0.27 1.36 -1.00 2.32 2.04 -1.01 -3.04 117.51 118.45 2b3b h ILE 366 Ca 0.51 -1.86 0.11 0.00 1.00 0.00 0.00 64.86 64.63 2b3b h ILE 366 Cb 0.97 2.18 -0.08 0.00 -0.74 0.00 0.00 36.82 39.15 2b3b h ILE 366 CO -0.58 0.56 0.63 0.15 0.00 0.00 0.00 178.15 178.91 2b3b h PHE 367 N 0.17 1.15 -0.97 1.37 3.57 -0.15 0.65 116.94 122.72 2b3b h PHE 367 Ca -0.04 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.54 2b3b h PHE 367 Cb 1.19 -0.37 -0.06 0.00 2.79 0.00 0.00 35.95 39.50 2b3b h PHE 367 CO 0.11 0.48 0.64 -0.07 -2.23 0.00 0.00 178.31 177.23 2b3b h LEU 368 N 1.02 1.03 0.00 0.59 3.38 -0.95 0.45 115.31 120.83 2b3b h LEU 368 Ca 0.49 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.44 2b3b h LEU 368 Cb 0.44 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2b3b h LEU 368 CO -0.25 0.69 -0.04 1.56 0.09 0.00 0.00 178.44 180.49 2b3b h GLN 369 N 1.19 0.03 0.00 1.13 1.08 -1.19 -3.37 115.11 113.98 2b3b h GLN 369 Ca 0.40 -0.03 -0.17 0.00 -1.45 0.00 0.00 58.65 57.40 2b3b h GLN 369 Cb 0.09 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.50 2b3b h GLN 369 CO -0.14 0.83 -0.81 1.79 -0.95 0.00 0.00 178.83 179.54 2b3b h THR 370 N -0.76 1.43 -5.09 -0.54 1.35 -0.83 -3.47 112.91 104.99 2b3b h THR 370 Ca -0.01 -2.93 -0.31 0.00 -0.55 0.00 0.00 66.41 62.61 2b3b h THR 370 Cb 0.84 2.65 -0.07 0.00 -1.73 0.00 0.00 68.15 69.84 2b3b h THR 370 CO 0.01 0.79 -0.45 0.54 -0.25 0.00 0.00 175.52 176.17 2b3b n ARG 371 N -3.35 -2.94 -3.67 4.72 5.12 0.16 -4.96 116.66 111.74 2b3b n ARG 371 Ca 0.00 0.43 -0.39 0.00 -1.93 0.00 0.00 57.85 55.96 2b3b n ARG 371 Cb 0.85 -5.08 -0.11 0.00 -1.16 0.00 0.00 32.46 26.96 2b3b n ARG 371 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 2b3b s ASN 372 N -2.49 5.49 0.21 0.55 3.84 -1.26 -4.98 114.94 116.30 2b3b s ASN 372 Ca 0.28 -1.41 -0.09 0.00 0.21 0.00 0.00 52.86 51.85 2b3b s ASN 372 Cb -0.15 -1.93 0.17 0.00 -0.55 0.00 0.00 41.25 38.79 2b3b s ASN 372 CO 0.34 -0.46 1.84 -0.65 -2.79 0.00 0.00 177.10 175.38 2b3b h PRO 373 N 8.31 1.11 -0.71 0.43 0.11 -1.93 -2.01 132.00 137.32 2b3b h PRO 373 Ca -0.22 -0.12 -0.07 0.00 0.11 0.00 0.00 66.00 65.70 2b3b h PRO 373 Cb 1.08 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 31.94 2b3b h PRO 373 CO 0.69 0.80 0.16 0.37 -0.21 0.00 0.00 178.00 179.82 2b3b h GLN 374 N 1.11 1.14 -0.53 1.05 5.75 -1.94 -0.97 115.11 120.72 2b3b h GLN 374 Ca 0.29 -0.28 -0.08 0.00 -0.15 0.00 0.00 58.65 58.42 2b3b h GLN 374 Cb 0.00 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.38 2b3b h GLN 374 CO -0.05 1.01 0.01 0.00 -2.65 0.00 0.00 178.83 177.15 2b3b h ALA 375 N 1.09 1.00 -0.35 3.38 0.00 -1.94 0.07 119.26 122.50 2b3b h ALA 375 Ca 0.22 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 2b3b h ALA 375 Cb 0.39 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2b3b h ALA 375 CO 0.00 0.61 -0.22 0.00 0.00 0.00 0.00 179.25 179.65 2b3b h ALA 376 N 1.16 0.50 -0.19 0.00 0.00 -1.13 0.06 119.26 119.66 2b3b h ALA 376 Ca 0.16 -0.38 0.01 0.00 0.00 0.00 0.00 54.91 54.71 2b3b h ALA 376 Cb 0.49 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2b3b h ALA 376 CO 0.02 0.47 0.08 0.00 0.00 0.00 0.00 179.25 179.83 2b3b h ALA 377 N 0.77 0.22 -0.83 0.00 0.00 -1.04 -0.74 119.26 117.64 2b3b h ALA 377 Ca 0.07 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.01 2b3b h ALA 377 Cb 0.78 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 2b3b h ALA 377 CO 0.06 -0.34 0.55 -0.91 0.00 0.00 0.00 179.25 178.61 2b3b h ASN 378 N 0.19 0.95 -0.44 0.00 2.35 -0.88 -1.49 115.58 116.26 2b3b h ASN 378 Ca 0.08 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 2b3b h ASN 378 Cb 0.03 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.15 2b3b h ASN 378 CO -0.07 0.68 0.13 0.00 -1.65 0.00 0.00 177.43 176.52 2b3b h ALA 379 N 1.31 0.58 -0.81 -0.83 0.00 -0.61 -0.73 119.26 118.17 2b3b h ALA 379 Ca 0.31 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2b3b h ALA 379 Cb -0.11 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 2b3b h ALA 379 CO -0.07 0.24 0.38 0.00 0.00 0.00 0.00 179.25 179.79 2b3b h ALA 380 N 0.98 1.05 -0.70 0.00 0.00 -0.85 -1.46 119.26 118.28 2b3b h ALA 380 Ca 0.14 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2b3b h ALA 380 Cb 0.28 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2b3b h ALA 380 CO -0.00 0.62 0.26 0.37 0.00 0.00 0.00 179.25 180.50 2b3b h GLN 381 N 1.15 1.06 -0.25 0.00 5.75 -1.08 -1.35 115.11 120.40 2b3b h GLN 381 Ca 0.28 -0.20 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 2b3b h GLN 381 Cb 0.14 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.51 2b3b h GLN 381 CO -0.03 0.89 0.17 0.00 -2.65 0.00 0.00 178.83 177.21 2b3b h ALA 382 N 1.12 0.32 -0.54 3.38 0.00 -0.66 -0.06 119.26 122.82 2b3b h ALA 382 Ca 0.23 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.14 2b3b h ALA 382 Cb 0.24 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2b3b h ALA 382 CO -0.02 -0.20 0.34 0.82 0.00 0.00 0.00 179.25 180.18 2b3b h ILE 383 N 0.34 1.08 -0.76 0.00 1.08 -1.11 -0.09 117.51 118.06 2b3b h ILE 383 Ca 0.09 -0.23 0.02 0.00 -0.39 0.00 0.00 64.86 64.35 2b3b h ILE 383 Cb -0.04 0.35 -0.04 0.00 -3.07 0.00 0.00 36.82 34.02 2b3b h ILE 383 CO -0.02 0.12 0.49 0.00 -0.69 0.00 0.00 178.15 178.06 2b3b h ALA 384 N 1.23 0.99 -0.24 1.87 0.00 -0.64 -0.62 119.26 121.84 2b3b h ALA 384 Ca 0.21 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2b3b h ALA 384 Cb -0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2b3b h ALA 384 CO -0.08 0.33 0.06 -0.44 0.00 0.00 0.00 179.25 179.12 2b3b h ASP 385 N 0.98 0.37 -0.79 0.00 3.32 -0.62 0.86 116.42 120.54 2b3b h ASP 385 Ca 0.29 -0.23 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 2b3b h ASP 385 Cb -0.05 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.37 2b3b h ASP 385 CO -0.09 0.51 0.38 1.56 -1.72 0.00 0.00 179.24 179.88 2b3b h GLN 386 N 0.22 1.14 -0.00 3.56 4.20 -0.57 -2.89 115.11 120.76 2b3b h GLN 386 Ca 0.08 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.62 2b3b h GLN 386 Cb 0.28 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.85 2b3b h GLN 386 CO 0.00 0.88 -0.26 1.33 -0.67 0.00 0.00 178.83 180.11 2b3b n VAL 387 N -4.36 0.00 -3.19 -0.54 0.24 -0.28 -4.95 118.33 105.25 2b3b n VAL 387 Ca 0.07 -0.01 -0.15 0.00 -2.04 0.00 0.00 64.34 62.21 2b3b n VAL 387 Cb 0.13 -0.06 0.06 0.00 -1.47 0.00 0.00 33.84 32.50 2b3b n VAL 387 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2b3b n GLY 388 N 1.47 -0.12 3.69 7.63 0.00 -0.33 -4.90 105.19 112.63 2b3b n GLY 388 Ca 0.07 -0.03 -0.58 0.00 0.00 0.00 0.00 46.02 45.48 2b3b n GLY 388 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2b3b n LEU 389 N -3.54 1.98 0.00 0.99 7.94 0.15 -1.16 117.00 123.35 2b3b n LEU 389 Ca -0.07 1.10 0.00 0.00 -1.11 0.00 0.00 56.01 55.93 2b3b n LEU 389 Cb 0.57 -1.10 0.00 0.00 0.53 0.00 0.00 43.42 43.42 2b3b n LEU 389 CO 0.45 -0.66 0.00 0.61 -1.11 0.00 0.00 177.39 176.68 2b3b n GLY 390 N 3.78 1.90 0.34 -3.96 0.00 -1.26 -4.55 105.19 101.44 2b3b n GLY 390 Ca 0.26 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.26 2b3b n GLY 390 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2b3b h ARG 391 N 0.37 1.13 0.00 1.61 0.11 -1.49 -3.49 114.38 112.62 2b3b h ARG 391 Ca 0.00 -0.07 0.00 0.00 0.10 0.00 0.00 59.98 60.01 2b3b h ARG 391 Cb 0.00 -0.26 0.00 0.00 1.11 0.00 0.00 29.97 30.82 2b3b h ARG 391 CO 0.00 0.75 0.00 1.28 0.10 0.00 0.00 179.97 182.10