#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 0.98 -0.14 0.03 1.02 -1.26 -0.51 119.74 119.86 2b3b s LYS 2 Ca 0.00 -1.46 -0.06 0.00 0.02 0.00 0.00 55.97 54.48 2b3b s LYS 2 Cb 0.00 -0.05 0.06 0.00 -0.52 0.00 0.00 37.83 37.32 2b3b s LYS 2 CO 0.00 -0.16 0.29 -1.17 -0.92 0.00 0.00 175.35 173.39 2b3b s LEU 3 N -3.10 -0.12 -0.31 3.17 2.96 0.13 -4.81 118.68 116.61 2b3b s LEU 3 Ca 0.21 0.66 -0.09 0.00 -0.22 0.00 0.00 54.13 54.70 2b3b s LEU 3 Cb 0.07 0.87 0.00 0.00 0.50 0.00 0.00 46.19 47.63 2b3b s LEU 3 CO 0.01 -0.21 0.13 -0.70 -1.32 0.00 0.00 176.35 174.26 2b3b s GLU 4 N 2.00 3.18 -0.20 1.98 2.12 -1.26 -0.02 118.70 126.50 2b3b s GLU 4 Ca -0.03 -0.81 -0.07 0.00 0.36 0.00 0.00 54.97 54.41 2b3b s GLU 4 Cb -0.11 -3.51 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 2b3b s GLU 4 CO -0.10 -0.46 0.06 0.42 -0.54 0.00 0.00 175.26 174.65 2b3b s ILE 5 N 1.56 4.64 -0.16 -3.70 1.01 -0.48 -1.74 121.20 122.34 2b3b s ILE 5 Ca 0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 60.65 60.59 2b3b s ILE 5 Cb -0.17 -3.11 -0.02 0.00 0.01 0.00 0.00 42.46 39.17 2b3b s ILE 5 CO 0.05 0.42 -0.09 0.12 0.00 0.00 0.00 174.94 175.44 2b3b s PHE 6 N 0.75 2.90 0.34 3.97 5.36 -0.62 -0.28 117.98 130.39 2b3b s PHE 6 Ca 0.03 -0.60 -0.16 0.00 -0.96 0.00 0.00 56.93 55.24 2b3b s PHE 6 Cb -0.13 -1.93 0.03 0.00 -0.34 0.00 0.00 43.02 40.65 2b3b s PHE 6 CO 0.02 -0.23 0.72 -1.54 -1.46 0.00 0.00 175.22 172.73 2b3b s SER 7 N 0.57 -0.01 -0.24 6.13 1.04 -0.91 -0.11 113.70 120.17 2b3b s SER 7 Ca -0.06 -0.98 0.14 0.00 0.48 0.00 0.00 55.95 55.53 2b3b s SER 7 Cb -0.15 0.78 0.66 0.00 0.10 0.00 0.00 66.02 67.41 2b3b s SER 7 CO 0.03 -1.50 1.61 -2.67 0.98 0.00 0.00 173.24 171.68 2b3b n TRP 8 N -0.50 1.63 -1.70 5.02 2.14 -1.26 -1.36 117.44 121.41 2b3b n TRP 8 Ca -0.06 -0.96 -0.40 0.00 2.07 0.00 0.00 57.50 58.15 2b3b n TRP 8 Cb 0.60 -0.47 -0.01 0.00 -0.81 0.00 0.00 31.31 30.61 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 -0.16 2.62 -2.73 -2.67 8.01 -1.26 -4.64 117.44 116.62 2b3b n TRP 9 Ca 0.29 -2.95 -0.28 0.00 -1.31 0.00 0.00 57.50 53.24 2b3b n TRP 9 Cb 1.11 -2.19 -0.01 0.00 -2.01 0.00 0.00 31.31 28.20 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 0.76 3.39 0.00 6.99 0.00 -1.26 -3.00 121.76 128.64 2b3b s ALA 10 Ca 0.59 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.14 2b3b s ALA 10 Cb 0.17 -2.62 0.00 0.00 0.00 0.00 0.00 23.12 20.68 2b3b s ALA 10 CO -0.07 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 175.88 2b3b n GLY 11 N -1.91 3.26 0.00 0.00 0.00 -1.26 -1.19 105.19 104.09 2b3b n GLY 11 Ca 0.01 -0.09 0.05 0.00 0.00 0.00 0.00 46.02 45.99 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 3.60 0.00 0.00 1.61 5.68 -1.26 -0.57 116.55 125.61 2b3b n ASP 12 Ca 0.00 0.47 0.13 0.00 -0.50 0.00 0.00 54.79 54.90 2b3b n ASP 12 Cb 0.00 -0.48 0.49 0.00 -1.14 0.00 0.00 41.12 39.99 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 -1.48 0.01 0.12 0.11 1.02 -0.34 -4.44 120.64 115.65 2b3b n GLU 13 Ca 0.03 0.01 -0.02 0.00 -0.02 0.00 0.00 57.16 57.15 2b3b n GLU 13 Cb 0.12 -1.51 0.13 0.00 -0.02 0.00 0.00 31.44 30.16 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 4.98 0.01 -0.32 0.62 0.00 -0.74 -3.40 103.07 104.23 2b3b h GLY 14 Ca 0.00 -0.02 0.18 0.00 0.00 0.00 0.00 47.33 47.49 2b3b h GLY 14 CO 0.00 0.02 0.08 -2.55 0.00 0.00 0.00 176.54 174.09 2b3b h PRO 15 N 0.01 0.15 0.29 4.80 0.11 -1.78 0.13 132.00 135.70 2b3b h PRO 15 Ca -0.01 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.09 2b3b h PRO 15 Cb 1.18 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2b3b h PRO 15 CO 0.09 0.10 -0.28 0.00 -0.21 0.00 0.00 178.00 177.69 2b3b h ALA 16 N 1.70 -0.59 -0.66 -0.75 0.00 -1.82 -0.64 119.26 116.50 2b3b h ALA 16 Ca 0.44 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.31 2b3b h ALA 16 Cb 0.79 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 2b3b h ALA 16 CO -0.63 -0.87 0.38 1.25 0.00 0.00 0.00 179.25 179.38 2b3b h LEU 17 N -0.60 0.58 -1.08 0.00 5.85 -1.55 -2.02 115.31 116.50 2b3b h LEU 17 Ca -0.01 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 2b3b h LEU 17 Cb 0.55 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 2b3b h LEU 17 CO -0.06 0.38 0.38 -0.33 -0.34 0.00 0.00 178.44 178.47 2b3b h GLU 18 N 0.71 1.02 -0.74 1.25 5.08 -0.54 0.89 114.58 122.25 2b3b h GLU 18 Ca 0.29 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.47 2b3b h GLU 18 Cb 0.14 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 2b3b h GLU 18 CO -0.16 0.77 0.26 0.00 -1.00 0.00 0.00 179.01 178.87 2b3b h ALA 19 N 1.39 0.97 -0.49 3.43 0.00 -0.82 -0.25 119.26 123.49 2b3b h ALA 19 Ca 0.26 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2b3b h ALA 19 Cb 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2b3b h ALA 19 CO -0.04 0.63 0.02 1.25 0.00 0.00 0.00 179.25 181.11 2b3b h LEU 20 N 1.09 0.83 -0.69 0.00 5.85 -0.74 -2.12 115.31 119.52 2b3b h LEU 20 Ca 0.24 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 2b3b h LEU 20 Cb 0.27 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 2b3b h LEU 20 CO -0.01 0.92 0.33 0.40 -0.34 0.00 0.00 178.44 179.74 2b3b h ILE 21 N 0.71 1.23 -0.93 4.05 2.04 -0.51 0.92 117.51 125.01 2b3b h ILE 21 Ca 0.14 -0.65 0.01 0.00 1.00 0.00 0.00 64.86 65.36 2b3b h ILE 21 Cb 0.49 0.38 -0.05 0.00 -0.74 0.00 0.00 36.82 36.90 2b3b h ILE 21 CO 0.02 0.27 0.61 0.03 0.00 0.00 0.00 178.15 179.09 2b3b h ARG 22 N 0.97 1.22 -0.39 2.37 3.08 -0.96 -0.73 114.38 119.94 2b3b h ARG 22 Ca 0.24 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 60.13 2b3b h ARG 22 Cb 0.12 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 2b3b h ARG 22 CO -0.03 0.81 -0.09 1.25 -1.07 0.00 0.00 179.97 180.84 2b3b h LEU 23 N 1.26 0.75 -0.41 3.04 5.85 -0.69 -1.83 115.31 123.29 2b3b h LEU 23 Ca 0.34 -0.36 0.06 0.00 0.84 0.00 0.00 57.88 58.76 2b3b h LEU 23 Cb -0.14 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.63 2b3b h LEU 23 CO -0.07 0.94 0.11 0.22 -0.34 0.00 0.00 178.44 179.29 2b3b h TYR 24 N 0.56 0.18 -0.05 1.25 3.20 -0.44 -1.32 116.97 120.35 2b3b h TYR 24 Ca 0.10 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.92 2b3b h TYR 24 Cb 0.61 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 2b3b h TYR 24 CO 0.05 0.04 -0.29 0.87 -1.64 0.00 0.00 178.16 177.19 2b3b h LYS 25 N 0.25 0.09 -0.52 1.82 1.57 -0.98 0.31 116.57 119.10 2b3b h LYS 25 Ca 0.19 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.92 2b3b h LYS 25 Cb 0.22 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2b3b h LYS 25 CO -0.23 0.37 0.23 1.96 -0.57 0.00 0.00 179.45 181.21 2b3b h GLN 26 N 0.08 0.76 0.00 3.15 4.20 -0.82 -2.91 115.11 119.57 2b3b h GLN 26 Ca 0.01 -0.13 -0.12 0.00 0.06 0.00 0.00 58.65 58.48 2b3b h GLN 26 Cb 0.56 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 2b3b h GLN 26 CO 0.04 0.66 -0.55 0.87 -0.67 0.00 0.00 178.83 179.17 2b3b h LYS 27 N 0.70 0.00 -2.33 1.46 1.57 -0.61 -3.39 116.57 113.98 2b3b h LYS 27 Ca 0.18 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.37 2b3b h LYS 27 Cb 0.16 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 32.08 2b3b h LYS 27 CO -0.02 0.55 -0.94 0.66 -0.57 0.00 0.00 179.45 179.13 2b3b n TYR 28 N -3.32 0.03 -1.48 -1.35 4.01 0.10 -5.10 117.16 110.06 2b3b n TYR 28 Ca 0.01 -3.55 -0.32 0.00 -0.16 0.00 0.00 57.90 53.88 2b3b n TYR 28 Cb 0.72 -0.07 0.07 0.00 -0.31 0.00 0.00 39.34 39.74 2b3b n TYR 28 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 2b3b s PRO 29 N -0.66 2.55 0.00 -0.72 0.02 -1.10 -3.48 135.00 131.61 2b3b s PRO 29 Ca 0.33 1.21 0.00 0.00 0.02 0.00 0.00 61.00 62.56 2b3b s PRO 29 Cb 0.08 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.67 2b3b s PRO 29 CO -0.16 -1.42 0.00 0.41 -0.33 0.00 0.00 177.00 175.50 2b3b n GLY 30 N -1.10 0.66 3.39 0.52 0.00 -1.26 -5.01 105.19 102.39 2b3b n GLY 30 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.60 4.03 -0.17 1.61 1.01 -1.23 -4.12 120.40 118.93 2b3b s VAL 31 Ca 0.00 -0.36 -0.29 0.00 0.00 0.00 0.00 61.98 61.33 2b3b s VAL 31 Cb 0.00 -2.92 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 2b3b s VAL 31 CO 0.00 0.30 1.37 -0.70 0.00 0.00 0.00 175.10 176.07 2b3b s GLU 32 N 1.56 4.13 -0.27 2.72 2.12 0.33 -4.89 118.70 124.40 2b3b s GLU 32 Ca 0.05 1.69 -0.12 0.00 0.36 0.00 0.00 54.97 56.95 2b3b s GLU 32 Cb -0.15 -3.85 -0.05 0.00 0.26 0.00 0.00 34.13 30.34 2b3b s GLU 32 CO 0.02 -0.86 0.25 0.08 -0.54 0.00 0.00 175.26 174.21 2b3b s VAL 33 N 3.91 5.27 -0.38 3.70 1.01 -1.26 -0.69 120.40 131.96 2b3b s VAL 33 Ca 0.60 0.32 -0.17 0.00 0.00 0.00 0.00 61.98 62.72 2b3b s VAL 33 Cb -0.23 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.56 2b3b s VAL 33 CO 0.20 0.23 0.47 -0.63 0.00 0.00 0.00 175.10 175.37 2b3b s ILE 34 N 1.76 5.05 -0.98 2.22 1.09 0.97 -4.96 121.20 126.35 2b3b s ILE 34 Ca 0.10 0.07 -0.16 0.00 -1.10 0.00 0.00 60.65 59.55 2b3b s ILE 34 Cb -0.16 -3.97 0.16 0.00 -1.06 0.00 0.00 42.46 37.43 2b3b s ILE 34 CO 0.10 -0.28 1.12 0.21 -0.10 0.00 0.00 174.94 175.99 2b3b s ASN 35 N 1.79 6.78 -0.91 3.58 2.47 -1.26 -1.38 114.94 126.01 2b3b s ASN 35 Ca 0.16 -2.44 -0.20 0.00 0.42 0.00 0.00 52.86 50.79 2b3b s ASN 35 Cb -0.16 -2.35 0.11 0.00 -1.45 0.00 0.00 41.25 37.40 2b3b s ASN 35 CO 0.14 -0.86 1.17 0.00 -3.72 0.00 0.00 177.10 173.82 2b3b s ALA 36 N 1.76 3.21 0.06 1.71 0.00 0.61 -5.01 121.76 124.11 2b3b s ALA 36 Ca 0.32 -2.56 -0.00 0.00 0.00 0.00 0.00 51.96 49.72 2b3b s ALA 36 Cb -0.06 -4.12 -0.04 0.00 0.00 0.00 0.00 23.12 18.90 2b3b s ALA 36 CO -0.07 -3.08 0.21 0.95 0.00 0.00 0.00 175.76 173.77 2b3b s THR 37 N 3.29 5.39 -0.22 0.00 -4.23 -1.26 -2.14 115.64 116.46 2b3b s THR 37 Ca 0.34 -0.38 0.01 0.00 -1.18 0.00 0.00 61.69 60.49 2b3b s THR 37 Cb -0.05 -3.63 0.05 0.00 1.34 0.00 0.00 72.50 70.21 2b3b s THR 37 CO -0.07 0.15 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.37 2b3b s VAL 38 N -1.51 1.79 0.16 2.29 1.01 -0.46 -4.96 120.40 118.72 2b3b s VAL 38 Ca 0.35 -1.24 -0.31 0.00 0.00 0.00 0.00 61.98 60.77 2b3b s VAL 38 Cb -0.13 -1.91 -0.09 0.00 0.00 0.00 0.00 36.38 34.25 2b3b s VAL 38 CO 0.28 0.06 1.49 -0.89 0.00 0.00 0.00 175.10 176.04 2b3b s THR 39 N 1.30 2.85 0.00 3.92 2.01 -1.26 -4.36 115.64 120.10 2b3b s THR 39 Ca -0.04 0.63 0.00 0.00 0.31 0.00 0.00 61.69 62.58 2b3b s THR 39 Cb -0.18 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 68.93 2b3b s THR 39 CO -0.07 0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.53 2b3b n GLY 40 N 3.43 2.02 3.74 4.40 0.00 -1.26 -4.71 105.19 112.81 2b3b n GLY 40 Ca 0.12 0.32 -0.42 0.00 0.00 0.00 0.00 46.02 46.05 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 1.00 2.66 -0.02 0.00 -1.26 -1.83 105.19 105.74 2b3b n GLY 41 Ca 0.00 0.35 -0.00 0.00 0.00 0.00 0.00 46.02 46.36 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 0.74 -0.00 -0.77 4.61 0.00 -1.26 -3.38 120.51 120.45 2b3b n ALA 42 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2b3b n ALA 42 Cb 0.37 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.82 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 -0.36 0.59 0.18 0.00 0.00 -0.76 -4.96 105.19 99.88 2b3b n GLY 43 Ca -0.00 -0.26 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 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 0.69 -0.37 1.61 2.07 -1.69 -0.70 116.25 117.86 2b3b h VAL 44 Ca 0.00 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.44 2b3b h VAL 44 Cb 0.00 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 2b3b h VAL 44 CO 0.00 0.00 -0.10 0.78 0.02 0.00 0.00 177.57 178.27 2b3b h ASN 45 N -0.32 0.72 -0.84 0.57 2.35 -1.84 -3.09 115.58 113.12 2b3b h ASN 45 Ca -0.00 -0.37 0.10 0.00 -0.55 0.00 0.00 56.30 55.48 2b3b h ASN 45 Cb 0.30 -0.20 -0.07 0.00 0.05 0.00 0.00 38.32 38.40 2b3b h ASN 45 CO -0.02 0.92 0.49 0.00 -1.65 0.00 0.00 177.43 177.16 2b3b h ALA 46 N 0.82 1.20 -0.57 -0.83 0.00 -1.70 -0.90 119.26 117.29 2b3b h ALA 46 Ca 0.09 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2b3b h ALA 46 Cb 0.61 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2b3b h ALA 46 CO 0.04 0.11 0.36 0.00 0.00 0.00 0.00 179.25 179.76 2b3b h ARG 47 N 0.81 0.77 -0.55 0.00 3.08 -1.13 -0.39 114.38 116.97 2b3b h ARG 47 Ca 0.40 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 60.32 2b3b h ARG 47 Cb 0.37 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 2b3b h ARG 47 CO -0.25 0.54 0.07 0.00 -1.07 0.00 0.00 179.97 179.26 2b3b h ALA 48 N 1.18 0.74 -0.14 0.04 0.00 -1.24 -1.30 119.26 118.54 2b3b h ALA 48 Ca 0.21 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2b3b h ALA 48 Cb -0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2b3b h ALA 48 CO -0.04 0.50 0.04 0.28 0.00 0.00 0.00 179.25 180.03 2b3b h VAL 49 N 0.82 1.19 -0.83 0.00 2.07 -1.07 -2.95 116.25 115.49 2b3b h VAL 49 Ca 0.17 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 67.06 2b3b h VAL 49 Cb 0.44 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 2b3b h VAL 49 CO 0.02 0.18 0.36 0.25 0.02 0.00 0.00 177.57 178.39 2b3b h LEU 50 N 0.04 1.12 -0.54 2.57 5.85 -0.92 -0.56 115.31 122.87 2b3b h LEU 50 Ca 0.05 -0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.67 2b3b h LEU 50 Cb 0.24 -0.29 -0.06 0.00 0.37 0.00 0.00 40.66 40.92 2b3b h LEU 50 CO -0.00 0.97 0.24 0.50 -0.34 0.00 0.00 178.44 179.80 2b3b h LYS 51 N 1.19 0.44 -0.26 1.25 3.64 -1.19 0.75 116.57 122.38 2b3b h LYS 51 Ca 0.28 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.61 2b3b h LYS 51 Cb 0.18 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 2b3b h LYS 51 CO -0.03 0.29 0.10 1.15 -2.27 0.00 0.00 179.45 178.69 2b3b h THR 52 N 0.45 1.18 -0.39 1.00 2.02 -1.18 -0.94 112.91 115.05 2b3b h THR 52 Ca 0.25 -0.57 0.05 0.00 0.77 0.00 0.00 66.41 66.92 2b3b h THR 52 Cb 0.23 1.06 -0.04 0.00 -1.74 0.00 0.00 68.15 67.66 2b3b h THR 52 CO -0.22 0.19 0.14 0.03 0.37 0.00 0.00 175.52 176.03 2b3b h ARG 53 N 0.27 0.29 -0.46 6.66 3.08 -0.79 -1.85 114.38 121.58 2b3b h ARG 53 Ca 0.09 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 2b3b h ARG 53 Cb 0.20 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 2b3b h ARG 53 CO -0.01 0.19 -0.00 0.52 -1.07 0.00 0.00 179.97 179.60 2b3b h MET 54 N 0.30 0.81 0.00 0.04 2.86 -0.72 0.11 114.93 118.32 2b3b h MET 54 Ca 0.18 -0.26 -0.05 0.00 -2.06 0.00 0.00 59.70 57.51 2b3b h MET 54 Cb 0.16 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 2b3b h MET 54 CO -0.18 0.87 -0.23 -0.07 1.06 0.00 0.00 176.91 178.36 2b3b h LEU 55 N 0.66 0.00 -2.41 1.22 3.38 -1.05 -2.51 115.31 114.60 2b3b h LEU 55 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2b3b h LEU 55 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2b3b h LEU 55 CO 0.02 0.23 0.00 0.61 0.09 0.00 0.00 178.44 179.39 2b3b n GLY 56 N 0.14 2.03 2.16 0.83 0.00 -0.71 -4.95 105.19 104.70 2b3b n GLY 56 Ca 0.00 -0.64 -0.08 0.00 0.00 0.00 0.00 46.02 45.30 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 1.01 0.06 2.59 -0.02 0.00 -0.94 -4.97 105.19 102.92 2b3b n GLY 57 Ca 0.20 -0.54 -0.22 0.00 0.00 0.00 0.00 46.02 45.46 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 0.41 2.91 -4.76 1.61 2.03 0.35 -5.03 116.55 114.06 2b3b n ASP 58 Ca -0.10 -3.34 -0.36 0.00 0.52 0.00 0.00 54.79 51.51 2b3b n ASP 58 Cb 0.56 -0.56 0.01 0.00 -0.72 0.00 0.00 41.12 40.41 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 -3.09 3.29 1.22 -0.67 0.04 -1.26 -4.56 135.00 129.97 2b3b s PRO 59 Ca 0.43 1.77 -0.20 0.00 0.04 0.00 0.00 61.00 63.04 2b3b s PRO 59 Cb 0.34 -2.08 0.30 0.00 0.04 0.00 0.00 34.50 33.10 2b3b s PRO 59 CO -0.10 -0.94 1.12 -1.25 0.04 0.00 0.00 177.00 175.87 2b3b s PRO 60 N -3.15 -1.37 0.24 0.56 0.04 -1.26 -4.65 135.00 125.41 2b3b s PRO 60 Ca 0.72 -0.15 0.13 0.00 0.04 0.00 0.00 61.00 61.74 2b3b s PRO 60 Cb -0.28 -1.59 0.07 0.00 0.04 0.00 0.00 34.50 32.74 2b3b s PRO 60 CO 0.32 -3.80 1.44 -0.44 0.04 0.00 0.00 177.00 174.56 2b3b h ASP 61 N -2.64 0.00 -4.93 6.66 3.32 -1.73 -3.42 116.42 113.69 2b3b h ASP 61 Ca -0.44 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.57 2b3b h ASP 61 Cb 1.29 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.66 2b3b h ASP 61 CO 0.31 0.66 0.23 0.28 -1.72 0.00 0.00 179.24 179.00 2b3b s THR 62 N -2.99 0.00 0.00 0.35 -1.32 -1.15 -4.31 115.64 106.22 2b3b s THR 62 Ca 0.02 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.50 2b3b s THR 62 Cb 0.09 -1.00 -0.00 0.00 -1.51 0.00 0.00 72.50 70.08 2b3b s THR 62 CO 0.76 0.00 -0.01 0.72 -2.21 0.00 0.00 174.62 173.89 2b3b s PHE 63 N -1.63 0.06 -0.01 9.09 -0.12 -1.26 -1.60 117.98 122.51 2b3b s PHE 63 Ca -0.08 -0.08 -0.35 0.00 -0.05 0.00 0.00 56.93 56.37 2b3b s PHE 63 Cb -0.00 -0.04 -0.13 0.00 -0.63 0.00 0.00 43.02 42.21 2b3b s PHE 63 CO 0.05 -0.03 1.71 0.94 -0.05 0.00 0.00 175.22 177.85 2b3b n GLN 64 N 2.87 1.95 -3.78 1.99 7.27 0.84 -3.84 117.38 124.66 2b3b n GLN 64 Ca -0.14 0.71 -0.13 0.00 0.07 0.00 0.00 57.00 57.51 2b3b n GLN 64 Cb 0.59 -2.49 -0.10 0.00 2.41 0.00 0.00 30.24 30.65 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 2.59 0.03 0.04 1.69 0.11 0.35 -4.92 120.40 120.30 2b3b s VAL 65 Ca 0.88 -0.23 -0.30 0.00 -2.93 0.00 0.00 61.98 59.39 2b3b s VAL 65 Cb -0.76 -0.47 -0.05 0.00 -1.53 0.00 0.00 36.38 33.57 2b3b s VAL 65 CO 0.48 -0.13 1.22 -1.00 -3.33 0.00 0.00 175.10 172.34 2b3b s HIS 66 N -0.48 3.36 0.35 1.54 3.76 -1.26 -0.33 115.29 122.23 2b3b s HIS 66 Ca -0.06 1.25 -0.28 0.00 -0.15 0.00 0.00 55.06 55.82 2b3b s HIS 66 Cb -0.04 -3.45 -0.12 0.00 1.11 0.00 0.00 32.58 30.09 2b3b s HIS 66 CO 0.02 -1.40 1.30 0.00 -0.85 0.00 0.00 174.74 173.81 2b3b n ALA 67 N 4.19 1.38 0.00 -1.40 0.00 -0.40 -2.61 120.51 121.67 2b3b n ALA 67 Ca 0.10 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.89 2b3b n ALA 67 Cb 0.46 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.64 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 0.75 0.30 0.22 0.00 0.00 -0.72 -3.75 105.19 101.99 2b3b n GLY 68 Ca 0.05 -1.86 0.05 0.00 0.00 0.00 0.00 46.02 44.26 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 0.00 0.40 1.61 2.86 -1.01 -2.01 114.93 116.79 2b3b h MET 69 Ca 0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2b3b h MET 69 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 2b3b h MET 69 CO 0.00 0.19 -0.19 1.49 1.06 0.00 0.00 176.91 179.46 2b3b h GLU 70 N 0.00 -0.52 0.27 1.72 4.81 -1.37 0.13 114.58 119.62 2b3b h GLU 70 Ca -0.00 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2b3b h GLU 70 Cb 0.35 0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 2b3b h GLU 70 CO 0.03 -0.28 -0.52 1.25 -0.73 0.00 0.00 179.01 178.75 2b3b h LEU 71 N -0.65 -1.53 -0.13 1.64 5.85 -1.20 -2.71 115.31 116.58 2b3b h LEU 71 Ca -0.05 0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 2b3b h LEU 71 Cb 0.47 0.54 -0.00 0.00 0.37 0.00 0.00 40.66 42.04 2b3b h LEU 71 CO 0.09 -0.60 -0.01 0.40 -0.34 0.00 0.00 178.44 177.98 2b3b h ILE 72 N -0.86 1.26 0.00 4.05 1.08 -1.38 -1.32 117.51 120.34 2b3b h ILE 72 Ca -0.03 -0.86 -0.07 0.00 -0.39 0.00 0.00 64.86 63.51 2b3b h ILE 72 Cb 0.81 1.57 -0.01 0.00 -3.07 0.00 0.00 36.82 36.12 2b3b h ILE 72 CO -0.20 0.25 -0.34 1.23 -0.69 0.00 0.00 178.15 178.40 2b3b h GLY 73 N -0.04 0.00 0.00 5.37 0.00 -1.04 -1.38 103.07 105.99 2b3b h GLY 73 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2b3b h GLY 73 CO 0.01 0.00 -0.89 2.41 0.00 0.00 0.00 176.54 178.07 2b3b n THR 74 N -3.86 1.47 0.01 4.70 -1.04 -1.02 -4.65 114.28 109.88 2b3b n THR 74 Ca -0.01 0.16 -0.19 0.00 -2.04 0.00 0.00 64.05 61.97 2b3b n THR 74 Cb 0.41 -2.35 -0.14 0.00 -1.82 0.00 0.00 70.33 66.43 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 -0.99 0.42 0.06 -1.42 4.06 -1.39 -3.19 115.95 113.51 2b3b h TRP 75 Ca 0.00 -0.31 -0.11 0.00 2.06 0.00 0.00 58.89 60.53 2b3b h TRP 75 Cb 0.89 -0.02 0.01 0.00 -1.00 0.00 0.00 29.16 29.04 2b3b h TRP 75 CO -0.38 1.61 -0.47 0.28 -3.56 0.00 0.00 178.44 175.92 2b3b h VAL 76 N 0.06 1.59 -0.24 1.49 2.07 -1.46 -2.42 116.25 117.35 2b3b h VAL 76 Ca -0.38 -2.34 -0.01 0.00 0.82 0.00 0.00 66.70 64.79 2b3b h VAL 76 Cb 2.04 3.12 -0.01 0.00 -1.52 0.00 0.00 31.29 34.92 2b3b h VAL 76 CO 0.10 0.64 0.09 0.58 0.02 0.00 0.00 177.57 179.00 2b3b h VAL 77 N -0.55 1.10 0.00 2.57 2.07 -1.43 -0.80 116.25 119.21 2b3b h VAL 77 Ca -0.08 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2b3b h VAL 77 Cb 1.32 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 2b3b h VAL 77 CO 0.09 0.12 0.00 0.00 0.02 0.00 0.00 177.57 177.80 2b3b n ALA 78 N -2.50 2.29 -2.22 1.67 0.00 -1.20 -4.89 120.51 113.68 2b3b n ALA 78 Ca 0.01 -0.13 -0.16 0.00 0.00 0.00 0.00 53.44 53.15 2b3b n ALA 78 Cb 0.13 -1.36 -0.01 0.00 0.00 0.00 0.00 19.45 18.21 2b3b n ALA 78 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2b3b n ASN 79 N -1.03 -4.79 -0.52 0.00 5.15 -0.31 -4.91 115.26 108.86 2b3b n ASN 79 Ca 0.16 0.03 0.11 0.00 -0.60 0.00 0.00 54.58 54.27 2b3b n ASN 79 Cb 0.08 -3.89 0.00 0.00 -0.53 0.00 0.00 39.78 35.45 2b3b n ASN 79 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2b3b n ARG 80 N -2.54 1.36 -4.27 1.20 5.12 -0.91 -4.96 116.66 111.66 2b3b n ARG 80 Ca -0.19 -1.05 -0.29 0.00 -1.93 0.00 0.00 57.85 54.39 2b3b n ARG 80 Cb 0.63 -1.45 -0.11 0.00 -1.16 0.00 0.00 32.46 30.38 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 -2.35 1.93 0.20 5.56 -1.94 -1.25 -1.22 119.30 120.22 2b3b s MET 81 Ca 0.18 -1.14 -0.24 0.00 -1.71 0.00 0.00 55.69 52.78 2b3b s MET 81 Cb 0.17 -2.18 -0.08 0.00 2.01 0.00 0.00 34.83 34.75 2b3b s MET 81 CO 0.53 0.48 0.79 -1.21 -0.01 0.00 0.00 175.02 175.60 2b3b s GLU 82 N -2.25 4.52 0.01 2.03 2.02 -0.21 -4.75 118.70 120.07 2b3b s GLU 82 Ca 0.20 1.13 -0.30 0.00 0.02 0.00 0.00 54.97 56.01 2b3b s GLU 82 Cb -0.11 -3.13 -0.05 0.00 0.10 0.00 0.00 34.13 30.94 2b3b s GLU 82 CO 0.12 0.50 1.29 0.34 0.02 0.00 0.00 175.26 177.53 2b3b s ASP 83 N -1.31 6.96 -0.09 -0.19 2.15 -1.26 -4.64 116.67 118.29 2b3b s ASP 83 Ca 0.39 2.01 0.17 0.00 0.43 0.00 0.00 52.55 55.55 2b3b s ASP 83 Cb -0.21 -2.57 0.59 0.00 -0.30 0.00 0.00 42.92 40.43 2b3b s ASP 83 CO 0.25 -0.62 1.51 0.18 -0.17 0.00 0.00 175.17 176.32 2b3b n LEU 84 N 4.88 4.17 -0.23 -1.34 4.77 0.13 -4.67 117.00 124.71 2b3b n LEU 84 Ca 0.11 -2.42 -0.01 0.00 -0.03 0.00 0.00 56.01 53.67 2b3b n LEU 84 Cb 0.45 -0.49 0.06 0.00 -2.33 0.00 0.00 43.42 41.10 2b3b n LEU 84 CO 0.57 0.78 0.69 0.28 -1.33 0.00 0.00 177.39 178.39 2b3b h SER 85 N 3.27 -0.80 -0.50 -1.43 0.02 -1.92 -0.16 113.55 112.02 2b3b h SER 85 Ca 0.00 0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 61.14 2b3b h SER 85 Cb 1.27 0.48 -0.02 0.00 0.14 0.00 0.00 62.40 64.26 2b3b h SER 85 CO 0.17 -0.25 0.20 0.00 -1.14 0.00 0.00 176.83 175.80 2b3b h ALA 86 N 1.49 0.64 -0.43 3.77 0.00 -1.95 -2.24 119.26 120.54 2b3b h ALA 86 Ca 0.31 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.13 2b3b h ALA 86 Cb 0.52 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 2b3b h ALA 86 CO -0.71 0.25 0.07 1.25 0.00 0.00 0.00 179.25 180.12 2b3b h LEU 87 N 0.66 -0.02 -0.94 0.00 5.85 -1.69 -0.52 115.31 118.65 2b3b h LEU 87 Ca 0.17 0.08 0.04 0.00 0.84 0.00 0.00 57.88 59.00 2b3b h LEU 87 Cb 0.20 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.28 2b3b h LEU 87 CO -0.01 0.03 0.61 -0.26 -0.34 0.00 0.00 178.44 178.47 2b3b h PHE 88 N 0.20 1.15 -0.13 1.25 -1.00 -0.67 -1.23 116.94 116.52 2b3b h PHE 88 Ca 0.21 0.03 -0.14 0.00 2.81 0.00 0.00 57.97 60.88 2b3b h PHE 88 Cb 0.27 -0.38 0.00 0.00 3.61 0.00 0.00 35.95 39.45 2b3b h PHE 88 CO -0.22 0.66 -0.46 0.00 -1.61 0.00 0.00 178.31 176.68 2b3b h ARG 89 N 1.19 0.54 -0.82 1.51 3.08 -1.09 0.28 114.38 119.08 2b3b h ARG 89 Ca 0.38 -0.41 0.08 0.00 0.07 0.00 0.00 59.98 60.10 2b3b h ARG 89 Cb 0.01 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.08 2b3b h ARG 89 CO -0.12 1.03 0.53 1.96 -1.07 0.00 0.00 179.97 182.30 2b3b h GLN 90 N 0.17 0.79 -0.03 0.04 4.20 -0.88 -2.30 115.11 117.10 2b3b h GLN 90 Ca -0.02 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.64 2b3b h GLN 90 Cb 1.09 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.69 2b3b h GLN 90 CO 0.10 0.52 0.00 0.39 -0.67 0.00 0.00 178.83 179.17 2b3b n GLU 91 N -4.50 1.81 -2.23 1.46 -0.58 -0.48 -4.94 120.64 111.18 2b3b n GLU 91 Ca 0.13 -1.18 -0.13 0.00 -0.42 0.00 0.00 57.16 55.55 2b3b n GLU 91 Cb 0.28 -1.47 -0.01 0.00 -0.57 0.00 0.00 31.44 29.67 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 1.21 -0.13 0.08 0.62 0.00 -0.84 -4.91 105.19 101.22 2b3b n GLY 92 Ca 0.18 -0.33 0.13 0.00 0.00 0.00 0.00 46.02 46.00 2b3b n GLY 92 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2b3b n TRP 93 N -3.97 0.70 0.25 1.61 8.01 0.93 -2.88 117.44 122.08 2b3b n TRP 93 Ca -0.16 0.20 0.12 0.00 -1.31 0.00 0.00 57.50 56.35 2b3b n TRP 93 Cb 0.62 -0.79 0.61 0.00 -2.01 0.00 0.00 31.31 29.74 2b3b n TRP 93 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.69 176.61 2b3b h LEU 94 N 0.00 0.00 0.00 -0.99 3.38 -1.91 -2.62 115.31 113.16 2b3b h LEU 94 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2b3b h LEU 94 Cb 0.71 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 2b3b h LEU 94 CO 0.00 0.16 -1.47 0.00 0.09 0.00 0.00 178.44 177.22 2b3b n GLN 95 N -3.46 0.63 0.17 1.13 3.00 -1.14 -4.45 117.38 113.27 2b3b n GLN 95 Ca -0.01 -0.02 0.10 0.00 -0.01 0.00 0.00 57.00 57.06 2b3b n GLN 95 Cb 0.33 -1.69 0.09 0.00 0.00 0.00 0.00 30.24 28.98 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 1.98 0.81 -3.80 -1.58 0.00 -1.37 -3.46 119.26 111.85 2b3b h ALA 96 Ca -0.01 -0.10 -0.68 0.00 0.00 0.00 0.00 54.91 54.12 2b3b h ALA 96 Cb 1.02 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.62 2b3b h ALA 96 CO 0.00 0.13 -0.80 -0.06 0.00 0.00 0.00 179.25 178.52 2b3b s PHE 97 N -3.20 2.56 0.45 0.00 0.08 -1.09 -0.90 117.98 115.88 2b3b s PHE 97 Ca 0.04 -0.25 -0.25 0.00 0.12 0.00 0.00 56.93 56.59 2b3b s PHE 97 Cb 0.07 -1.40 -0.08 0.00 -0.57 0.00 0.00 43.02 41.04 2b3b s PHE 97 CO 0.72 0.34 1.44 -1.25 -0.10 0.00 0.00 175.22 176.37 2b3b s PRO 98 N -1.89 3.69 0.27 0.24 0.04 -1.26 -4.85 135.00 131.25 2b3b s PRO 98 Ca 0.17 2.46 -0.00 0.00 0.04 0.00 0.00 61.00 63.66 2b3b s PRO 98 Cb -0.11 -2.67 0.50 0.00 0.04 0.00 0.00 34.50 32.26 2b3b s PRO 98 CO 0.09 -0.82 1.84 0.87 0.04 0.00 0.00 177.00 179.01 2b3b h LYS 99 N 2.35 0.97 -0.67 4.56 1.57 -1.98 -1.36 116.57 122.00 2b3b h LYS 99 Ca -0.51 -0.06 0.06 0.00 -1.87 0.00 0.00 60.65 58.28 2b3b h LYS 99 Cb 1.27 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 33.32 2b3b h LYS 99 CO 0.61 0.64 0.44 0.78 -0.57 0.00 0.00 179.45 181.36 2b3b h GLY 100 N 1.00 0.85 0.78 3.86 0.00 -2.00 -0.07 103.07 107.50 2b3b h GLY 100 Ca 0.47 -0.27 -0.17 0.00 0.00 0.00 0.00 47.33 47.36 2b3b h GLY 100 CO -0.25 0.20 -0.67 -2.00 0.00 0.00 0.00 176.54 173.82 2b3b h LEU 101 N 0.67 0.53 -0.65 3.11 5.85 -1.65 -2.91 115.31 120.27 2b3b h LEU 101 Ca 0.29 -0.80 0.11 0.00 0.84 0.00 0.00 57.88 58.32 2b3b h LEU 101 Cb 0.28 -0.17 -0.08 0.00 0.37 0.00 0.00 40.66 41.06 2b3b h LEU 101 CO -0.09 1.27 0.25 0.40 -0.34 0.00 0.00 178.44 179.93 2b3b h ILE 102 N -0.14 0.74 -0.97 4.05 1.08 -1.06 -1.48 117.51 119.73 2b3b h ILE 102 Ca -0.09 -0.14 0.11 0.00 -0.39 0.00 0.00 64.86 64.34 2b3b h ILE 102 Cb 1.41 0.28 -0.08 0.00 -3.07 0.00 0.00 36.82 35.36 2b3b h ILE 102 CO 0.13 0.08 0.61 0.44 -0.69 0.00 0.00 178.15 178.71 2b3b h ASP 103 N 0.42 0.90 0.38 1.72 3.32 -1.00 -1.62 116.42 120.55 2b3b h ASP 103 Ca 0.34 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.40 2b3b h ASP 103 Cb 0.44 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.85 2b3b h ASP 103 CO -0.34 0.50 -0.15 -0.07 -1.72 0.00 0.00 179.24 177.46 2b3b h LEU 104 N 0.99 0.00 -2.30 1.55 3.38 -1.07 -2.79 115.31 115.07 2b3b h LEU 104 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.44 2b3b h LEU 104 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2b3b h LEU 104 CO -0.25 0.15 0.00 2.30 0.09 0.00 0.00 178.44 180.73 2b3b n ILE 105 N -3.73 0.55 -4.13 1.22 -5.35 -0.68 -1.76 119.36 105.48 2b3b n ILE 105 Ca -0.02 -0.78 -0.30 0.00 -0.27 0.00 0.00 62.75 61.39 2b3b n ILE 105 Cb 0.26 0.89 -0.08 0.00 -1.74 0.00 0.00 39.64 38.97 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 -1.20 5.06 -0.29 7.28 0.01 -0.76 -1.20 113.70 122.60 2b3b s SER 106 Ca 0.29 -0.18 -0.19 0.00 1.31 0.00 0.00 55.95 57.18 2b3b s SER 106 Cb 0.17 -1.21 0.16 0.00 0.21 0.00 0.00 66.02 65.34 2b3b s SER 106 CO 0.23 0.16 1.08 -0.47 0.41 0.00 0.00 173.24 174.66 2b3b s TYR 107 N -1.37 -0.41 -1.63 2.43 5.04 -0.38 -4.96 117.35 116.07 2b3b s TYR 107 Ca 0.26 0.86 -0.11 0.00 -2.44 0.00 0.00 57.07 55.64 2b3b s TYR 107 Cb -0.11 0.30 0.10 0.00 0.35 0.00 0.00 41.96 42.60 2b3b s TYR 107 CO 0.19 -0.20 0.51 1.63 -1.34 0.00 0.00 175.55 176.34 2b3b n LYS 108 N 3.11 -2.36 -0.68 4.97 4.76 -1.26 -0.38 118.16 126.32 2b3b n LYS 108 Ca -0.16 0.29 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 2b3b n LYS 108 Cb 0.57 -4.60 0.00 0.00 -1.84 0.00 0.00 35.03 29.16 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 -1.72 1.42 3.85 0.72 0.00 -1.26 -5.02 105.19 103.19 2b3b n GLY 109 Ca -0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.94 1.46 -0.10 -0.02 0.00 0.49 -4.98 107.32 102.22 2b3b s GLY 110 Ca 0.00 -1.32 0.03 0.00 0.00 0.00 0.00 44.72 43.43 2b3b s GLY 110 CO 0.00 -1.35 -0.20 -0.42 0.00 0.00 0.00 173.10 171.13 2b3b s ILE 111 N -2.00 1.80 -0.23 0.90 1.01 -1.26 -1.25 121.20 120.18 2b3b s ILE 111 Ca 0.33 -0.86 0.03 0.00 0.00 0.00 0.00 60.65 60.15 2b3b s ILE 111 Cb -0.09 -1.58 -0.01 0.00 0.01 0.00 0.00 42.46 40.78 2b3b s ILE 111 CO 0.26 0.50 0.28 0.79 0.00 0.00 0.00 174.94 176.76 2b3b n TRP 112 N 3.74 0.00 -3.70 3.97 7.02 -0.34 0.19 117.44 128.32 2b3b n TRP 112 Ca -0.20 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.20 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 -0.96 -0.36 -0.29 -0.99 1.04 -1.26 -4.51 113.70 106.36 2b3b s SER 113 Ca 0.02 -0.37 -0.04 0.00 0.48 0.00 0.00 55.95 56.04 2b3b s SER 113 Cb 0.02 0.65 0.03 0.00 0.10 0.00 0.00 66.02 66.83 2b3b s SER 113 CO 0.10 -1.16 0.02 -0.69 0.98 0.00 0.00 173.24 172.49 2b3b s VAL 114 N -3.78 3.33 0.22 5.02 1.01 0.96 -4.90 120.40 122.27 2b3b s VAL 114 Ca 0.08 -1.09 -0.30 0.00 0.00 0.00 0.00 61.98 60.67 2b3b s VAL 114 Cb -0.04 -2.81 -0.09 0.00 0.00 0.00 0.00 36.38 33.44 2b3b s VAL 114 CO -0.00 -0.00 1.29 -2.84 0.00 0.00 0.00 175.10 173.55 2b3b s PRO 115 N 1.36 4.40 -0.01 2.72 0.02 -1.26 -0.83 135.00 141.39 2b3b s PRO 115 Ca -0.01 2.06 0.14 0.00 0.02 0.00 0.00 61.00 63.20 2b3b s PRO 115 Cb -0.18 -3.18 -0.20 0.00 0.02 0.00 0.00 34.50 30.96 2b3b s PRO 115 CO -0.00 -0.21 0.36 1.55 -0.33 0.00 0.00 177.00 178.37 2b3b n VAL 116 N 2.25 0.00 -3.83 3.83 3.14 -0.24 -4.59 118.33 118.89 2b3b n VAL 116 Ca 0.05 -0.29 -0.08 0.00 -2.96 0.00 0.00 64.34 61.06 2b3b n VAL 116 Cb 0.43 0.35 0.01 0.00 -1.06 0.00 0.00 33.84 33.57 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 -3.31 -0.10 -0.07 6.55 2.20 -1.23 -4.13 114.94 114.85 2b3b s ASN 117 Ca -0.03 -0.92 0.01 0.00 -0.94 0.00 0.00 52.86 50.98 2b3b s ASN 117 Cb 0.09 0.80 0.02 0.00 -2.00 0.00 0.00 41.25 40.16 2b3b s ASN 117 CO 0.57 -1.54 -0.08 -0.63 -2.94 0.00 0.00 177.10 172.48 2b3b s ILE 118 N -2.95 0.90 0.24 0.54 -1.09 0.81 -4.23 121.20 115.42 2b3b s ILE 118 Ca 0.14 -0.29 0.08 0.00 -2.23 0.00 0.00 60.65 58.34 2b3b s ILE 118 Cb -0.05 -0.88 -0.04 0.00 -1.58 0.00 0.00 42.46 39.90 2b3b s ILE 118 CO 0.09 0.32 0.10 -1.00 -1.23 0.00 0.00 174.94 173.22 2b3b s HIS 119 N 1.11 2.94 -0.13 3.97 3.76 -0.53 -1.34 115.29 125.06 2b3b s HIS 119 Ca -0.07 -0.14 0.00 0.00 -0.15 0.00 0.00 55.06 54.70 2b3b s HIS 119 Cb -0.14 -1.34 -0.01 0.00 1.11 0.00 0.00 32.58 32.20 2b3b s HIS 119 CO -0.01 0.55 -0.15 0.50 -0.85 0.00 0.00 174.74 174.79 2b3b s ARG 120 N -3.59 3.31 -0.09 1.40 3.52 -1.26 -1.72 118.95 120.51 2b3b s ARG 120 Ca 0.31 -0.72 -0.26 0.00 -0.13 0.00 0.00 55.73 54.93 2b3b s ARG 120 Cb -0.08 -2.60 -0.25 0.00 -1.56 0.00 0.00 34.95 30.46 2b3b s ARG 120 CO 0.22 0.16 0.91 1.03 -0.81 0.00 0.00 175.30 176.81 2b3b h SER 121 N 6.87 0.14 -0.36 -2.12 0.87 -1.35 -2.69 113.55 114.91 2b3b h SER 121 Ca -0.27 -0.88 -0.72 0.00 -1.23 0.00 0.00 61.79 58.70 2b3b h SER 121 Cb 1.21 -0.04 -0.06 0.00 -0.44 0.00 0.00 62.40 63.07 2b3b h SER 121 CO 0.55 1.00 2.95 -0.46 -0.53 0.00 0.00 176.83 180.35 2b3b n ASN 122 N -4.53 4.93 -4.16 6.23 6.94 -1.26 -3.45 115.26 119.97 2b3b n ASN 122 Ca -0.10 -2.88 -0.26 0.00 -0.02 0.00 0.00 54.58 51.32 2b3b n ASN 122 Cb 0.52 -1.59 -0.16 0.00 -2.36 0.00 0.00 39.78 36.19 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 2.25 1.48 -0.19 3.53 1.01 -1.25 -1.35 120.40 125.89 2b3b s VAL 123 Ca 0.48 -0.77 -0.06 0.00 0.00 0.00 0.00 61.98 61.64 2b3b s VAL 123 Cb 0.14 -1.25 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 2b3b s VAL 123 CO -0.07 0.42 0.02 -0.32 0.00 0.00 0.00 175.10 175.16 2b3b s MET 124 N -0.17 3.78 -0.07 2.72 1.75 0.12 -1.69 119.30 125.75 2b3b s MET 124 Ca 0.01 -0.44 0.00 0.00 -1.25 0.00 0.00 55.69 54.01 2b3b s MET 124 Cb -0.10 -3.12 -0.03 0.00 2.84 0.00 0.00 34.83 34.42 2b3b s MET 124 CO 0.01 0.16 -0.06 -1.58 -0.65 0.00 0.00 175.02 172.90 2b3b s TRP 125 N 0.64 2.98 0.22 4.11 0.52 0.27 -1.88 118.94 125.79 2b3b s TRP 125 Ca 0.01 0.05 -0.18 0.00 0.02 0.00 0.00 56.10 56.00 2b3b s TRP 125 Cb -0.14 -1.72 0.03 0.00 -1.15 0.00 0.00 33.47 30.49 2b3b s TRP 125 CO 0.02 0.36 0.57 1.52 0.02 0.00 0.00 176.95 179.44 2b3b s TYR 126 N -0.83 -0.11 -0.38 -1.98 -0.85 -1.00 -1.94 117.35 110.25 2b3b s TYR 126 Ca 0.13 -0.25 -0.09 0.00 -0.52 0.00 0.00 57.07 56.33 2b3b s TYR 126 Cb -0.11 0.46 0.05 0.00 0.38 0.00 0.00 41.96 42.74 2b3b s TYR 126 CO 0.02 -1.00 0.20 -0.51 -1.52 0.00 0.00 175.55 172.74 2b3b s LEU 127 N -2.89 4.79 0.34 -3.49 1.02 -1.26 -0.43 118.68 116.75 2b3b s LEU 127 Ca 0.11 -1.21 0.12 0.00 0.02 0.00 0.00 54.13 53.16 2b3b s LEU 127 Cb -0.02 -1.98 0.95 0.00 0.02 0.00 0.00 46.19 45.16 2b3b s LEU 127 CO 0.00 -0.43 1.73 -0.65 0.02 0.00 0.00 176.35 177.02 2b3b h PRO 128 N 8.38 0.50 -0.02 1.29 0.11 -1.86 0.46 132.00 140.87 2b3b h PRO 128 Ca -0.24 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.72 2b3b h PRO 128 Cb 1.09 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 2b3b h PRO 128 CO 0.69 0.33 -0.56 0.00 -0.21 0.00 0.00 178.00 178.25 2b3b h ALA 129 N 1.72 1.03 -0.03 -0.75 0.00 -1.94 -0.97 119.26 118.33 2b3b h ALA 129 Ca 0.65 -0.51 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 2b3b h ALA 129 Cb 1.34 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2b3b h ALA 129 CO -0.45 0.70 -0.12 0.87 0.00 0.00 0.00 179.25 180.24 2b3b h LYS 130 N 0.04 0.14 -0.85 0.00 1.79 -1.35 -1.74 116.57 114.61 2b3b h LYS 130 Ca -0.00 -0.11 0.07 0.00 -2.18 0.00 0.00 60.65 58.43 2b3b h LYS 130 Cb 1.01 0.02 -0.06 0.00 -1.58 0.00 0.00 32.23 31.61 2b3b h LYS 130 CO 0.08 0.75 0.52 -0.07 -1.08 0.00 0.00 179.45 179.64 2b3b h LEU 131 N -0.44 0.80 0.06 2.94 4.07 -1.31 -0.50 115.31 120.92 2b3b h LEU 131 Ca -0.01 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.97 2b3b h LEU 131 Cb 0.77 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.37 2b3b h LEU 131 CO 0.03 0.50 -0.03 0.50 -1.08 0.00 0.00 178.44 178.36 2b3b h LYS 132 N 0.93 -0.07 0.00 1.13 3.64 -1.21 0.49 116.57 121.47 2b3b h LYS 132 Ca 0.38 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.75 2b3b h LYS 132 Cb 0.21 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2b3b h LYS 132 CO -0.19 -0.04 -0.05 0.78 -2.27 0.00 0.00 179.45 177.68 2b3b h GLY 133 N -0.09 0.00 0.84 5.01 0.00 -0.71 -1.79 103.07 106.33 2b3b h GLY 133 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2b3b h GLY 133 CO 0.01 0.00 -0.63 0.79 0.00 0.00 0.00 176.54 176.72 2b3b n TRP 134 N -4.02 0.06 -1.79 5.60 8.01 -0.25 -4.98 117.44 120.08 2b3b n TRP 134 Ca -0.03 0.02 -0.02 0.00 -1.31 0.00 0.00 57.50 56.17 2b3b n TRP 134 Cb 0.14 -0.26 -0.00 0.00 -2.01 0.00 0.00 31.31 29.17 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 1.48 0.35 3.47 6.99 0.00 -0.11 -5.02 105.19 112.36 2b3b n GLY 135 Ca 0.05 -0.87 -0.25 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.07 2.54 0.19 1.61 -7.23 -0.03 -5.02 120.40 110.39 2b3b s VAL 136 Ca 0.00 -2.24 0.01 0.00 -1.81 0.00 0.00 61.98 57.94 2b3b s VAL 136 Cb 0.00 -2.30 -0.04 0.00 0.56 0.00 0.00 36.38 34.60 2b3b s VAL 136 CO 0.00 -0.31 0.35 0.20 -0.31 0.00 0.00 175.10 175.03 2b3b s ASN 137 N -3.26 6.35 0.01 4.85 0.01 -1.26 -4.28 114.94 117.37 2b3b s ASN 137 Ca 0.27 0.26 -0.30 0.00 -0.71 0.00 0.00 52.86 52.38 2b3b s ASN 137 Cb -0.06 -1.95 -0.07 0.00 0.41 0.00 0.00 41.25 39.59 2b3b s ASN 137 CO 0.14 -0.02 1.54 -2.16 -1.51 0.00 0.00 177.10 175.10 2b3b s PRO 138 N -3.41 4.23 0.27 -0.60 0.04 -1.26 -4.97 135.00 129.30 2b3b s PRO 138 Ca 0.36 2.14 -0.30 0.00 0.04 0.00 0.00 61.00 63.25 2b3b s PRO 138 Cb -0.11 -3.66 -0.10 0.00 0.04 0.00 0.00 34.50 30.67 2b3b s PRO 138 CO 0.29 -0.69 1.46 -1.25 0.04 0.00 0.00 177.00 176.85 2b3b s PRO 139 N 2.81 4.24 0.02 0.56 0.04 -1.26 -4.95 135.00 136.46 2b3b s PRO 139 Ca 0.69 2.37 0.22 0.00 0.04 0.00 0.00 61.00 64.32 2b3b s PRO 139 Cb -0.35 -3.08 -0.10 0.00 0.04 0.00 0.00 34.50 31.01 2b3b s PRO 139 CO 0.29 -0.45 0.89 0.54 0.04 0.00 0.00 177.00 178.31 2b3b n ARG 140 N 2.02 0.29 -4.13 4.56 1.74 -1.26 -4.50 116.66 115.39 2b3b n ARG 140 Ca 0.06 -0.04 -0.09 0.00 -0.77 0.00 0.00 57.85 57.01 2b3b n ARG 140 Cb 0.40 -1.55 -0.10 0.00 -1.02 0.00 0.00 32.46 30.18 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 -3.21 0.32 0.31 0.55 -4.23 -1.26 -0.73 115.64 107.38 2b3b s THR 141 Ca 0.02 -1.87 0.04 0.00 -1.18 0.00 0.00 61.69 58.71 2b3b s THR 141 Cb 0.15 -1.69 0.10 0.00 1.34 0.00 0.00 72.50 72.39 2b3b s THR 141 CO 0.84 -0.84 1.78 -0.50 -0.54 0.00 0.00 174.62 175.36 2b3b h TRP 142 N 3.03 0.50 -0.42 3.99 4.06 -1.93 -0.06 115.95 125.11 2b3b h TRP 142 Ca -0.35 -0.09 0.01 0.00 2.06 0.00 0.00 58.89 60.52 2b3b h TRP 142 Cb 1.16 -0.13 -0.02 0.00 -1.00 0.00 0.00 29.16 29.17 2b3b h TRP 142 CO 0.52 0.62 0.28 -0.44 -3.56 0.00 0.00 178.44 175.86 2b3b h ASP 143 N 0.41 0.48 -0.40 -3.49 3.32 -1.98 -1.22 116.42 113.54 2b3b h ASP 143 Ca 0.07 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 57.00 2b3b h ASP 143 Cb 0.56 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 2b3b h ASP 143 CO 0.04 0.34 -0.15 0.11 -1.72 0.00 0.00 179.24 177.86 2b3b h LYS 144 N 0.57 0.87 -0.41 3.56 1.57 -1.91 -2.21 116.57 118.61 2b3b h LYS 144 Ca 0.16 -0.32 0.05 0.00 -1.87 0.00 0.00 60.65 58.67 2b3b h LYS 144 Cb -0.06 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.15 2b3b h LYS 144 CO -0.04 0.96 0.13 0.35 -0.57 0.00 0.00 179.45 180.29 2b3b h PHE 145 N 0.77 0.24 -0.51 -1.35 3.57 -0.71 0.23 116.94 119.19 2b3b h PHE 145 Ca 0.12 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.54 2b3b h PHE 145 Cb 0.68 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 2b3b h PHE 145 CO 0.04 0.08 -0.08 -0.07 -2.23 0.00 0.00 178.31 176.06 2b3b h LEU 146 N 0.29 0.91 -0.38 0.59 3.38 -1.03 0.44 115.31 119.51 2b3b h LEU 146 Ca 0.19 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2b3b h LEU 146 Cb 0.19 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2b3b h LEU 146 CO -0.21 1.01 0.07 0.00 0.09 0.00 0.00 178.44 179.40 2b3b h ALA 147 N 1.08 0.50 -0.54 1.53 0.00 -1.09 -1.87 119.26 118.86 2b3b h ALA 147 Ca 0.14 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2b3b h ALA 147 Cb 0.60 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2b3b h ALA 147 CO 0.04 0.20 0.13 1.15 0.00 0.00 0.00 179.25 180.77 2b3b h THR 148 N 0.47 1.25 -0.56 0.00 2.02 -0.73 -1.08 112.91 114.28 2b3b h THR 148 Ca 0.12 -0.88 -0.05 0.00 0.77 0.00 0.00 66.41 66.37 2b3b h THR 148 Cb 0.34 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 2b3b h THR 148 CO 0.01 0.32 0.16 0.00 0.37 0.00 0.00 175.52 176.38 2b3b h GLN 150 N 0.82 0.43 -0.12 0.00 4.15 -1.10 0.10 115.11 119.39 2b3b h GLN 150 Ca 0.18 -0.06 0.04 0.00 0.77 0.00 0.00 58.65 59.58 2b3b h GLN 150 Cb 0.26 -0.08 -0.05 0.00 0.21 0.00 0.00 27.48 27.82 2b3b h GLN 150 CO -0.01 0.41 -0.22 1.15 -1.93 0.00 0.00 178.83 178.24 2b3b h THR 151 N 0.34 0.47 -0.76 2.39 2.02 -0.73 -1.81 112.91 114.83 2b3b h THR 151 Ca 0.10 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.27 2b3b h THR 151 Cb 0.13 0.47 -0.04 0.00 -1.74 0.00 0.00 68.15 66.97 2b3b h THR 151 CO -0.01 0.00 0.43 -0.07 0.37 0.00 0.00 175.52 176.24 2b3b h LEU 152 N -0.28 0.93 -1.08 2.58 3.38 -0.67 -2.36 115.31 117.80 2b3b h LEU 152 Ca 0.10 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2b3b h LEU 152 Cb 0.42 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 2b3b h LEU 152 CO -0.28 0.74 0.41 0.11 0.09 0.00 0.00 178.44 179.51 2b3b h LYS 153 N 1.04 1.05 0.00 1.13 1.57 -0.62 -1.56 116.57 119.17 2b3b h LYS 153 Ca 0.27 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 2b3b h LYS 153 Cb 0.00 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.10 2b3b h LYS 153 CO -0.05 0.77 -0.04 1.96 -0.57 0.00 0.00 179.45 181.52 2b3b h GLN 154 N 1.05 0.00 -0.10 3.15 4.20 -0.85 -0.09 115.11 122.48 2b3b h GLN 154 Ca 0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.98 2b3b h GLN 154 Cb 0.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.81 2b3b h GLN 154 CO -0.04 0.04 0.00 1.63 -0.67 0.00 0.00 178.83 179.79 2b3b n LYS 155 N -3.20 1.48 -0.30 1.46 5.02 -0.68 -4.94 118.16 117.00 2b3b n LYS 155 Ca -0.00 -0.71 0.00 0.00 -2.02 0.00 0.00 58.31 55.57 2b3b n LYS 155 Cb 0.27 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 33.91 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 1.03 0.73 3.53 0.72 0.00 -0.05 -5.01 105.19 106.14 2b3b n GLY 156 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 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 3.70 0.39 0.99 2.96 -0.69 -4.88 118.68 121.16 2b3b s LEU 157 Ca 0.00 -1.21 0.09 0.00 -0.22 0.00 0.00 54.13 52.78 2b3b s LEU 157 Cb 0.00 -2.53 0.85 0.00 0.50 0.00 0.00 46.19 45.01 2b3b s LEU 157 CO 0.00 -1.53 1.99 -0.33 -1.32 0.00 0.00 176.35 175.15 2b3b h GLU 158 N 9.71 0.59 -2.45 1.98 5.08 -1.85 -3.24 114.58 124.40 2b3b h GLU 158 Ca 0.02 -0.04 -0.59 0.00 -1.00 0.00 0.00 59.36 57.75 2b3b h GLU 158 Cb 1.03 -0.13 -0.39 0.00 0.50 0.00 0.00 28.75 29.76 2b3b h GLU 158 CO 1.32 0.39 -0.92 0.00 -1.00 0.00 0.00 179.01 178.80 2b3b n ALA 159 N -2.48 2.93 0.28 3.43 0.00 -1.26 -4.89 120.51 118.52 2b3b n ALA 159 Ca 0.09 -3.32 0.13 0.00 0.00 0.00 0.00 53.44 50.34 2b3b n ALA 159 Cb 0.24 -0.79 0.84 0.00 0.00 0.00 0.00 19.45 19.73 2b3b n ALA 159 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2b3b h PRO 160 N 5.54 0.00 -5.05 0.00 0.11 -1.64 -3.39 132.00 127.57 2b3b h PRO 160 Ca 0.25 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 65.72 2b3b h PRO 160 Cb 0.89 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 31.82 2b3b h PRO 160 CO 0.42 0.00 -0.56 -1.17 -0.21 0.00 0.00 178.00 176.49 2b3b s LEU 161 N -8.08 3.82 0.17 2.35 2.96 -0.28 0.25 118.68 119.86 2b3b s LEU 161 Ca -0.05 -0.02 -0.28 0.00 -0.22 0.00 0.00 54.13 53.57 2b3b s LEU 161 Cb 0.16 -2.02 -0.08 0.00 0.50 0.00 0.00 46.19 44.75 2b3b s LEU 161 CO 0.58 0.04 0.86 0.00 -1.32 0.00 0.00 176.35 176.51 2b3b s ALA 162 N 1.21 3.38 0.00 5.97 0.00 0.36 -2.58 121.76 130.09 2b3b s ALA 162 Ca 0.06 0.48 -0.18 0.00 0.00 0.00 0.00 51.96 52.32 2b3b s ALA 162 Cb -0.14 -3.09 0.03 0.00 0.00 0.00 0.00 23.12 19.92 2b3b s ALA 162 CO 0.05 0.20 0.38 -1.17 0.00 0.00 0.00 175.76 175.22 2b3b s LEU 163 N -0.90 0.54 0.00 0.00 2.96 -1.26 -4.50 118.68 115.52 2b3b s LEU 163 Ca 0.39 0.11 0.00 0.00 -0.22 0.00 0.00 54.13 54.41 2b3b s LEU 163 Cb -0.24 1.57 0.00 0.00 0.50 0.00 0.00 46.19 48.02 2b3b s LEU 163 CO 0.28 -0.55 0.00 0.61 -1.32 0.00 0.00 176.35 175.38 2b3b n GLY 164 N 0.94 5.33 3.51 7.98 0.00 -1.26 -4.38 105.19 117.30 2b3b n GLY 164 Ca -0.20 -1.41 -0.28 0.00 0.00 0.00 0.00 46.02 44.12 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 4.24 -0.88 0.24 1.61 -1.05 0.70 -4.04 118.70 119.53 2b3b s GLU 165 Ca 0.00 0.75 -0.15 0.00 -0.15 0.00 0.00 54.97 55.42 2b3b s GLU 165 Cb 0.00 -1.56 0.30 0.00 -0.44 0.00 0.00 34.13 32.43 2b3b s GLU 165 CO 0.00 -3.67 1.55 -1.71 0.95 0.00 0.00 175.26 172.38 2b3b n ASN 166 N -4.87 -0.57 0.23 0.83 2.85 -1.26 0.03 115.26 112.50 2b3b n ASN 166 Ca 0.03 1.73 0.06 0.00 -0.11 0.00 0.00 54.58 56.29 2b3b n ASN 166 Cb 0.55 -0.43 0.53 0.00 1.24 0.00 0.00 39.78 41.67 2b3b n ASN 166 CO 0.00 0.00 0.00 4.11 -2.11 0.00 0.00 177.26 179.26 2b3b h TRP 167 N 0.00 0.01 0.00 1.20 5.08 -1.97 0.01 115.95 120.28 2b3b h TRP 167 Ca 0.38 -0.00 -0.05 0.00 1.08 0.00 0.00 58.89 60.30 2b3b h TRP 167 Cb 0.63 -0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.78 2b3b h TRP 167 CO -0.84 0.14 -0.26 1.79 -1.28 0.00 0.00 178.44 177.99 2b3b h THR 168 N 0.01 0.68 0.09 0.12 1.35 -0.69 0.89 112.91 115.36 2b3b h THR 168 Ca 0.00 -1.14 -0.28 0.00 -0.55 0.00 0.00 66.41 64.44 2b3b h THR 168 Cb 0.24 1.74 0.03 0.00 -1.73 0.00 0.00 68.15 68.43 2b3b h THR 168 CO 0.02 0.25 -1.15 1.56 -0.25 0.00 0.00 175.52 175.95 2b3b h GLN 169 N 0.00 0.63 -0.82 4.72 4.20 -0.76 -0.71 115.11 122.37 2b3b h GLN 169 Ca -0.00 -0.79 0.01 0.00 0.06 0.00 0.00 58.65 57.93 2b3b h GLN 169 Cb 0.71 0.25 -0.04 0.00 0.30 0.00 0.00 27.48 28.71 2b3b h GLN 169 CO 0.03 1.35 0.55 1.96 -0.67 0.00 0.00 178.83 182.05 2b3b h GLN 170 N 0.27 1.07 -0.43 1.46 4.20 -0.96 -0.53 115.11 120.19 2b3b h GLN 170 Ca -0.17 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.46 2b3b h GLN 170 Cb 1.83 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 29.34 2b3b h GLN 170 CO 0.22 0.71 0.21 1.25 -0.67 0.00 0.00 178.83 180.55 2b3b h HIS 171 N 1.11 0.62 -0.33 2.96 2.76 -0.63 -1.08 115.15 120.56 2b3b h HIS 171 Ca 0.30 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.45 2b3b h HIS 171 Cb -0.11 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 28.64 2b3b h HIS 171 CO -0.00 0.50 0.22 1.25 -1.30 0.00 0.00 177.93 178.60 2b3b h LEU 172 N 0.56 0.38 -0.79 0.26 5.85 -0.89 -2.93 115.31 117.74 2b3b h LEU 172 Ca 0.15 -0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.95 2b3b h LEU 172 Cb 0.11 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 40.97 2b3b h LEU 172 CO -0.02 0.28 0.43 -0.25 -0.34 0.00 0.00 178.44 178.54 2b3b h TRP 173 N 0.44 0.77 -0.29 1.25 7.01 -0.55 -2.09 115.95 122.48 2b3b h TRP 173 Ca 0.12 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.09 2b3b h TRP 173 Cb -0.04 -0.23 -0.02 0.00 -2.10 0.00 0.00 29.16 26.77 2b3b h TRP 173 CO -0.05 0.29 -0.10 1.05 -2.79 0.00 0.00 178.44 176.84 2b3b h GLU 174 N 0.71 0.48 -0.41 2.65 4.11 -1.03 0.22 114.58 121.31 2b3b h GLU 174 Ca 0.39 -0.13 -0.03 0.00 0.07 0.00 0.00 59.36 59.66 2b3b h GLU 174 Cb 0.40 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 2b3b h GLU 174 CO -0.27 0.58 0.13 0.77 0.07 0.00 0.00 179.01 180.30 2b3b h SER 175 N 0.45 0.59 0.00 3.06 0.02 -1.39 -1.22 113.55 115.07 2b3b h SER 175 Ca 0.09 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2b3b h SER 175 Cb 0.45 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2b3b h SER 175 CO 0.02 0.63 -0.00 0.58 -1.14 0.00 0.00 176.83 176.92 2b3b h VAL 176 N 0.51 1.00 -0.82 2.27 2.07 -0.71 -1.48 116.25 119.09 2b3b h VAL 176 Ca 0.13 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.68 2b3b h VAL 176 Cb 0.25 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 2b3b h VAL 176 CO -0.01 0.00 0.52 0.00 0.02 0.00 0.00 177.57 178.11 2b3b h ALA 177 N 0.99 1.08 -0.71 1.67 0.00 -0.59 -0.01 119.26 121.68 2b3b h ALA 177 Ca -0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2b3b h ALA 177 Cb 0.01 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 2b3b h ALA 177 CO 0.00 0.34 0.22 1.25 0.00 0.00 0.00 179.25 181.06 2b3b h LEU 178 N 1.01 1.04 -0.36 0.00 5.85 -1.00 0.12 115.31 121.98 2b3b h LEU 178 Ca 0.33 -0.21 -0.10 0.00 0.84 0.00 0.00 57.88 58.74 2b3b h LEU 178 Cb 0.02 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.77 2b3b h LEU 178 CO -0.12 0.97 -0.16 0.00 -0.34 0.00 0.00 178.44 178.80 2b3b h ALA 179 N 1.11 0.50 -0.22 1.25 0.00 -0.51 0.65 119.26 122.04 2b3b h ALA 179 Ca 0.23 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 2b3b h ALA 179 Cb 0.31 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2b3b h ALA 179 CO -0.01 0.41 -0.44 0.28 0.00 0.00 0.00 179.25 179.49 2b3b h VAL 180 N 0.52 1.31 0.00 0.00 2.07 -0.88 -3.32 116.25 115.96 2b3b h VAL 180 Ca 0.08 -1.66 -0.15 0.00 0.82 0.00 0.00 66.70 65.79 2b3b h VAL 180 Cb 0.69 1.81 -0.03 0.00 -1.52 0.00 0.00 31.29 32.24 2b3b h VAL 180 CO 0.05 0.52 -1.16 -0.07 0.02 0.00 0.00 177.57 176.93 2b3b h LEU 181 N 0.40 0.00 -0.20 2.57 3.38 -0.78 -3.50 115.31 117.18 2b3b h LEU 181 Ca 0.01 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.11 2b3b h LEU 181 Cb 1.05 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.73 2b3b h LEU 181 CO 0.10 0.57 -0.43 0.61 0.09 0.00 0.00 178.44 179.38 2b3b n GLY 182 N 1.35 -2.65 0.31 0.83 0.00 0.22 -4.07 105.19 101.17 2b3b n GLY 182 Ca -0.06 -1.32 -0.01 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.53 0.79 -0.09 1.61 0.13 -1.96 -1.56 132.00 130.41 2b3b h PRO 183 Ca -0.06 -0.13 -0.01 0.00 -0.87 0.00 0.00 66.00 64.93 2b3b h PRO 183 Cb 0.51 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 31.51 2b3b h PRO 183 CO 0.02 0.68 0.03 -0.44 -0.23 0.00 0.00 178.00 178.06 2b3b h ASP 184 N 0.77 0.12 0.47 1.44 3.32 -1.96 -1.50 116.42 119.07 2b3b h ASP 184 Ca 0.18 -0.20 -0.16 0.00 0.02 0.00 0.00 57.03 56.87 2b3b h ASP 184 Cb 0.21 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2b3b h ASP 184 CO -0.01 0.29 -0.67 0.44 -1.72 0.00 0.00 179.24 177.57 2b3b h ASP 185 N -0.05 0.22 -0.14 6.45 3.32 -1.68 -0.84 116.42 123.70 2b3b h ASP 185 Ca 0.03 -0.14 0.05 0.00 0.02 0.00 0.00 57.03 56.99 2b3b h ASP 185 Cb 0.21 -0.06 -0.07 0.00 0.22 0.00 0.00 39.33 39.63 2b3b h ASP 185 CO -0.00 0.83 -0.35 -0.25 -1.72 0.00 0.00 179.24 177.75 2b3b h TRP 186 N 0.13 -0.98 -0.84 4.55 2.91 -1.27 -1.68 115.95 118.78 2b3b h TRP 186 Ca -0.01 0.04 0.13 0.00 1.13 0.00 0.00 58.89 60.18 2b3b h TRP 186 Cb 1.21 0.45 -0.06 0.00 -0.51 0.00 0.00 29.16 30.24 2b3b h TRP 186 CO 0.02 -0.42 0.55 -0.91 -1.03 0.00 0.00 178.44 176.64 2b3b h ASN 187 N -0.42 0.62 0.80 2.65 2.35 -1.00 -2.32 115.58 118.26 2b3b h ASN 187 Ca 0.09 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.84 2b3b h ASN 187 Cb 0.57 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.84 2b3b h ASN 187 CO -0.37 0.33 -0.16 0.78 -1.65 0.00 0.00 177.43 176.36 2b3b h ASN 188 N 0.66 0.00 -0.45 5.81 2.35 -0.48 -2.13 115.58 121.34 2b3b h ASN 188 Ca 0.41 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 56.22 2b3b h ASN 188 Cb 0.65 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.96 2b3b h ASN 188 CO -0.17 0.16 0.15 -0.07 -1.65 0.00 0.00 177.43 175.85 2b3b h LEU 189 N 0.00 0.15 0.00 1.61 3.38 -0.73 0.52 115.31 120.24 2b3b h LEU 189 Ca -0.00 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2b3b h LEU 189 Cb 0.60 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 2b3b h LEU 189 CO 0.02 0.12 -0.31 -0.50 0.09 0.00 0.00 178.44 177.86 2b3b h TRP 190 N 0.32 0.00 -0.13 1.13 4.06 -1.48 -2.74 115.95 117.11 2b3b h TRP 190 Ca 0.21 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.16 2b3b h TRP 190 Cb 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.38 2b3b h TRP 190 CO -0.16 0.00 0.00 0.27 -3.56 0.00 0.00 178.44 174.99 2b3b n ASN 191 N -2.97 2.21 0.00 -3.49 0.23 -1.02 -3.14 115.26 107.08 2b3b n ASN 191 Ca 0.03 -1.76 0.00 0.00 -0.53 0.00 0.00 54.58 52.32 2b3b n ASN 191 Cb 0.54 -0.07 0.00 0.00 -2.08 0.00 0.00 39.78 38.16 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 1.26 1.26 0.10 4.83 0.00 -1.04 -4.38 105.19 107.23 2b3b n GLY 192 Ca 0.17 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.15 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 3.14 0.02 -5.19 1.61 1.57 -1.54 -3.42 116.57 112.76 2b3b h LYS 193 Ca 0.00 -0.02 -0.65 0.00 -1.87 0.00 0.00 60.65 58.12 2b3b h LYS 193 Cb 0.00 0.01 -0.24 0.00 0.08 0.00 0.00 32.23 32.08 2b3b h LYS 193 CO 0.00 0.80 -0.69 -1.17 -0.57 0.00 0.00 179.45 177.83 2b3b s LEU 194 N -7.23 3.13 0.37 2.94 2.96 0.08 -4.99 118.68 115.94 2b3b s LEU 194 Ca -0.01 -0.22 -0.22 0.00 -0.22 0.00 0.00 54.13 53.47 2b3b s LEU 194 Cb 0.11 -1.77 -0.10 0.00 0.50 0.00 0.00 46.19 44.93 2b3b s LEU 194 CO 0.79 0.10 0.91 -0.54 -1.32 0.00 0.00 176.35 176.30 2b3b s LYS 195 N 0.76 4.32 0.57 1.98 1.02 -1.26 -4.15 119.74 122.98 2b3b s LYS 195 Ca -0.01 1.12 0.35 0.00 0.02 0.00 0.00 55.97 57.44 2b3b s LYS 195 Cb -0.14 -2.44 1.63 0.00 -0.52 0.00 0.00 37.83 36.35 2b3b s LYS 195 CO 0.02 0.11 2.09 0.74 -0.92 0.00 0.00 175.35 177.39 2b3b h PHE 196 N 2.43 0.00 -0.01 3.18 0.04 -1.93 -2.06 116.94 118.60 2b3b h PHE 196 Ca -0.48 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.29 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 0.04 -0.02 0.25 -0.60 0.00 0.00 178.31 178.60 2b3b n THR 197 N -3.22 0.00 -1.96 -1.55 -2.24 -1.26 -3.74 114.28 100.30 2b3b n THR 197 Ca -0.01 -0.09 -0.41 0.00 -2.27 0.00 0.00 64.05 61.27 2b3b n THR 197 Cb 0.24 -0.12 -0.02 0.00 -2.10 0.00 0.00 70.33 68.33 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 -2.10 6.60 0.47 3.42 2.15 -0.77 -4.78 116.67 121.66 2b3b s ASP 198 Ca 0.41 2.70 0.30 0.00 0.43 0.00 0.00 52.55 56.39 2b3b s ASP 198 Cb 0.21 -2.62 1.38 0.00 -0.30 0.00 0.00 42.92 41.60 2b3b s ASP 198 CO 0.38 -0.75 1.74 -0.65 -0.17 0.00 0.00 175.17 175.71 2b3b h PRO 199 N 5.26 0.15 -0.38 4.34 0.11 -1.90 0.29 132.00 139.88 2b3b h PRO 199 Ca -0.46 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 2b3b h PRO 199 Cb 1.22 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 2b3b h PRO 199 CO 0.80 0.10 0.23 0.87 -0.21 0.00 0.00 178.00 179.79 2b3b h LYS 200 N 0.16 0.52 0.00 1.05 1.57 -1.94 -1.28 116.57 116.65 2b3b h LYS 200 Ca 0.66 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 59.26 2b3b h LYS 200 Cb 2.18 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 34.37 2b3b h LYS 200 CO -0.19 0.38 -0.64 0.00 -0.57 0.00 0.00 179.45 178.43 2b3b h ALA 201 N 1.10 0.67 -0.51 3.86 0.00 -0.78 -3.01 119.26 120.60 2b3b h ALA 201 Ca 0.14 -0.59 -0.10 0.00 0.00 0.00 0.00 54.91 54.36 2b3b h ALA 201 Cb 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2b3b h ALA 201 CO -0.03 0.81 -0.08 0.28 0.00 0.00 0.00 179.25 180.23 2b3b h VAL 202 N 0.00 1.26 -0.58 0.00 2.07 -0.94 -2.84 116.25 115.22 2b3b h VAL 202 Ca -0.01 -1.20 0.05 0.00 0.82 0.00 0.00 66.70 66.37 2b3b h VAL 202 Cb 1.37 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 2b3b h VAL 202 CO 0.08 0.42 0.39 -0.09 0.02 0.00 0.00 177.57 178.39 2b3b h ARG 203 N 0.84 0.58 -0.80 1.57 2.43 -1.10 -1.95 114.38 115.96 2b3b h ARG 203 Ca 0.14 -0.03 0.10 0.00 -0.81 0.00 0.00 59.98 59.38 2b3b h ARG 203 Cb 0.61 -0.13 -0.08 0.00 -0.42 0.00 0.00 29.97 29.95 2b3b h ARG 203 CO 0.04 0.38 0.44 0.00 -1.51 0.00 0.00 179.97 179.32 2b3b h ALA 204 N 1.68 1.14 -0.53 2.80 0.00 -1.44 -0.74 119.26 122.17 2b3b h ALA 204 Ca 0.25 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 2b3b h ALA 204 Cb 0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2b3b h ALA 204 CO -0.07 0.03 -0.01 -1.49 0.00 0.00 0.00 179.25 177.71 2b3b h TRP 205 N 0.72 0.98 -0.24 0.00 4.06 -1.45 -0.83 115.95 119.20 2b3b h TRP 205 Ca 0.39 -0.16 -0.01 0.00 2.06 0.00 0.00 58.89 61.18 2b3b h TRP 205 Cb 0.41 -0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 28.29 2b3b h TRP 205 CO -0.08 0.89 0.10 1.49 -3.56 0.00 0.00 178.44 177.29 2b3b h GLU 206 N 0.84 0.35 -0.22 0.49 4.22 -0.93 -0.39 114.58 118.93 2b3b h GLU 206 Ca 0.15 -0.06 -0.02 0.00 0.08 0.00 0.00 59.36 59.52 2b3b h GLU 206 Cb 0.51 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2b3b h GLU 206 CO 0.03 0.37 0.06 0.28 -2.18 0.00 0.00 179.01 177.57 2b3b h VAL 207 N 0.24 1.20 -0.76 0.32 2.07 -1.10 -2.91 116.25 115.31 2b3b h VAL 207 Ca 0.08 -0.63 0.16 0.00 0.82 0.00 0.00 66.70 67.13 2b3b h VAL 207 Cb 0.15 1.20 -0.10 0.00 -1.52 0.00 0.00 31.29 31.01 2b3b h VAL 207 CO -0.01 0.20 0.25 0.15 0.02 0.00 0.00 177.57 178.18 2b3b h PHE 208 N 0.18 0.41 -0.67 1.57 3.57 -1.02 -1.19 116.94 119.79 2b3b h PHE 208 Ca 0.07 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.57 2b3b h PHE 208 Cb 0.25 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.89 2b3b h PHE 208 CO 0.01 -0.02 0.27 0.78 -2.23 0.00 0.00 178.31 177.12 2b3b h GLY 209 N 0.35 1.06 0.93 2.40 0.00 -0.87 0.20 103.07 107.14 2b3b h GLY 209 Ca 0.43 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 2b3b h GLY 209 CO -0.47 0.52 0.12 3.21 0.00 0.00 0.00 176.54 179.92 2b3b h ARG 210 N 0.97 0.60 -0.65 4.80 3.08 -1.14 -1.86 114.38 120.18 2b3b h ARG 210 Ca 0.23 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2b3b h ARG 210 Cb 0.19 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 2b3b h ARG 210 CO -0.02 0.61 0.42 0.28 -1.07 0.00 0.00 179.97 180.19 2b3b h VAL 211 N 0.47 1.18 -0.06 2.04 2.07 -0.78 -2.83 116.25 118.34 2b3b h VAL 211 Ca 0.12 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.26 2b3b h VAL 211 Cb 0.26 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 2b3b h VAL 211 CO -0.00 0.17 -0.13 0.25 0.02 0.00 0.00 177.57 177.88 2b3b h LEU 212 N 0.88 0.08 0.00 2.57 5.85 -0.36 0.28 115.31 124.62 2b3b h LEU 212 Ca 0.24 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.94 2b3b h LEU 212 Cb -0.08 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 40.93 2b3b h LEU 212 CO -0.05 0.23 0.00 0.47 -0.34 0.00 0.00 178.44 178.75 2b3b n ASP 213 N -4.33 0.00 -0.95 1.25 8.00 -0.72 -1.86 116.55 117.93 2b3b n ASP 213 Ca -0.02 -0.72 0.12 0.00 0.71 0.00 0.00 54.79 54.88 2b3b n ASP 213 Cb 0.23 0.00 0.19 0.00 -0.02 0.00 0.00 41.12 41.52 2b3b n ASP 213 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b3b s ALA 215 N -1.84 3.86 0.31 0.00 0.00 -0.78 -1.13 121.76 122.19 2b3b s ALA 215 Ca 0.32 -1.12 -0.29 0.00 0.00 0.00 0.00 51.96 50.88 2b3b s ALA 215 Cb 0.21 -1.94 -0.10 0.00 0.00 0.00 0.00 23.12 21.29 2b3b s ALA 215 CO 0.31 -0.01 1.42 0.54 0.00 0.00 0.00 175.76 178.01 2b3b s ASN 216 N -4.08 6.60 0.22 0.00 4.22 -1.07 -4.86 114.94 115.99 2b3b s ASN 216 Ca 0.41 2.78 0.25 0.00 -2.14 0.00 0.00 52.86 54.15 2b3b s ASN 216 Cb -0.09 -2.64 0.90 0.00 1.28 0.00 0.00 41.25 40.69 2b3b s ASN 216 CO 0.34 -0.70 1.75 0.29 -2.04 0.00 0.00 177.10 176.73 2b3b n LYS 217 N 1.42 0.22 -0.60 3.55 4.76 -1.26 -2.56 118.16 123.70 2b3b n LYS 217 Ca 0.03 0.30 0.07 0.00 -2.87 0.00 0.00 58.31 55.85 2b3b n LYS 217 Cb 0.40 -1.82 0.31 0.00 -1.84 0.00 0.00 35.03 32.08 2b3b n LYS 217 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2b3b n ASP 218 N -2.21 4.34 -0.31 4.39 5.75 -1.26 -4.67 116.55 122.58 2b3b n ASP 218 Ca 0.04 -2.52 0.08 0.00 -0.01 0.00 0.00 54.79 52.38 2b3b n ASP 218 Cb 0.33 -0.57 0.24 0.00 -1.03 0.00 0.00 41.12 40.08 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 3.78 1.35 -0.79 2.12 0.00 -1.70 -3.06 119.26 120.97 2b3b h ALA 219 Ca 0.00 0.07 0.19 0.00 0.00 0.00 0.00 54.91 55.17 2b3b h ALA 219 Cb 1.42 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 19.11 2b3b h ALA 219 CO 0.28 -0.03 0.54 0.00 0.00 0.00 0.00 179.25 180.03 2b3b h ALA 220 N 1.56 2.33 -0.03 0.00 0.00 -1.83 -0.60 119.26 120.69 2b3b h ALA 220 Ca 0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2b3b h ALA 220 Cb 0.65 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2b3b h ALA 220 CO -0.35 -0.56 0.00 0.41 0.00 0.00 0.00 179.25 178.75 2b3b n GLY 221 N -1.57 0.56 3.87 0.00 0.00 -1.16 -4.25 105.19 102.65 2b3b n GLY 221 Ca 0.16 -0.58 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 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 -1.98 4.33 0.89 0.99 1.43 -0.27 -4.93 118.68 119.14 2b3b s LEU 222 Ca 0.33 0.42 -0.12 0.00 -1.03 0.00 0.00 54.13 53.73 2b3b s LEU 222 Cb 0.20 -2.19 0.13 0.00 0.03 0.00 0.00 46.19 44.36 2b3b s LEU 222 CO 0.32 0.37 1.10 -0.94 0.23 0.00 0.00 176.35 177.42 2b3b s SER 223 N -1.25 3.56 0.34 2.29 1.04 -1.26 -0.21 113.70 118.20 2b3b s SER 223 Ca 0.18 1.39 0.02 0.00 0.48 0.00 0.00 55.95 58.01 2b3b s SER 223 Cb -0.12 -2.07 0.60 0.00 0.10 0.00 0.00 66.02 64.53 2b3b s SER 223 CO 0.08 -2.57 1.99 4.11 0.98 0.00 0.00 173.24 177.82 2b3b h TRP 224 N -1.50 0.87 -0.58 5.02 5.08 -1.97 -2.02 115.95 120.84 2b3b h TRP 224 Ca -0.50 0.02 -0.10 0.00 1.08 0.00 0.00 58.89 59.39 2b3b h TRP 224 Cb 1.29 -0.29 -0.02 0.00 -3.00 0.00 0.00 29.16 27.14 2b3b h TRP 224 CO 0.41 0.52 -0.04 1.96 -1.28 0.00 0.00 178.44 180.01 2b3b h GLN 225 N 0.92 1.05 -0.23 0.12 7.50 -1.99 -1.41 115.11 121.07 2b3b h GLN 225 Ca 0.27 -0.36 -0.06 0.00 0.50 0.00 0.00 58.65 59.00 2b3b h GLN 225 Cb -0.02 -0.08 -0.01 0.00 0.05 0.00 0.00 27.48 27.41 2b3b h GLN 225 CO -0.07 1.06 -0.13 1.96 -1.50 0.00 0.00 178.83 180.15 2b3b h GLN 226 N 0.94 0.37 -0.40 1.46 4.20 -1.82 -0.65 115.11 119.22 2b3b h GLN 226 Ca 0.16 -0.10 -0.10 0.00 0.06 0.00 0.00 58.65 58.67 2b3b h GLN 226 Cb 0.61 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 2b3b h GLN 226 CO 0.04 0.51 -0.15 0.00 -0.67 0.00 0.00 178.83 178.55 2b3b h ALA 227 N 1.52 0.56 -0.69 3.87 0.00 -1.07 -2.84 119.26 120.61 2b3b h ALA 227 Ca 0.07 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 2b3b h ALA 227 Cb 0.45 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2b3b h ALA 227 CO 0.03 0.48 0.42 0.28 0.00 0.00 0.00 179.25 180.46 2b3b h VAL 228 N 0.62 1.19 -0.24 0.00 2.07 -0.75 -2.68 116.25 116.46 2b3b h VAL 228 Ca 0.09 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 2b3b h VAL 228 Cb 0.70 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2b3b h VAL 228 CO 0.05 0.20 0.10 0.44 0.02 0.00 0.00 177.57 178.38 2b3b h ASP 229 N 0.95 0.29 -0.85 0.57 3.32 -0.91 -1.70 116.42 118.09 2b3b h ASP 229 Ca 0.25 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.28 2b3b h ASP 229 Cb -0.05 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 2b3b h ASP 229 CO -0.05 0.26 0.53 0.03 -1.72 0.00 0.00 179.24 178.30 2b3b h ARG 230 N 0.33 1.13 -0.09 3.56 3.08 -1.26 0.15 114.38 121.28 2b3b h ARG 230 Ca 0.08 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 2b3b h ARG 230 Cb 0.06 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 29.87 2b3b h ARG 230 CO -0.01 0.78 -0.08 0.28 -1.07 0.00 0.00 179.97 179.87 2b3b h VAL 231 N 1.15 1.36 -0.95 2.04 2.07 -1.41 0.26 116.25 120.77 2b3b h VAL 231 Ca 0.31 -1.21 0.11 0.00 0.82 0.00 0.00 66.70 66.72 2b3b h VAL 231 Cb -0.08 1.96 -0.08 0.00 -1.52 0.00 0.00 31.29 31.57 2b3b h VAL 231 CO -0.06 0.34 0.58 0.58 0.02 0.00 0.00 177.57 179.03 2b3b h VAL 232 N -0.19 0.94 -0.31 2.57 2.07 -1.15 -2.40 116.25 117.77 2b3b h VAL 232 Ca 0.02 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2b3b h VAL 232 Cb 0.58 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 2b3b h VAL 232 CO 0.02 0.17 0.00 0.00 0.02 0.00 0.00 177.57 177.78 2b3b n GLN 233 N -4.64 1.90 -1.13 1.57 6.02 0.50 -4.93 117.38 116.66 2b3b n GLN 233 Ca 0.17 -1.37 -0.04 0.00 -0.01 0.00 0.00 57.00 55.74 2b3b n GLN 233 Cb 0.31 -1.36 -0.02 0.00 1.02 0.00 0.00 30.24 30.19 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 1.16 0.71 0.56 1.08 0.00 -0.90 -4.88 105.19 102.92 2b3b n GLY 234 Ca 0.15 -0.48 0.13 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.41 1.76 -3.43 1.61 5.02 0.85 -4.90 118.16 116.65 2b3b n LYS 235 Ca -0.04 -1.11 -0.13 0.00 -2.02 0.00 0.00 58.31 55.01 2b3b n LYS 235 Cb 0.20 -1.46 -0.02 0.00 -0.02 0.00 0.00 35.03 33.73 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 -1.93 -1.62 -0.23 7.82 0.00 -1.02 -4.64 121.76 120.13 2b3b s ALA 236 Ca 0.36 0.60 0.06 0.00 0.00 0.00 0.00 51.96 52.97 2b3b s ALA 236 Cb 0.20 0.77 -0.20 0.00 0.00 0.00 0.00 23.12 23.89 2b3b s ALA 236 CO 0.31 -0.72 -0.07 0.00 0.00 0.00 0.00 175.76 175.28 2b3b n ALA 237 N -0.22 1.41 -2.54 0.00 0.00 0.14 -4.34 120.51 114.97 2b3b n ALA 237 Ca -0.17 -1.12 -0.11 0.00 0.00 0.00 0.00 53.44 52.04 2b3b n ALA 237 Cb 0.64 -0.19 -0.11 0.00 0.00 0.00 0.00 19.45 19.79 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 -2.52 0.72 -0.07 0.00 0.08 -0.39 -4.37 117.98 111.44 2b3b s PHE 238 Ca -0.26 -0.71 -0.05 0.00 0.12 0.00 0.00 56.93 56.03 2b3b s PHE 238 Cb 0.08 -0.43 0.03 0.00 -0.57 0.00 0.00 43.02 42.12 2b3b s PHE 238 CO 0.68 -0.14 0.17 1.21 -0.10 0.00 0.00 175.22 177.04 2b3b s ASN 239 N -2.26 -0.17 -0.31 1.36 2.47 -0.82 -0.49 114.94 114.72 2b3b s ASN 239 Ca -0.00 0.35 -0.09 0.00 0.42 0.00 0.00 52.86 53.53 2b3b s ASN 239 Cb -0.03 0.31 -0.00 0.00 -1.45 0.00 0.00 41.25 40.08 2b3b s ASN 239 CO -0.02 -0.09 0.15 -0.63 -3.72 0.00 0.00 177.10 172.78 2b3b s ILE 240 N 0.48 4.53 -0.02 -5.21 -1.09 -1.26 -0.57 121.20 118.07 2b3b s ILE 240 Ca -0.03 -0.48 -0.29 0.00 -2.23 0.00 0.00 60.65 57.62 2b3b s ILE 240 Cb -0.05 -3.33 0.08 0.00 -1.58 0.00 0.00 42.46 37.58 2b3b s ILE 240 CO -0.02 0.05 0.72 -0.32 -1.23 0.00 0.00 174.94 174.14 2b3b s MET 241 N 1.60 1.02 0.97 2.79 1.75 -0.68 -4.63 119.30 122.12 2b3b s MET 241 Ca 0.04 0.05 -0.11 0.00 -1.25 0.00 0.00 55.69 54.42 2b3b s MET 241 Cb -0.17 0.48 0.17 0.00 2.84 0.00 0.00 34.83 38.15 2b3b s MET 241 CO 0.06 -0.36 1.11 0.20 -0.65 0.00 0.00 175.02 175.38 2b3b s GLY 242 N -1.59 1.64 0.00 2.11 0.00 -1.22 -3.88 107.32 104.38 2b3b s GLY 242 Ca -0.06 0.32 0.17 0.00 0.00 0.00 0.00 44.72 45.14 2b3b s GLY 242 CO 0.03 0.81 1.55 2.09 0.00 0.00 0.00 173.10 177.58 2b3b n ASP 243 N -4.32 0.00 0.20 1.64 5.68 -1.01 -1.22 116.55 117.52 2b3b n ASP 243 Ca 0.09 -1.25 0.18 0.00 -0.50 0.00 0.00 54.79 53.31 2b3b n ASP 243 Cb 0.53 0.00 0.78 0.00 -1.14 0.00 0.00 41.12 41.29 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 -0.41 2.11 0.09 -1.81 -1.03 115.95 114.91 2b3b h TRP 244 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 58.89 58.93 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 0.06 0.00 0.09 0.00 0.00 178.44 178.59 2b3b h ALA 245 N 1.44 1.35 -0.17 0.11 0.00 -1.45 -0.99 119.26 119.55 2b3b h ALA 245 Ca 0.11 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2b3b h ALA 245 Cb 0.89 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2b3b h ALA 245 CO -0.00 0.46 -0.03 0.00 0.00 0.00 0.00 179.25 179.68 2b3b h ALA 246 N 1.47 0.23 -0.91 0.00 0.00 -1.43 -1.58 119.26 117.04 2b3b h ALA 246 Ca 0.13 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.86 2b3b h ALA 246 Cb 0.29 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 2b3b h ALA 246 CO 0.00 -0.02 0.60 0.78 0.00 0.00 0.00 179.25 180.61 2b3b h GLY 247 N 0.04 1.32 0.95 0.00 0.00 -1.38 -1.25 103.07 102.74 2b3b h GLY 247 Ca 0.04 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 46.91 2b3b h GLY 247 CO 0.01 0.35 0.17 -1.82 0.00 0.00 0.00 176.54 175.26 2b3b h TYR 248 N 1.10 0.63 -0.02 5.60 3.20 -1.07 -0.74 116.97 125.66 2b3b h TYR 248 Ca 0.37 -0.04 -0.11 0.00 3.14 0.00 0.00 58.73 62.09 2b3b h TYR 248 Cb 0.09 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 2b3b h TYR 248 CO -0.00 0.54 -0.52 0.52 -1.64 0.00 0.00 178.16 177.06 2b3b h MET 249 N 0.53 0.05 0.00 1.82 2.86 -0.55 -0.44 114.93 119.20 2b3b h MET 249 Ca 0.14 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.72 2b3b h MET 249 Cb 0.18 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.83 2b3b h MET 249 CO -0.01 0.56 -0.74 0.25 1.06 0.00 0.00 176.91 178.03 2b3b n THR 250 N -3.92 1.45 -0.21 2.22 -2.24 -0.54 -0.25 114.28 110.78 2b3b n THR 250 Ca -0.02 0.16 -0.09 0.00 -2.27 0.00 0.00 64.05 61.84 2b3b n THR 250 Cb 0.54 -2.34 0.02 0.00 -2.10 0.00 0.00 70.33 66.45 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 1.26 0.00 4.28 2.02 -1.25 -0.31 112.91 117.91 2b3b h THR 251 Ca -0.05 -1.11 -0.30 0.00 0.77 0.00 0.00 66.41 65.72 2b3b h THR 251 Cb 0.71 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 67.89 2b3b h THR 251 CO -0.03 0.40 -1.75 0.41 0.37 0.00 0.00 175.52 174.92 2b3b n THR 252 N -4.23 1.52 1.30 3.16 -1.04 -0.76 -4.57 114.28 109.66 2b3b n THR 252 Ca 0.03 -0.15 0.13 0.00 -2.04 0.00 0.00 64.05 62.02 2b3b n THR 252 Cb 0.33 -2.03 0.46 0.00 -1.82 0.00 0.00 70.33 67.27 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 -4.37 0.84 -2.60 -4.42 4.77 -0.25 -4.94 117.00 106.03 2b3b n LEU 253 Ca -0.38 -0.17 -0.21 0.00 -0.03 0.00 0.00 56.01 55.22 2b3b n LEU 253 Cb 0.72 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 2b3b n LEU 253 CO 0.11 0.16 -0.18 0.29 -1.33 0.00 0.00 177.39 176.44 2b3b n LYS 254 N -0.74 -2.67 -3.08 3.23 4.76 -0.13 -4.90 118.16 114.63 2b3b n LYS 254 Ca 0.13 0.93 -0.36 0.00 -2.87 0.00 0.00 58.31 56.14 2b3b n LYS 254 Cb 0.32 -5.65 -0.06 0.00 -1.84 0.00 0.00 35.03 27.80 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 -6.20 4.34 -0.24 -0.35 1.43 0.65 -4.96 118.68 113.36 2b3b s LEU 255 Ca 0.09 1.44 -0.25 0.00 -1.03 0.00 0.00 54.13 54.38 2b3b s LEU 255 Cb -0.04 -3.60 -0.00 0.00 0.03 0.00 0.00 46.19 42.57 2b3b s LEU 255 CO 0.12 0.03 0.85 -0.54 0.23 0.00 0.00 176.35 177.04 2b3b s LYS 256 N -1.97 4.20 0.19 1.70 -0.14 -1.26 -4.31 119.74 118.15 2b3b s LYS 256 Ca 0.43 0.99 -0.31 0.00 -1.36 0.00 0.00 55.97 55.73 2b3b s LYS 256 Cb -0.17 -3.64 -0.09 0.00 -1.68 0.00 0.00 37.83 32.25 2b3b s LYS 256 CO 0.21 -0.51 1.45 -2.14 -0.76 0.00 0.00 175.35 173.60 2b3b s PRO 257 N 2.82 4.28 0.00 -1.68 0.02 -1.26 -0.80 135.00 138.38 2b3b s PRO 257 Ca 0.36 2.24 0.00 0.00 0.02 0.00 0.00 61.00 63.62 2b3b s PRO 257 Cb -0.15 -3.16 0.00 0.00 0.02 0.00 0.00 34.50 31.21 2b3b s PRO 257 CO 0.08 -0.46 0.00 0.41 -0.33 0.00 0.00 177.00 176.70 2b3b n GLY 258 N 2.92 2.92 0.30 0.52 0.00 0.19 -4.79 105.19 107.25 2b3b n GLY 258 Ca 0.10 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.03 2b3b n GLY 258 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2b3b n THR 259 N -0.07 1.42 0.17 2.61 -1.04 -0.97 -4.69 114.28 111.71 2b3b n THR 259 Ca 0.00 0.15 0.10 0.00 -2.04 0.00 0.00 64.05 62.26 2b3b n THR 259 Cb 0.00 -2.15 0.10 0.00 -1.82 0.00 0.00 70.33 66.45 2b3b n THR 259 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2b3b h ASP 260 N -0.79 0.00 -5.08 8.00 3.32 -1.27 -3.42 116.42 117.18 2b3b h ASP 260 Ca -0.05 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 2b3b h ASP 260 Cb 0.85 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.30 2b3b h ASP 260 CO -0.03 0.10 0.06 0.72 -1.72 0.00 0.00 179.24 178.37 2b3b s PHE 261 N -3.20 -0.13 0.33 4.55 -0.12 -1.22 -4.76 117.98 113.43 2b3b s PHE 261 Ca 0.04 -0.21 0.01 0.00 -0.05 0.00 0.00 56.93 56.72 2b3b s PHE 261 Cb 0.07 0.43 -0.00 0.00 -0.63 0.00 0.00 43.02 42.89 2b3b s PHE 261 CO 0.72 -0.96 0.41 0.00 -0.05 0.00 0.00 175.22 175.33 2b3b n ALA 262 N -0.36 -0.01 -3.04 1.99 0.00 0.43 0.57 120.51 120.09 2b3b n ALA 262 Ca -0.09 -1.64 -0.12 0.00 0.00 0.00 0.00 53.44 51.59 2b3b n ALA 262 Cb 0.62 1.33 -0.06 0.00 0.00 0.00 0.00 19.45 21.34 2b3b n ALA 262 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 2b3b s TRP 263 N -3.09 -0.18 0.18 0.00 -2.14 -1.26 -2.37 118.94 110.08 2b3b s TRP 263 Ca 0.31 0.02 -0.10 0.00 2.66 0.00 0.00 56.10 58.98 2b3b s TRP 263 Cb -0.00 0.18 -0.00 0.00 -3.10 0.00 0.00 33.47 30.54 2b3b s TRP 263 CO 0.22 -0.58 0.33 0.00 -2.66 0.00 0.00 176.95 174.26 2b3b s ALA 264 N -2.92 -0.12 0.75 2.67 0.00 -0.79 -5.00 121.76 116.35 2b3b s ALA 264 Ca -0.02 -0.82 -0.15 0.00 0.00 0.00 0.00 51.96 50.96 2b3b s ALA 264 Cb 0.00 0.90 0.01 0.00 0.00 0.00 0.00 23.12 24.03 2b3b s ALA 264 CO -0.06 -0.69 0.82 -2.30 0.00 0.00 0.00 175.76 173.53 2b3b n PRO 265 N -0.25 0.33 -1.68 0.00 -0.02 -1.26 -0.71 135.00 131.41 2b3b n PRO 265 Ca -0.07 0.17 -0.41 0.00 -2.02 0.00 0.00 63.50 61.17 2b3b n PRO 265 Cb 0.63 -2.10 0.02 0.00 -0.02 0.00 0.00 33.50 32.03 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 -1.44 2.18 -4.56 2.55 7.64 -0.46 -4.34 113.62 115.20 2b3b n SER 266 Ca 0.12 1.06 -0.53 0.00 1.01 0.00 0.00 58.87 60.53 2b3b n SER 266 Cb 0.50 -1.47 -0.06 0.00 -1.01 0.00 0.00 64.21 62.17 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 -0.12 0.83 -0.89 1.43 -0.02 -1.26 -1.42 135.00 133.55 2b3b n PRO 267 Ca 0.08 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2b3b n PRO 267 Cb 0.40 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.04 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 2.13 0.75 0.00 -1.23 0.00 0.09 -4.49 105.19 102.45 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 -2.45 0.95 -1.63 2.61 -2.24 -0.51 -4.48 114.28 106.54 2b3b n THR 269 Ca 0.00 -0.96 -0.46 0.00 -2.27 0.00 0.00 64.05 60.36 2b3b n THR 269 Cb 0.00 0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 68.72 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 -0.49 1.62 -0.35 -0.78 3.00 -1.26 -1.34 117.38 117.79 2b3b n GLN 270 Ca 0.01 0.58 0.00 0.00 -0.01 0.00 0.00 57.00 57.57 2b3b n GLN 270 Cb 0.28 -2.12 0.00 0.00 0.00 0.00 0.00 30.24 28.41 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 1.79 1.53 3.17 1.08 0.00 -1.26 -5.02 105.19 106.47 2b3b n GLY 271 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.07 1.72 -0.33 1.61 1.01 -0.45 -1.25 120.40 119.65 2b3b s VAL 272 Ca 0.00 -0.84 -0.05 0.00 0.00 0.00 0.00 61.98 61.09 2b3b s VAL 272 Cb 0.00 -1.49 0.05 0.00 0.00 0.00 0.00 36.38 34.93 2b3b s VAL 272 CO 0.00 0.49 0.08 0.12 0.00 0.00 0.00 175.10 175.78 2b3b s PHE 273 N 0.27 3.27 -0.48 5.22 5.36 -0.11 -4.94 117.98 126.56 2b3b s PHE 273 Ca -0.12 -1.59 -0.23 0.00 -0.96 0.00 0.00 56.93 54.03 2b3b s PHE 273 Cb -0.15 -2.26 0.03 0.00 -0.34 0.00 0.00 43.02 40.30 2b3b s PHE 273 CO 0.06 -0.76 0.79 1.41 -1.46 0.00 0.00 175.22 175.25 2b3b s MET 274 N 1.35 3.34 0.34 10.12 -2.45 -1.26 -2.25 119.30 128.49 2b3b s MET 274 Ca -0.02 -0.25 0.05 0.00 -1.25 0.00 0.00 55.69 54.21 2b3b s MET 274 Cb -0.20 -3.98 -0.01 0.00 1.25 0.00 0.00 34.83 31.89 2b3b s MET 274 CO 0.01 -1.20 0.49 0.00 1.05 0.00 0.00 175.02 175.37 2b3b s MET 275 N 3.32 3.18 0.11 4.11 0.23 0.59 -0.89 119.30 129.95 2b3b s MET 275 Ca 0.28 -0.85 -0.11 0.00 -1.03 0.00 0.00 55.69 53.97 2b3b s MET 275 Cb -0.13 -2.78 0.01 0.00 -1.53 0.00 0.00 34.83 30.40 2b3b s MET 275 CO 0.20 0.07 0.28 -0.48 -2.03 0.00 0.00 175.02 173.07 2b3b s LEU 276 N -4.21 0.99 -0.04 0.18 2.34 -0.70 -1.08 118.68 116.17 2b3b s LEU 276 Ca 0.43 -0.56 -0.01 0.00 0.06 0.00 0.00 54.13 54.05 2b3b s LEU 276 Cb -0.10 1.35 0.03 0.00 -0.56 0.00 0.00 46.19 46.92 2b3b s LEU 276 CO 0.32 -0.80 0.07 -0.55 -1.06 0.00 0.00 176.35 174.34 2b3b s SER 277 N -2.85 0.28 0.10 1.48 0.15 -1.26 -1.45 113.70 110.16 2b3b s SER 277 Ca 0.06 0.13 -0.30 0.00 0.70 0.00 0.00 55.95 56.54 2b3b s SER 277 Cb 0.04 0.01 -0.06 0.00 -1.71 0.00 0.00 66.02 64.30 2b3b s SER 277 CO -0.10 -0.17 0.97 -1.81 1.20 0.00 0.00 173.24 173.33 2b3b s ASP 278 N 1.41 7.48 0.06 5.45 1.01 -1.26 -1.27 116.67 129.55 2b3b s ASP 278 Ca -0.05 1.80 -0.01 0.00 0.71 0.00 0.00 52.55 54.99 2b3b s ASP 278 Cb -0.12 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.18 2b3b s ASP 278 CO -0.04 -0.09 -0.03 -0.94 0.21 0.00 0.00 175.17 174.29 2b3b s SER 279 N 0.07 0.55 -0.08 0.27 1.04 0.55 -1.07 113.70 115.02 2b3b s SER 279 Ca 0.47 -1.02 0.05 0.00 0.48 0.00 0.00 55.95 55.93 2b3b s SER 279 Cb -0.23 0.20 -0.01 0.00 0.10 0.00 0.00 66.02 66.08 2b3b s SER 279 CO 0.30 -0.60 -0.23 -0.36 0.98 0.00 0.00 173.24 173.33 2b3b s PHE 280 N -3.90 2.53 0.01 5.02 0.08 -0.01 -0.49 117.98 121.22 2b3b s PHE 280 Ca 0.09 -0.80 0.00 0.00 0.12 0.00 0.00 56.93 56.34 2b3b s PHE 280 Cb 0.08 -1.66 0.00 0.00 -0.57 0.00 0.00 43.02 40.86 2b3b s PHE 280 CO -0.08 -0.27 0.00 0.41 -0.10 0.00 0.00 175.22 175.18 2b3b n GLY 281 N 3.17 3.74 2.96 4.36 0.00 -1.25 -0.03 105.19 118.15 2b3b n GLY 281 Ca -0.18 -2.20 -0.31 0.00 0.00 0.00 0.00 46.02 43.33 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 4.15 0.34 0.99 2.96 -1.26 -4.31 118.68 121.55 2b3b s LEU 282 Ca 0.00 -1.99 -0.28 0.00 -0.22 0.00 0.00 54.13 51.64 2b3b s LEU 282 Cb -0.00 -1.47 -0.10 0.00 0.50 0.00 0.00 46.19 45.12 2b3b s LEU 282 CO 0.00 -0.37 1.30 -2.16 -1.32 0.00 0.00 176.35 173.80 2b3b s PRO 283 N 1.06 4.32 0.32 0.98 0.04 -1.26 -1.04 135.00 139.43 2b3b s PRO 283 Ca 0.09 2.19 -0.29 0.00 0.04 0.00 0.00 61.00 63.04 2b3b s PRO 283 Cb -0.19 -3.04 -0.12 0.00 0.04 0.00 0.00 34.50 31.19 2b3b s PRO 283 CO -0.11 -0.20 1.36 1.63 0.04 0.00 0.00 177.00 179.72 2b3b n LYS 284 N 0.74 2.23 -0.91 4.56 5.02 -0.36 -2.44 118.16 126.98 2b3b n LYS 284 Ca 0.00 0.78 0.00 0.00 -2.02 0.00 0.00 58.31 57.08 2b3b n LYS 284 Cb 0.42 -2.42 0.00 0.00 -0.02 0.00 0.00 35.03 33.01 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 1.13 0.70 3.64 0.72 0.00 -1.26 -4.87 105.19 105.24 2b3b n GLY 285 Ca 0.06 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.62 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 0.74 0.42 0.14 4.61 0.00 -1.02 -4.77 120.51 120.63 2b3b n ALA 286 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.86 2b3b n ALA 286 Cb 0.00 -2.17 0.27 0.00 0.00 0.00 0.00 19.45 17.55 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 3.63 0.09 -2.24 0.00 1.57 -1.85 -3.32 116.57 114.45 2b3b h LYS 287 Ca -0.44 -0.04 -0.57 0.00 -1.87 0.00 0.00 60.65 57.72 2b3b h LYS 287 Cb 1.30 -0.00 -0.42 0.00 0.08 0.00 0.00 32.23 33.20 2b3b h LYS 287 CO 0.72 0.51 -0.73 0.09 -0.57 0.00 0.00 179.45 179.47 2b3b n ASN 288 N -4.02 3.85 -0.15 0.86 3.02 -1.26 -4.94 115.26 112.61 2b3b n ASN 288 Ca -0.02 -3.56 -0.03 0.00 -0.03 0.00 0.00 54.58 50.94 2b3b n ASN 288 Cb 0.47 -0.58 0.06 0.00 -0.61 0.00 0.00 39.78 39.12 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 3.07 0.30 -0.51 3.52 2.43 -1.94 -1.61 114.38 119.64 2b3b h ARG 289 Ca 0.13 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 2b3b h ARG 289 Cb 0.59 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 2b3b h ARG 289 CO 0.77 0.20 0.28 0.37 -1.51 0.00 0.00 179.97 180.07 2b3b h GLN 290 N 0.31 0.71 -0.45 0.20 4.15 -1.94 -1.37 115.11 116.71 2b3b h GLN 290 Ca 0.23 -0.08 -0.08 0.00 0.77 0.00 0.00 58.65 59.49 2b3b h GLN 290 Cb 0.26 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.79 2b3b h GLN 290 CO -0.26 0.55 -0.03 -0.91 -1.93 0.00 0.00 178.83 176.26 2b3b h ASN 291 N 0.67 0.74 -0.60 -0.69 2.35 -1.80 -2.37 115.58 113.88 2b3b h ASN 291 Ca 0.18 -0.18 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 2b3b h ASN 291 Cb 0.05 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.19 2b3b h ASN 291 CO -0.03 0.82 0.29 0.00 -1.65 0.00 0.00 177.43 176.86 2b3b h ALA 292 N 1.26 0.78 -0.69 -0.83 0.00 -1.01 -1.38 119.26 117.39 2b3b h ALA 292 Ca 0.14 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2b3b h ALA 292 Cb 0.47 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2b3b h ALA 292 CO 0.02 0.34 0.33 0.82 0.00 0.00 0.00 179.25 180.77 2b3b h ILE 293 N 0.83 1.23 -1.01 0.00 2.04 -0.99 -0.31 117.51 119.29 2b3b h ILE 293 Ca 0.21 -0.64 0.02 0.00 1.00 0.00 0.00 64.86 65.45 2b3b h ILE 293 Cb 0.12 0.38 -0.05 0.00 -0.74 0.00 0.00 36.82 36.53 2b3b h ILE 293 CO -0.03 0.27 0.66 0.78 0.00 0.00 0.00 178.15 179.84 2b3b h ASN 294 N 0.96 1.13 -0.22 1.72 2.35 -1.27 -0.91 115.58 119.34 2b3b h ASN 294 Ca 0.24 -0.02 0.04 0.00 -0.55 0.00 0.00 56.30 56.01 2b3b h ASN 294 Cb 0.12 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.17 2b3b h ASN 294 CO -0.03 0.79 -0.07 -0.25 -1.65 0.00 0.00 177.43 176.23 2b3b h TRP 295 N 1.32 -0.15 -0.99 1.19 2.91 -0.64 -2.10 115.95 117.49 2b3b h TRP 295 Ca 0.39 0.02 0.03 0.00 1.13 0.00 0.00 58.89 60.46 2b3b h TRP 295 Cb -0.07 0.10 -0.06 0.00 -0.51 0.00 0.00 29.16 28.62 2b3b h TRP 295 CO -0.00 -0.11 0.65 -0.07 -1.03 0.00 0.00 178.44 177.88 2b3b h LEU 296 N -0.02 1.09 -0.77 0.65 3.38 -0.38 0.11 115.31 119.36 2b3b h LEU 296 Ca 0.11 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2b3b h LEU 296 Cb 0.18 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2b3b h LEU 296 CO -0.23 0.75 0.48 0.03 0.09 0.00 0.00 178.44 179.56 2b3b h ARG 297 N 1.26 1.04 -0.25 1.13 3.08 -1.01 -1.48 114.38 118.15 2b3b h ARG 297 Ca 0.39 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 60.31 2b3b h ARG 297 Cb -0.02 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.79 2b3b h ARG 297 CO -0.12 0.72 -0.03 1.25 -1.07 0.00 0.00 179.97 180.72 2b3b h LEU 298 N 1.05 0.45 -1.09 3.04 5.85 -0.56 -3.01 115.31 121.04 2b3b h LEU 298 Ca 0.28 -0.34 0.09 0.00 0.84 0.00 0.00 57.88 58.75 2b3b h LEU 298 Cb -0.07 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 40.77 2b3b h LEU 298 CO -0.06 0.68 0.61 0.58 -0.34 0.00 0.00 178.44 179.92 2b3b h VAL 299 N 0.21 1.01 -0.13 1.05 2.07 -0.59 -1.59 116.25 118.27 2b3b h VAL 299 Ca 0.07 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2b3b h VAL 299 Cb 0.47 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 2b3b h VAL 299 CO 0.02 0.19 0.00 0.61 0.02 0.00 0.00 177.57 178.40 2b3b n GLY 300 N -1.38 -0.05 3.89 2.17 0.00 -0.58 -4.52 105.19 104.72 2b3b n GLY 300 Ca 0.16 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.50 6.51 0.18 1.61 1.04 -0.60 -4.99 113.70 115.95 2b3b s SER 301 Ca 0.29 0.72 -0.12 0.00 0.48 0.00 0.00 55.95 57.32 2b3b s SER 301 Cb 0.15 -2.14 0.09 0.00 0.10 0.00 0.00 66.02 64.22 2b3b s SER 301 CO 0.23 -0.07 1.79 0.50 0.98 0.00 0.00 173.24 176.68 2b3b h LYS 302 N 2.33 0.86 -0.19 4.02 3.64 -1.92 -1.38 116.57 123.92 2b3b h LYS 302 Ca -0.47 -0.10 0.03 0.00 -1.27 0.00 0.00 60.65 58.84 2b3b h LYS 302 Cb 1.18 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.80 2b3b h LYS 302 CO 0.69 0.65 0.02 1.49 -2.27 0.00 0.00 179.45 180.03 2b3b h GLU 303 N 0.84 0.09 0.01 1.90 4.81 -1.94 0.57 114.58 120.86 2b3b h GLU 303 Ca 0.22 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.44 2b3b h GLU 303 Cb 0.04 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.40 2b3b h GLU 303 CO -0.03 0.06 -0.01 0.78 -0.73 0.00 0.00 179.01 179.08 2b3b h GLY 304 N 0.09 -0.02 1.54 1.92 0.00 -1.64 -2.38 103.07 102.58 2b3b h GLY 304 Ca 0.09 0.01 -0.11 0.00 0.00 0.00 0.00 47.33 47.32 2b3b h GLY 304 CO -0.13 -0.01 -0.28 1.46 0.00 0.00 0.00 176.54 177.58 2b3b h GLN 305 N -0.07 0.53 -0.00 4.80 4.20 -1.04 -1.99 115.11 121.54 2b3b h GLN 305 Ca -0.00 -0.22 0.00 0.00 0.06 0.00 0.00 58.65 58.49 2b3b h GLN 305 Cb 0.07 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.82 2b3b h GLN 305 CO 0.00 0.76 -0.23 -0.25 -0.67 0.00 0.00 178.83 178.44 2b3b n ASP 306 N -4.10 0.24 0.05 1.46 8.00 0.17 -1.74 116.55 120.63 2b3b n ASP 306 Ca -0.01 0.13 -0.22 0.00 0.71 0.00 0.00 54.79 55.41 2b3b n ASP 306 Cb 0.43 -0.14 -0.15 0.00 -0.02 0.00 0.00 41.12 41.24 2b3b n ASP 306 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2b3b h THR 307 N 0.01 1.13 0.06 -3.53 2.02 -1.05 -3.41 112.91 108.13 2b3b h THR 307 Ca 0.00 -2.49 -0.32 0.00 0.77 0.00 0.00 66.41 64.37 2b3b h THR 307 Cb 0.50 2.86 -0.03 0.00 -1.74 0.00 0.00 68.15 69.74 2b3b h THR 307 CO 0.00 0.76 -1.76 -1.54 0.37 0.00 0.00 175.52 173.35 2b3b n SER 308 N -3.85 1.99 -0.04 4.18 3.41 -0.78 -4.51 113.62 114.02 2b3b n SER 308 Ca -0.22 0.29 -0.00 0.00 -0.26 0.00 0.00 58.87 58.68 2b3b n SER 308 Cb 0.96 -0.88 0.28 0.00 -0.26 0.00 0.00 64.21 64.31 2b3b n SER 308 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2b3b h ASN 309 N -0.47 0.57 -0.58 4.04 2.35 -1.58 -1.53 115.58 118.38 2b3b h ASN 309 Ca -0.43 -0.09 0.17 0.00 -0.55 0.00 0.00 56.30 55.40 2b3b h ASN 309 Cb 1.69 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 39.88 2b3b h ASN 309 CO -0.09 0.59 0.43 -0.65 -1.65 0.00 0.00 177.43 176.06 2b3b h PRO 310 N 0.60 0.00 0.00 0.81 0.11 -1.79 -0.79 132.00 130.94 2b3b h PRO 310 Ca 0.14 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.15 2b3b h PRO 310 Cb 0.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 2b3b h PRO 310 CO 0.00 0.00 -0.45 -0.07 -0.21 0.00 0.00 178.00 177.27 2b3b h LEU 311 N 0.00 0.00 0.05 2.35 3.38 -1.53 -3.38 115.31 116.18 2b3b h LEU 311 Ca 0.28 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.94 2b3b h LEU 311 Cb 1.13 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.84 2b3b h LEU 311 CO -0.00 0.45 -1.66 0.50 0.09 0.00 0.00 178.44 177.82 2b3b h LYS 312 N 0.00 0.11 0.00 1.13 1.63 -1.08 -3.43 116.57 114.94 2b3b h LYS 312 Ca -0.00 -0.19 0.00 0.00 -0.85 0.00 0.00 60.65 59.60 2b3b h LYS 312 Cb 1.32 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 33.02 2b3b h LYS 312 CO 0.06 0.83 0.00 0.41 -3.45 0.00 0.00 179.45 177.30 2b3b n GLY 313 N 1.65 2.35 3.91 5.01 0.00 -1.02 -3.43 105.19 113.67 2b3b n GLY 313 Ca -0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.41 4.56 0.33 1.61 1.04 -1.25 -4.58 113.70 114.00 2b3b s SER 314 Ca 0.00 0.62 0.07 0.00 0.48 0.00 0.00 55.95 57.12 2b3b s SER 314 Cb 0.00 -1.15 -0.03 0.00 0.10 0.00 0.00 66.02 64.94 2b3b s SER 314 CO 0.00 -1.83 0.28 0.27 0.98 0.00 0.00 173.24 172.94 2b3b s ILE 315 N -3.46 3.55 0.54 -1.02 -4.36 -0.45 -4.50 121.20 111.49 2b3b s ILE 315 Ca 0.62 -1.40 -0.21 0.00 -0.26 0.00 0.00 60.65 59.41 2b3b s ILE 315 Cb -0.11 -3.18 -0.05 0.00 1.25 0.00 0.00 42.46 40.37 2b3b s ILE 315 CO 0.47 -0.18 1.22 0.00 0.24 0.00 0.00 174.94 176.69 2b3b s ALA 316 N -2.30 2.75 0.03 2.27 0.00 -1.26 -0.13 121.76 123.11 2b3b s ALA 316 Ca 0.40 1.04 0.17 0.00 0.00 0.00 0.00 51.96 53.57 2b3b s ALA 316 Cb -0.06 -3.45 0.43 0.00 0.00 0.00 0.00 23.12 20.04 2b3b s ALA 316 CO 0.26 -1.01 1.61 0.00 0.00 0.00 0.00 175.76 176.62 2b3b h ALA 317 N 1.41 0.84 -2.72 0.00 0.00 -1.77 -3.39 119.26 113.64 2b3b h ALA 317 Ca -0.50 -0.39 -0.52 0.00 0.00 0.00 0.00 54.91 53.50 2b3b h ALA 317 Cb 1.28 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 19.03 2b3b h ALA 317 CO 0.57 0.54 0.59 1.03 0.00 0.00 0.00 179.25 181.98 2b3b s ARG 318 N -3.32 4.46 0.31 0.00 0.52 -1.26 -4.46 118.95 115.20 2b3b s ARG 318 Ca 0.02 1.98 -0.00 0.00 -0.52 0.00 0.00 55.73 57.20 2b3b s ARG 318 Cb 0.09 -3.19 0.49 0.00 0.52 0.00 0.00 34.95 32.86 2b3b s ARG 318 CO 0.71 -0.11 1.91 -0.07 0.02 0.00 0.00 175.30 177.76 2b3b h LEU 319 N 4.79 0.78 -1.18 2.53 3.38 -1.36 -2.94 115.31 121.32 2b3b h LEU 319 Ca -0.46 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.44 2b3b h LEU 319 Cb 1.22 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2b3b h LEU 319 CO 0.73 0.66 0.00 -0.90 0.09 0.00 0.00 178.44 179.02 2b3b n ASP 320 N -4.35 1.67 -4.62 -0.43 5.75 -1.26 -4.96 116.55 108.35 2b3b n ASP 320 Ca 0.06 -2.09 -0.39 0.00 -0.01 0.00 0.00 54.79 52.35 2b3b n ASP 320 Cb 0.13 -0.28 0.03 0.00 -1.03 0.00 0.00 41.12 39.97 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 0.20 1.06 -4.43 -1.12 2.88 -1.11 -4.94 113.62 106.16 2b3b n SER 321 Ca 0.08 0.92 -0.44 0.00 -1.33 0.00 0.00 58.87 58.10 2b3b n SER 321 Cb 0.31 -1.38 -0.06 0.00 -0.75 0.00 0.00 64.21 62.34 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 -0.98 6.21 0.59 -3.46 -1.08 -1.26 -4.95 116.67 111.75 2b3b s ASP 322 Ca 0.69 -1.03 0.29 0.00 -0.52 0.00 0.00 52.55 51.98 2b3b s ASP 322 Cb -0.48 -2.30 1.62 0.00 -1.46 0.00 0.00 42.92 40.31 2b3b s ASP 322 CO 0.52 -0.97 2.07 1.55 0.52 0.00 0.00 175.17 178.86 2b3b h PRO 323 N 9.06 0.00 0.00 4.34 0.13 -1.96 -1.57 132.00 142.00 2b3b h PRO 323 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2b3b h PRO 323 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2b3b h PRO 323 CO 1.01 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.44 2b3b h SER 324 N 0.00 0.00 0.72 1.44 4.64 -1.99 -1.47 113.55 116.89 2b3b h SER 324 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2b3b h SER 324 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2b3b h SER 324 CO -0.00 0.00 -0.01 0.29 -0.87 0.00 0.00 176.83 176.23 2b3b n LYS 325 N -2.30 0.28 -4.37 4.77 4.76 -0.59 -4.90 118.16 115.80 2b3b n LYS 325 Ca 0.01 -0.01 -0.31 0.00 -2.87 0.00 0.00 58.31 55.13 2b3b n LYS 325 Cb 0.16 -1.50 -0.10 0.00 -1.84 0.00 0.00 35.03 31.75 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 -2.73 2.85 0.30 2.13 2.02 -0.55 -4.75 117.35 116.61 2b3b s TYR 326 Ca 0.23 -0.08 -0.05 0.00 -0.37 0.00 0.00 57.07 56.80 2b3b s TYR 326 Cb 0.20 -1.55 0.07 0.00 -0.40 0.00 0.00 41.96 40.28 2b3b s TYR 326 CO 0.49 0.39 0.28 0.27 -1.57 0.00 0.00 175.55 175.42 2b3b n ASN 327 N 1.21 -1.06 0.02 2.29 0.23 -1.26 -4.61 115.26 112.08 2b3b n ASN 327 Ca -0.14 -0.74 0.07 0.00 -0.53 0.00 0.00 54.58 53.24 2b3b n ASN 327 Cb 0.52 -0.25 0.49 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 -2.14 1.85 0.17 -2.53 0.00 -1.97 -1.47 119.26 113.16 2b3b h ALA 328 Ca -0.10 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2b3b h ALA 328 Cb 0.31 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2b3b h ALA 328 CO 0.07 0.10 -0.08 -0.92 0.00 0.00 0.00 179.25 178.42 2b3b h TYR 329 N 0.41 -0.21 -0.70 0.00 3.20 -1.91 -2.71 116.97 115.06 2b3b h TYR 329 Ca 0.16 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.09 2b3b h TYR 329 Cb 0.12 0.07 -0.06 0.00 1.54 0.00 0.00 36.73 38.40 2b3b h TYR 329 CO -0.00 0.22 0.39 0.78 -1.64 0.00 0.00 178.16 177.91 2b3b h GLY 330 N -0.78 1.04 1.29 1.82 0.00 -1.81 0.04 103.07 104.67 2b3b h GLY 330 Ca -0.02 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 2b3b h GLY 330 CO 0.04 0.15 0.22 1.46 0.00 0.00 0.00 176.54 178.41 2b3b h GLN 331 N 0.71 0.91 -0.30 4.80 4.20 -1.37 0.73 115.11 124.78 2b3b h GLN 331 Ca 0.32 -0.16 -0.05 0.00 0.06 0.00 0.00 58.65 58.82 2b3b h GLN 331 Cb 0.22 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 2b3b h GLN 331 CO -0.20 0.76 -0.01 1.03 -0.67 0.00 0.00 178.83 179.74 2b3b h SER 332 N 0.89 0.53 -0.52 1.46 0.87 -0.85 -2.33 113.55 113.59 2b3b h SER 332 Ca 0.21 -0.32 -0.02 0.00 -1.23 0.00 0.00 61.79 60.43 2b3b h SER 332 Cb 0.21 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 2b3b h SER 332 CO -0.01 0.72 0.26 0.00 -0.53 0.00 0.00 176.83 177.27 2b3b h ALA 333 N 0.83 0.67 -0.89 6.23 0.00 -0.85 -1.73 119.26 123.52 2b3b h ALA 333 Ca 0.08 -0.11 0.14 0.00 0.00 0.00 0.00 54.91 55.02 2b3b h ALA 333 Cb 0.45 -0.21 -0.09 0.00 0.00 0.00 0.00 17.79 17.95 2b3b h ALA 333 CO 0.02 0.22 0.51 0.52 0.00 0.00 0.00 179.25 180.52 2b3b h MET 334 N 0.70 0.73 -0.22 0.00 2.07 -0.67 0.12 114.93 117.66 2b3b h MET 334 Ca 0.18 -0.04 -0.04 0.00 -2.07 0.00 0.00 59.70 57.73 2b3b h MET 334 Cb 0.10 -0.16 -0.01 0.00 -1.87 0.00 0.00 31.60 29.65 2b3b h MET 334 CO -0.02 0.48 -0.01 0.00 1.07 0.00 0.00 176.91 178.43 2b3b h ARG 335 N 0.75 0.40 -0.59 1.72 3.08 -1.09 -2.63 114.38 116.01 2b3b h ARG 335 Ca 0.47 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.39 2b3b h ARG 335 Cb 0.60 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.58 2b3b h ARG 335 CO -0.32 0.59 0.38 -0.44 -1.07 0.00 0.00 179.97 179.11 2b3b h ASP 336 N 0.16 0.68 -0.99 7.04 5.19 -0.83 -1.07 116.42 126.61 2b3b h ASP 336 Ca 0.06 -0.03 0.13 0.00 -0.62 0.00 0.00 57.03 56.58 2b3b h ASP 336 Cb 0.42 -0.17 -0.09 0.00 0.18 0.00 0.00 39.33 39.67 2b3b h ASP 336 CO 0.01 0.51 0.62 -0.25 -3.12 0.00 0.00 179.24 177.01 2b3b h TRP 337 N 0.80 1.08 0.00 4.55 -0.00 -0.69 0.24 115.95 121.93 2b3b h TRP 337 Ca 0.21 0.03 -0.03 0.00 -0.00 0.00 0.00 58.89 59.10 2b3b h TRP 337 Cb -0.07 -0.34 -0.00 0.00 -0.00 0.00 0.00 29.16 28.74 2b3b h TRP 337 CO -0.03 0.40 -0.48 0.00 -0.00 0.00 0.00 178.44 178.34 2b3b h ARG 338 N 0.92 0.00 0.00 2.65 3.08 -1.08 -3.38 114.38 116.57 2b3b h ARG 338 Ca 0.50 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.40 2b3b h ARG 338 Cb 0.58 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 2b3b h ARG 338 CO -0.27 0.11 -1.77 -1.13 -1.07 0.00 0.00 179.97 175.84 2b3b n SER 339 N -2.99 1.93 -4.88 7.04 3.41 -0.44 -5.06 113.62 112.63 2b3b n SER 339 Ca 0.01 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.32 2b3b n SER 339 Cb 0.60 1.08 0.03 0.00 -0.26 0.00 0.00 64.21 65.66 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 -4.19 5.80 0.10 4.04 -0.87 0.78 -5.03 114.94 115.57 2b3b s ASN 340 Ca -0.06 1.21 -0.31 0.00 -1.57 0.00 0.00 52.86 52.14 2b3b s ASN 340 Cb 0.05 -2.14 -0.07 0.00 -0.02 0.00 0.00 41.25 39.07 2b3b s ASN 340 CO 0.53 -1.11 1.33 -0.60 -2.57 0.00 0.00 177.10 174.68 2b3b s ARG 341 N -5.24 4.35 -0.17 -0.60 6.06 -0.38 -4.85 118.95 118.12 2b3b s ARG 341 Ca 0.56 1.99 -0.07 0.00 -2.50 0.00 0.00 55.73 55.71 2b3b s ARG 341 Cb -0.11 -3.27 -0.04 0.00 0.06 0.00 0.00 34.95 31.59 2b3b s ARG 341 CO 0.52 -0.38 0.08 0.42 -2.50 0.00 0.00 175.30 173.43 2b3b s ILE 342 N 1.06 4.93 0.26 4.11 -1.09 -1.26 -0.94 121.20 128.27 2b3b s ILE 342 Ca 0.63 0.01 0.04 0.00 -2.23 0.00 0.00 60.65 59.09 2b3b s ILE 342 Cb -0.35 -3.20 -0.06 0.00 -1.58 0.00 0.00 42.46 37.27 2b3b s ILE 342 CO 0.30 0.49 0.02 0.68 -1.23 0.00 0.00 174.94 175.20 2b3b s VAL 343 N 0.08 1.09 0.18 2.92 -7.23 -0.95 -4.98 120.40 111.51 2b3b s VAL 343 Ca 0.06 -2.03 0.03 0.00 -1.81 0.00 0.00 61.98 58.23 2b3b s VAL 343 Cb -0.12 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.27 2b3b s VAL 343 CO 0.00 -0.20 0.30 -0.83 -0.31 0.00 0.00 175.10 174.06 2b3b s GLY 344 N -3.37 1.57 0.22 2.32 0.00 -1.26 -0.30 107.32 106.50 2b3b s GLY 344 Ca 0.32 -1.10 -0.29 0.00 0.00 0.00 0.00 44.72 43.65 2b3b s GLY 344 CO 0.11 -1.10 0.90 -0.45 0.00 0.00 0.00 173.10 172.56 2b3b s SER 345 N -3.44 7.59 -0.08 1.64 0.15 -0.24 -4.73 113.70 114.59 2b3b s SER 345 Ca 0.34 1.87 -0.16 0.00 0.70 0.00 0.00 55.95 58.70 2b3b s SER 345 Cb -0.10 -2.58 -0.13 0.00 -1.71 0.00 0.00 66.02 61.50 2b3b s SER 345 CO 0.28 0.17 0.60 0.25 1.20 0.00 0.00 173.24 175.74 2b3b h LEU 346 N 4.23 -0.14 -1.83 3.45 5.85 -1.95 -1.24 115.31 123.68 2b3b h LEU 346 Ca -0.45 -0.33 -0.02 0.00 0.84 0.00 0.00 57.88 57.92 2b3b h LEU 346 Cb 1.20 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.27 2b3b h LEU 346 CO 0.68 0.46 -0.09 0.58 -0.34 0.00 0.00 178.44 179.73 2b3b h VAL 347 N -0.96 1.04 -0.41 1.05 2.07 -1.94 -2.59 116.25 114.52 2b3b h VAL 347 Ca -0.02 -0.32 -0.22 0.00 0.82 0.00 0.00 66.70 66.96 2b3b h VAL 347 Cb 0.46 1.17 -0.14 0.00 -1.52 0.00 0.00 31.29 31.27 2b3b h VAL 347 CO 0.03 0.09 -0.08 1.41 0.02 0.00 0.00 177.57 179.04 2b3b n HIS 348 N -4.40 1.28 -0.27 1.57 8.25 -1.26 -4.98 115.22 115.41 2b3b n HIS 348 Ca -0.03 -1.70 0.00 0.00 -0.26 0.00 0.00 57.72 55.74 2b3b n HIS 348 Cb 0.17 -0.53 0.00 0.00 1.12 0.00 0.00 29.99 30.75 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 -1.11 1.31 0.17 -1.41 0.00 -0.97 -4.67 105.19 98.50 2b3b n GLY 349 Ca 0.36 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.22 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 0.23 0.00 4.61 0.00 -1.32 -1.35 119.26 121.43 2b3b h ALA 350 Ca 0.00 -0.46 -0.06 0.00 0.00 0.00 0.00 54.91 54.39 2b3b h ALA 350 Cb 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2b3b h ALA 350 CO 0.00 0.34 -1.75 1.33 0.00 0.00 0.00 179.25 179.17 2b3b n VAL 351 N -4.29 0.22 -4.31 0.00 0.24 -1.02 -1.74 118.33 107.42 2b3b n VAL 351 Ca -0.07 -0.40 -0.23 0.00 -2.04 0.00 0.00 64.34 61.60 2b3b n VAL 351 Cb 0.54 -0.03 -0.13 0.00 -1.47 0.00 0.00 33.84 32.76 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 -2.88 1.71 0.72 2.33 0.00 -1.26 -4.85 121.76 117.52 2b3b s ALA 352 Ca -0.06 -1.19 -0.15 0.00 0.00 0.00 0.00 51.96 50.57 2b3b s ALA 352 Cb 0.08 -0.24 0.03 0.00 0.00 0.00 0.00 23.12 23.00 2b3b s ALA 352 CO 0.61 0.34 1.17 -1.25 0.00 0.00 0.00 175.76 176.63 2b3b s PRO 353 N -1.79 2.30 0.52 0.00 0.04 -1.26 -3.89 135.00 130.91 2b3b s PRO 353 Ca 0.05 1.62 0.26 0.00 0.04 0.00 0.00 61.00 62.97 2b3b s PRO 353 Cb -0.10 -1.87 1.41 0.00 0.04 0.00 0.00 34.50 33.98 2b3b s PRO 353 CO 0.04 -1.68 2.07 1.49 0.04 0.00 0.00 177.00 178.95 2b3b h GLU 354 N -0.28 0.00 -0.93 4.56 4.81 -1.88 0.03 114.58 120.88 2b3b h GLU 354 Ca -0.47 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 58.84 2b3b h GLU 354 Cb 1.28 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.59 2b3b h GLU 354 CO 0.51 0.12 0.58 0.66 -0.73 0.00 0.00 179.01 180.15 2b3b h SER 355 N 0.00 0.91 0.00 1.04 4.64 -1.96 -0.09 113.55 118.09 2b3b h SER 355 Ca -0.00 0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2b3b h SER 355 Cb 0.32 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 2b3b h SER 355 CO 0.02 0.55 -0.00 0.15 -0.87 0.00 0.00 176.83 176.68 2b3b h PHE 356 N 1.03 0.00 -0.80 4.77 3.57 -1.43 -3.34 116.94 120.74 2b3b h PHE 356 Ca 0.42 -0.00 0.18 0.00 3.53 0.00 0.00 57.97 62.10 2b3b h PHE 356 Cb 0.25 -0.00 -0.12 0.00 2.79 0.00 0.00 35.95 38.87 2b3b h PHE 356 CO -0.02 0.89 0.25 0.52 -2.23 0.00 0.00 178.31 177.72 2b3b h MET 357 N -0.89 0.30 0.00 1.11 2.86 -0.92 -1.42 114.93 115.97 2b3b h MET 357 Ca -0.00 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2b3b h MET 357 Cb 0.89 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.49 2b3b h MET 357 CO 0.00 0.20 0.00 -1.13 1.06 0.00 0.00 176.91 177.04 2b3b n SER 358 N -5.13 0.74 -0.00 1.22 3.41 -0.06 -2.89 113.62 110.91 2b3b n SER 358 Ca 0.17 0.63 0.08 0.00 -0.26 0.00 0.00 58.87 59.49 2b3b n SER 358 Cb 0.54 -0.80 -0.12 0.00 -0.26 0.00 0.00 64.21 63.56 2b3b n SER 358 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b3b n GLN 359 N -2.26 0.89 0.23 4.33 6.02 -0.60 -4.48 117.38 121.52 2b3b n GLN 359 Ca 0.04 -0.09 0.08 0.00 -0.01 0.00 0.00 57.00 57.01 2b3b n GLN 359 Cb 0.32 -1.37 0.58 0.00 1.02 0.00 0.00 30.24 30.79 2b3b n GLN 359 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 2b3b h PHE 360 N 0.00 0.00 -0.91 1.08 3.57 -1.25 -1.39 116.94 118.04 2b3b h PHE 360 Ca 0.00 0.00 0.15 0.00 3.53 0.00 0.00 57.97 61.65 2b3b h PHE 360 Cb 0.63 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.30 2b3b h PHE 360 CO 0.00 0.19 0.58 0.78 -2.23 0.00 0.00 178.31 177.63 2b3b h GLY 361 N 0.78 1.25 1.35 2.40 0.00 -1.79 0.14 103.07 107.20 2b3b h GLY 361 Ca -0.00 -0.31 -0.19 0.00 0.00 0.00 0.00 47.33 46.83 2b3b h GLY 361 CO 0.02 0.08 -0.65 -0.84 0.00 0.00 0.00 176.54 175.15 2b3b h THR 362 N 0.70 1.31 -0.33 4.70 2.02 -1.54 -1.38 112.91 118.39 2b3b h THR 362 Ca 0.46 -1.90 -0.02 0.00 0.77 0.00 0.00 66.41 65.72 2b3b h THR 362 Cb 0.74 1.87 -0.01 0.00 -1.74 0.00 0.00 68.15 69.00 2b3b h THR 362 CO -0.22 0.60 0.13 0.58 0.37 0.00 0.00 175.52 176.98 2b3b h VAL 363 N 0.48 1.18 -0.84 3.16 2.07 -1.28 -1.92 116.25 119.10 2b3b h VAL 363 Ca -0.02 -0.55 0.04 0.00 0.82 0.00 0.00 66.70 66.99 2b3b h VAL 363 Cb 1.24 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 31.90 2b3b h VAL 363 CO 0.13 0.19 0.55 -0.03 0.02 0.00 0.00 177.57 178.43 2b3b h MET 364 N 0.38 0.99 -0.24 1.57 4.05 -0.63 -1.74 114.93 119.32 2b3b h MET 364 Ca 0.11 -0.06 -0.17 0.00 -0.28 0.00 0.00 59.70 59.30 2b3b h MET 364 Cb 0.18 -0.22 -0.00 0.00 -0.80 0.00 0.00 31.60 30.75 2b3b h MET 364 CO -0.01 0.66 -0.53 1.49 0.23 0.00 0.00 176.91 178.75 2b3b h GLU 365 N 1.02 0.70 -0.56 0.39 4.57 -0.89 -0.04 114.58 119.77 2b3b h GLU 365 Ca 0.34 -0.43 0.06 0.00 -1.18 0.00 0.00 59.36 58.14 2b3b h GLU 365 Cb 0.06 0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.65 2b3b h GLU 365 CO -0.10 1.05 0.28 0.82 -1.18 0.00 0.00 179.01 179.87 2b3b h ILE 366 N 0.54 0.93 -0.65 2.32 2.04 -0.81 -1.29 117.51 120.59 2b3b h ILE 366 Ca 0.02 -0.18 -0.05 0.00 1.00 0.00 0.00 64.86 65.65 2b3b h ILE 366 Cb 1.10 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 2b3b h ILE 366 CO 0.11 0.10 0.22 0.15 0.00 0.00 0.00 178.15 178.72 2b3b h PHE 367 N 0.52 1.03 -0.99 1.37 3.57 -0.82 -1.96 116.94 119.66 2b3b h PHE 367 Ca 0.25 -0.10 0.01 0.00 3.53 0.00 0.00 57.97 61.67 2b3b h PHE 367 Cb 0.19 -0.30 -0.05 0.00 2.79 0.00 0.00 35.95 38.58 2b3b h PHE 367 CO -0.11 0.83 0.65 -0.07 -2.23 0.00 0.00 178.31 177.38 2b3b h LEU 368 N 0.93 1.13 -0.11 0.59 3.38 -0.54 1.03 115.31 121.72 2b3b h LEU 368 Ca 0.21 -0.03 -0.19 0.00 0.09 0.00 0.00 57.88 57.96 2b3b h LEU 368 Cb 0.27 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 40.75 2b3b h LEU 368 CO -0.01 0.82 -0.68 1.56 0.09 0.00 0.00 178.44 180.22 2b3b h GLN 369 N 1.34 0.65 0.00 1.13 1.08 -1.09 -3.38 115.11 114.84 2b3b h GLN 369 Ca 0.36 -0.56 -0.21 0.00 -1.45 0.00 0.00 58.65 56.79 2b3b h GLN 369 Cb -0.15 0.12 -0.04 0.00 -0.05 0.00 0.00 27.48 27.36 2b3b h GLN 369 CO -0.08 1.17 -2.11 0.25 -0.95 0.00 0.00 178.83 177.12 2b3b n THR 370 N -4.07 0.80 -3.68 -0.54 -2.24 -0.75 -4.99 114.28 98.81 2b3b n THR 370 Ca -0.08 -0.65 -0.28 0.00 -2.27 0.00 0.00 64.05 60.77 2b3b n THR 370 Cb 0.70 -0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 2b3b n THR 370 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2b3b n ARG 371 N -2.49 -4.18 -3.70 -0.78 5.12 0.35 -4.95 116.66 106.04 2b3b n ARG 371 Ca -0.20 0.53 -0.39 0.00 -1.93 0.00 0.00 57.85 55.86 2b3b n ARG 371 Cb 0.88 -5.32 -0.11 0.00 -1.16 0.00 0.00 32.46 26.75 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 -3.01 5.43 0.22 0.55 3.84 -1.26 -4.98 114.94 115.73 2b3b s ASN 372 Ca 0.55 -1.41 -0.07 0.00 0.21 0.00 0.00 52.86 52.13 2b3b s ASN 372 Cb -0.28 -1.91 0.16 0.00 -0.55 0.00 0.00 41.25 38.67 2b3b s ASN 372 CO 0.68 -0.44 1.78 -0.65 -2.79 0.00 0.00 177.10 175.67 2b3b h PRO 373 N 8.27 1.19 -0.63 0.43 0.11 -1.91 -1.83 132.00 137.63 2b3b h PRO 373 Ca -0.22 -0.22 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 2b3b h PRO 373 Cb 1.08 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.97 2b3b h PRO 373 CO 0.68 0.97 0.33 1.96 -0.21 0.00 0.00 178.00 181.73 2b3b h GLN 374 N 1.16 0.89 -0.38 1.05 7.50 -1.93 -0.60 115.11 122.79 2b3b h GLN 374 Ca 0.26 -0.11 -0.15 0.00 0.50 0.00 0.00 58.65 59.15 2b3b h GLN 374 Cb 0.23 -0.17 -0.01 0.00 0.05 0.00 0.00 27.48 27.58 2b3b h GLN 374 CO -0.02 0.69 -0.35 0.00 -1.50 0.00 0.00 178.83 177.65 2b3b h ALA 375 N 1.15 0.66 -0.21 3.87 0.00 -1.90 0.67 119.26 123.51 2b3b h ALA 375 Ca 0.22 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 2b3b h ALA 375 Cb 0.07 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2b3b h ALA 375 CO -0.03 0.67 -0.12 0.00 0.00 0.00 0.00 179.25 179.77 2b3b h ALA 376 N 0.86 0.29 -0.91 0.00 0.00 -1.21 -2.06 119.26 116.23 2b3b h ALA 376 Ca 0.07 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2b3b h ALA 376 Cb 0.92 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 2b3b h ALA 376 CO 0.09 0.15 0.55 0.00 0.00 0.00 0.00 179.25 180.03 2b3b h ALA 377 N 0.69 1.16 -0.60 0.00 0.00 -1.02 -0.57 119.26 118.92 2b3b h ALA 377 Ca 0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2b3b h ALA 377 Cb 0.62 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2b3b h ALA 377 CO 0.03 0.61 0.34 -0.91 0.00 0.00 0.00 179.25 179.32 2b3b h ASN 378 N 1.25 0.74 -0.83 0.00 2.35 -0.80 -1.61 115.58 116.69 2b3b h ASN 378 Ca 0.33 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.95 2b3b h ASN 378 Cb -0.06 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.09 2b3b h ASN 378 CO -0.06 0.62 0.38 0.00 -1.65 0.00 0.00 177.43 176.72 2b3b h ALA 379 N 1.16 1.11 -0.46 -0.83 0.00 -1.10 -1.35 119.26 117.78 2b3b h ALA 379 Ca 0.21 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2b3b h ALA 379 Cb 0.03 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2b3b h ALA 379 CO -0.04 0.66 0.11 0.00 0.00 0.00 0.00 179.25 179.99 2b3b h ALA 380 N 1.22 0.61 -0.64 0.00 0.00 -0.90 -2.72 119.26 116.83 2b3b h ALA 380 Ca 0.28 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2b3b h ALA 380 Cb 0.14 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2b3b h ALA 380 CO -0.03 0.30 0.17 0.37 0.00 0.00 0.00 179.25 180.05 2b3b h GLN 381 N 0.62 0.99 -0.85 0.00 5.75 -1.12 -1.30 115.11 119.21 2b3b h GLN 381 Ca 0.14 -0.21 0.02 0.00 -0.15 0.00 0.00 58.65 58.45 2b3b h GLN 381 Cb 0.32 -0.14 -0.05 0.00 1.07 0.00 0.00 27.48 28.69 2b3b h GLN 381 CO 0.00 0.87 0.56 0.00 -2.65 0.00 0.00 178.83 177.61 2b3b h ALA 382 N 1.23 1.44 -0.06 3.38 0.00 -1.13 0.15 119.26 124.28 2b3b h ALA 382 Ca 0.21 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2b3b h ALA 382 Cb 0.32 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2b3b h ALA 382 CO -0.00 0.49 -0.07 0.82 0.00 0.00 0.00 179.25 180.49 2b3b h ILE 383 N 1.09 1.39 -0.89 0.00 1.08 -1.16 -1.78 117.51 117.23 2b3b h ILE 383 Ca 0.32 -1.27 0.07 0.00 -0.39 0.00 0.00 64.86 63.60 2b3b h ILE 383 Cb -0.04 2.10 -0.06 0.00 -3.07 0.00 0.00 36.82 35.75 2b3b h ILE 383 CO -0.09 0.35 0.58 0.00 -0.69 0.00 0.00 178.15 178.30 2b3b h ALA 384 N 0.53 1.56 -0.31 1.87 0.00 -0.92 -0.78 119.26 121.20 2b3b h ALA 384 Ca 0.01 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2b3b h ALA 384 Cb 0.60 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2b3b h ALA 384 CO 0.02 0.29 -0.12 -0.44 0.00 0.00 0.00 179.25 179.00 2b3b h ASP 385 N 0.97 0.64 -0.87 0.00 3.32 -0.69 -1.42 116.42 118.37 2b3b h ASP 385 Ca 0.39 -0.39 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2b3b h ASP 385 Cb 0.26 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.59 2b3b h ASP 385 CO -0.15 0.89 0.46 -0.61 -1.72 0.00 0.00 179.24 178.10 2b3b h GLN 386 N 0.38 1.24 -0.00 3.56 4.15 -0.57 -3.15 115.11 120.71 2b3b h GLN 386 Ca 0.07 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.33 2b3b h GLN 386 Cb 0.63 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 28.09 2b3b h GLN 386 CO 0.04 0.92 -0.55 1.33 -1.93 0.00 0.00 178.83 178.63 2b3b n VAL 387 N -4.32 0.00 -2.65 2.39 0.24 -0.37 -4.97 118.33 108.65 2b3b n VAL 387 Ca 0.09 -0.06 -0.06 0.00 -2.04 0.00 0.00 64.34 62.27 2b3b n VAL 387 Cb 0.11 0.58 0.02 0.00 -1.47 0.00 0.00 33.84 33.09 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 1.45 0.40 3.70 7.63 0.00 -0.85 -4.95 105.19 112.57 2b3b n GLY 388 Ca 0.07 -0.37 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.83 3.52 0.00 0.99 7.94 -0.59 -1.55 117.00 125.47 2b3b n LEU 389 Ca -0.03 1.18 0.00 0.00 -1.11 0.00 0.00 56.01 56.05 2b3b n LEU 389 Cb 0.53 -1.48 0.00 0.00 0.53 0.00 0.00 43.42 43.00 2b3b n LEU 389 CO 0.18 -0.42 0.00 0.61 -1.11 0.00 0.00 177.39 176.65 2b3b n GLY 390 N 1.27 3.01 0.00 -3.96 0.00 -1.19 -4.33 105.19 100.00 2b3b n GLY 390 Ca 0.07 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.23 2b3b n GLY 390 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36