#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 0.58 -0.07 2.12 1.02 -1.26 -0.58 119.74 121.55 2b3b s LYS 2 Ca 0.00 -1.16 -0.03 0.00 0.02 0.00 0.00 55.97 54.81 2b3b s LYS 2 Cb 0.00 0.20 0.04 0.00 -0.52 0.00 0.00 37.83 37.55 2b3b s LYS 2 CO 0.00 -0.11 0.12 -1.17 -0.92 0.00 0.00 175.35 173.28 2b3b s LEU 3 N -2.77 0.22 -0.38 3.17 2.96 -0.28 -4.77 118.68 116.83 2b3b s LEU 3 Ca 0.05 0.25 -0.10 0.00 -0.22 0.00 0.00 54.13 54.10 2b3b s LEU 3 Cb 0.06 0.17 0.03 0.00 0.50 0.00 0.00 46.19 46.96 2b3b s LEU 3 CO -0.09 -0.22 0.20 -0.70 -1.32 0.00 0.00 176.35 174.23 2b3b s GLU 4 N 1.94 2.78 -0.27 1.98 2.12 -1.26 -0.07 118.70 125.92 2b3b s GLU 4 Ca 0.00 -1.13 -0.11 0.00 0.36 0.00 0.00 54.97 54.08 2b3b s GLU 4 Cb -0.12 -3.72 -0.05 0.00 0.26 0.00 0.00 34.13 30.51 2b3b s GLU 4 CO -0.05 -0.73 0.20 0.42 -0.54 0.00 0.00 175.26 174.57 2b3b s ILE 5 N 1.53 5.31 -0.18 -3.70 1.01 -0.46 -1.82 121.20 122.88 2b3b s ILE 5 Ca 0.02 0.22 -0.08 0.00 0.00 0.00 0.00 60.65 60.80 2b3b s ILE 5 Cb -0.20 -3.54 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 2b3b s ILE 5 CO 0.06 0.27 0.09 0.12 0.00 0.00 0.00 174.94 175.48 2b3b s PHE 6 N 1.60 3.34 0.36 3.97 5.36 -0.58 -0.50 117.98 131.52 2b3b s PHE 6 Ca 0.08 0.21 -0.17 0.00 -0.96 0.00 0.00 56.93 56.09 2b3b s PHE 6 Cb -0.15 -2.10 0.06 0.00 -0.34 0.00 0.00 43.02 40.48 2b3b s PHE 6 CO 0.09 0.25 0.82 -1.54 -1.46 0.00 0.00 175.22 173.38 2b3b s SER 7 N 0.26 -0.01 -0.24 6.13 1.04 -0.84 -0.95 113.70 119.09 2b3b s SER 7 Ca 0.06 -1.07 0.12 0.00 0.48 0.00 0.00 55.95 55.54 2b3b s SER 7 Cb -0.12 0.81 0.48 0.00 0.10 0.00 0.00 66.02 67.29 2b3b s SER 7 CO -0.01 -1.60 1.40 -2.67 0.98 0.00 0.00 173.24 171.34 2b3b n TRP 8 N -0.55 0.84 -1.87 5.02 2.14 -1.26 -0.53 117.44 121.23 2b3b n TRP 8 Ca -0.08 -1.36 -0.36 0.00 2.07 0.00 0.00 57.50 57.77 2b3b n TRP 8 Cb 0.60 -0.39 -0.02 0.00 -0.81 0.00 0.00 31.31 30.69 2b3b n TRP 8 CO 0.00 0.00 0.00 0.91 2.07 0.00 0.00 177.69 180.67 2b3b n TRP 9 N -1.01 2.32 -2.44 -2.67 8.01 -1.26 -4.65 117.44 115.73 2b3b n TRP 9 Ca 0.27 -2.56 -0.31 0.00 -1.31 0.00 0.00 57.50 53.59 2b3b n TRP 9 Cb 0.93 -1.68 -0.02 0.00 -2.01 0.00 0.00 31.31 28.52 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 -1.43 3.17 0.00 6.99 0.00 -1.26 -2.81 121.76 126.42 2b3b s ALA 10 Ca 0.55 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.49 2b3b s ALA 10 Cb 0.24 -2.96 0.00 0.00 0.00 0.00 0.00 23.12 20.40 2b3b s ALA 10 CO -0.13 -0.27 0.00 0.41 0.00 0.00 0.00 175.76 175.77 2b3b n GLY 11 N -1.78 3.71 0.00 0.00 0.00 -1.26 -1.62 105.19 104.25 2b3b n GLY 11 Ca 0.05 -0.06 0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 6.00 0.00 -0.00 1.61 5.68 -1.26 -1.31 116.55 127.27 2b3b n ASP 12 Ca 0.00 -0.51 0.13 0.00 -0.50 0.00 0.00 54.79 53.92 2b3b n ASP 12 Cb 0.00 -0.15 0.51 0.00 -1.14 0.00 0.00 41.12 40.34 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 -1.15 0.00 0.17 0.11 1.02 -0.64 -4.43 120.64 115.73 2b3b n GLU 13 Ca 0.18 -0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.37 2b3b n GLU 13 Cb 0.17 -1.50 0.21 0.00 -0.02 0.00 0.00 31.44 30.29 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 5.00 0.00 0.17 0.62 0.00 -1.03 -3.40 103.07 104.43 2b3b h GLY 14 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.45 2b3b h GLY 14 CO 0.00 0.00 0.13 -2.55 0.00 0.00 0.00 176.54 174.12 2b3b h PRO 15 N 0.00 0.26 -0.16 4.80 0.11 -1.78 0.24 132.00 135.47 2b3b h PRO 15 Ca -0.00 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 66.11 2b3b h PRO 15 Cb 1.11 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 2b3b h PRO 15 CO 0.05 0.17 0.05 0.00 -0.21 0.00 0.00 178.00 178.06 2b3b h ALA 16 N 1.49 0.17 -0.34 -0.75 0.00 -1.82 -0.87 119.26 117.14 2b3b h ALA 16 Ca 0.32 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.27 2b3b h ALA 16 Cb 0.48 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2b3b h ALA 16 CO -0.41 -0.39 0.18 1.25 0.00 0.00 0.00 179.25 179.88 2b3b h LEU 17 N 0.12 0.27 -0.62 0.00 5.85 -1.65 -2.22 115.31 117.06 2b3b h LEU 17 Ca 0.07 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.83 2b3b h LEU 17 Cb 0.04 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 2b3b h LEU 17 CO -0.07 0.20 0.37 -0.33 -0.34 0.00 0.00 178.44 178.27 2b3b h GLU 18 N 0.36 0.71 -0.43 1.25 5.08 -0.34 0.93 114.58 122.14 2b3b h GLU 18 Ca 0.14 -0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.53 2b3b h GLU 18 Cb 0.04 -0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.07 2b3b h GLU 18 CO -0.09 0.47 0.06 0.00 -1.00 0.00 0.00 179.01 178.45 2b3b h ALA 19 N 1.28 0.46 -0.90 3.43 0.00 -1.07 -1.02 119.26 121.44 2b3b h ALA 19 Ca 0.25 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 2b3b h ALA 19 Cb 0.04 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2b3b h ALA 19 CO -0.11 -0.34 0.49 -0.07 0.00 0.00 0.00 179.25 179.22 2b3b h LEU 20 N 0.19 1.12 -0.75 0.00 3.38 -0.57 -1.91 115.31 116.78 2b3b h LEU 20 Ca 0.21 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 2b3b h LEU 20 Cb 0.28 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2b3b h LEU 20 CO -0.30 0.90 0.01 0.40 0.09 0.00 0.00 178.44 179.55 2b3b h ILE 21 N 1.26 1.26 -0.64 1.22 2.04 -0.54 -0.78 117.51 121.32 2b3b h ILE 21 Ca 0.32 -1.09 -0.06 0.00 1.00 0.00 0.00 64.86 65.03 2b3b h ILE 21 Cb 0.03 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 2b3b h ILE 21 CO -0.05 0.39 0.17 0.03 0.00 0.00 0.00 178.15 178.69 2b3b h ARG 22 N 0.89 1.02 -0.13 2.37 3.08 -0.78 -0.13 114.38 120.70 2b3b h ARG 22 Ca 0.17 -0.24 0.02 0.00 0.07 0.00 0.00 59.98 59.99 2b3b h ARG 22 Cb 0.50 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 2b3b h ARG 22 CO 0.02 0.92 0.02 1.25 -1.07 0.00 0.00 179.97 181.11 2b3b h LEU 23 N 0.95 -0.01 -0.57 3.04 5.85 -1.14 -1.48 115.31 121.95 2b3b h LEU 23 Ca 0.20 0.02 0.08 0.00 0.84 0.00 0.00 57.88 59.02 2b3b h LEU 23 Cb 0.34 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.35 2b3b h LEU 23 CO -0.00 0.02 0.23 0.22 -0.34 0.00 0.00 178.44 178.57 2b3b h TYR 24 N 0.07 0.41 -0.29 1.25 3.20 -0.86 -1.78 116.97 118.97 2b3b h TYR 24 Ca 0.06 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.89 2b3b h TYR 24 Cb 0.06 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.21 2b3b h TYR 24 CO -0.13 0.14 -0.12 0.87 -1.64 0.00 0.00 178.16 177.28 2b3b h LYS 25 N 0.43 0.50 -0.46 1.82 1.57 -0.83 0.11 116.57 119.71 2b3b h LYS 25 Ca 0.28 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2b3b h LYS 25 Cb 0.30 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 2b3b h LYS 25 CO -0.26 0.61 0.28 1.96 -0.57 0.00 0.00 179.45 181.48 2b3b h GLN 26 N 0.46 0.62 -0.08 3.15 4.20 -0.62 -2.46 115.11 120.39 2b3b h GLN 26 Ca 0.09 -0.05 -0.16 0.00 0.06 0.00 0.00 58.65 58.58 2b3b h GLN 26 Cb 0.48 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 2b3b h GLN 26 CO 0.03 0.45 -0.66 0.87 -0.67 0.00 0.00 178.83 178.84 2b3b h LYS 27 N 0.62 0.33 -2.52 1.46 1.57 -0.74 -3.39 116.57 113.90 2b3b h LYS 27 Ca 0.17 -0.25 -0.60 0.00 -1.87 0.00 0.00 60.65 58.10 2b3b h LYS 27 Cb -0.02 0.04 -0.39 0.00 0.08 0.00 0.00 32.23 31.94 2b3b h LYS 27 CO -0.03 0.87 -0.85 0.66 -0.57 0.00 0.00 179.45 179.53 2b3b n TYR 28 N -3.85 0.60 0.30 -1.35 4.01 0.34 -4.98 117.16 112.23 2b3b n TYR 28 Ca -0.03 -3.67 0.19 0.00 -0.16 0.00 0.00 57.90 54.23 2b3b n TYR 28 Cb 0.66 -0.10 0.95 0.00 -0.31 0.00 0.00 39.34 40.53 2b3b n TYR 28 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2b3b h PRO 29 N 5.30 0.00 0.00 -0.72 0.11 -1.64 -2.95 132.00 132.10 2b3b h PRO 29 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 2b3b h PRO 29 Cb 0.85 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.96 2b3b h PRO 29 CO 0.51 0.02 0.00 0.78 -0.21 0.00 0.00 178.00 179.10 2b3b h GLY 30 N 0.89 0.00 -6.20 -0.55 0.00 -1.94 -3.46 103.07 91.81 2b3b h GLY 30 Ca -0.00 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.73 2b3b h GLY 30 CO 0.00 0.00 0.11 0.14 0.00 0.00 0.00 176.54 176.79 2b3b s VAL 31 N -3.25 5.02 -0.41 4.60 1.01 -1.11 -4.57 120.40 121.69 2b3b s VAL 31 Ca 0.07 1.13 -0.29 0.00 0.00 0.00 0.00 61.98 62.89 2b3b s VAL 31 Cb 0.10 -3.92 0.01 0.00 0.00 0.00 0.00 36.38 32.57 2b3b s VAL 31 CO 0.50 0.09 1.32 -0.70 0.00 0.00 0.00 175.10 176.31 2b3b s GLU 32 N 2.09 3.67 -0.30 2.72 2.12 0.25 -4.92 118.70 124.33 2b3b s GLU 32 Ca 0.27 0.89 -0.18 0.00 0.36 0.00 0.00 54.97 56.31 2b3b s GLU 32 Cb -0.16 -3.97 -0.02 0.00 0.26 0.00 0.00 34.13 30.25 2b3b s GLU 32 CO 0.10 -1.44 0.52 0.08 -0.54 0.00 0.00 175.26 173.98 2b3b s VAL 33 N 5.00 5.04 -0.41 3.70 1.01 -1.26 -1.13 120.40 132.34 2b3b s VAL 33 Ca 0.57 0.67 -0.19 0.00 0.00 0.00 0.00 61.98 63.02 2b3b s VAL 33 Cb -0.12 -3.89 0.02 0.00 0.00 0.00 0.00 36.38 32.38 2b3b s VAL 33 CO 0.31 -0.05 0.55 -0.63 0.00 0.00 0.00 175.10 175.28 2b3b s ILE 34 N 2.37 4.95 -1.09 2.22 1.09 0.90 -4.96 121.20 126.68 2b3b s ILE 34 Ca 0.20 0.07 -0.17 0.00 -1.10 0.00 0.00 60.65 59.65 2b3b s ILE 34 Cb -0.15 -4.09 0.13 0.00 -1.06 0.00 0.00 42.46 37.28 2b3b s ILE 34 CO 0.11 -0.44 1.36 0.21 -0.10 0.00 0.00 174.94 176.08 2b3b s ASN 35 N 1.88 6.80 -1.17 3.58 2.47 -1.26 -1.36 114.94 125.87 2b3b s ASN 35 Ca 0.19 -2.36 -0.17 0.00 0.42 0.00 0.00 52.86 50.94 2b3b s ASN 35 Cb -0.15 -2.44 0.12 0.00 -1.45 0.00 0.00 41.25 37.32 2b3b s ASN 35 CO 0.16 -1.02 1.49 0.00 -3.72 0.00 0.00 177.10 174.01 2b3b s ALA 36 N 2.79 3.52 0.26 1.71 0.00 0.34 -5.00 121.76 125.37 2b3b s ALA 36 Ca 0.41 -2.99 -0.10 0.00 0.00 0.00 0.00 51.96 49.28 2b3b s ALA 36 Cb -0.02 -4.34 -0.07 0.00 0.00 0.00 0.00 23.12 18.68 2b3b s ALA 36 CO -0.04 -3.09 0.59 0.95 0.00 0.00 0.00 175.76 174.18 2b3b s THR 37 N 3.05 4.89 -0.24 0.00 -4.23 -1.26 -1.98 115.64 115.87 2b3b s THR 37 Ca 0.45 0.52 0.01 0.00 -1.18 0.00 0.00 61.69 61.50 2b3b s THR 37 Cb -0.00 -3.63 0.06 0.00 1.34 0.00 0.00 72.50 70.27 2b3b s THR 37 CO 0.00 -0.13 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.19 2b3b s VAL 38 N -1.89 1.65 0.35 2.29 1.01 0.31 -4.93 120.40 119.19 2b3b s VAL 38 Ca 0.48 -1.30 -0.28 0.00 0.00 0.00 0.00 61.98 60.88 2b3b s VAL 38 Cb -0.11 -1.89 -0.10 0.00 0.00 0.00 0.00 36.38 34.28 2b3b s VAL 38 CO 0.22 -0.09 1.36 -0.89 0.00 0.00 0.00 175.10 175.70 2b3b s THR 39 N 1.34 2.51 0.00 3.92 2.01 -1.26 -4.37 115.64 119.79 2b3b s THR 39 Ca -0.06 0.51 0.00 0.00 0.31 0.00 0.00 61.69 62.44 2b3b s THR 39 Cb -0.19 -3.32 0.00 0.00 0.01 0.00 0.00 72.50 69.00 2b3b s THR 39 CO -0.06 0.12 0.00 0.61 -0.69 0.00 0.00 174.62 174.60 2b3b n GLY 40 N 0.68 2.77 3.62 4.40 0.00 -1.26 -4.69 105.19 110.72 2b3b n GLY 40 Ca 0.01 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 2b3b n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b3b n GLY 41 N 0.00 -0.06 2.47 -0.02 0.00 -1.26 -2.42 105.19 103.90 2b3b n GLY 41 Ca 0.00 0.22 -0.19 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.17 -0.30 -1.07 4.61 0.00 -1.26 -3.13 120.51 119.18 2b3b n ALA 42 Ca 0.08 0.31 -0.03 0.00 0.00 0.00 0.00 53.44 53.81 2b3b n ALA 42 Cb 0.37 -1.92 -0.01 0.00 0.00 0.00 0.00 19.45 17.89 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 -0.37 0.52 0.20 0.00 0.00 -1.01 -4.91 105.19 99.62 2b3b n GLY 43 Ca -0.19 -0.19 -0.14 0.00 0.00 0.00 0.00 46.02 45.49 2b3b n GLY 43 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2b3b h VAL 44 N 0.00 0.66 -0.64 1.61 3.04 -1.72 -0.70 116.25 118.50 2b3b h VAL 44 Ca -0.05 0.00 -0.09 0.00 -1.01 0.00 0.00 66.70 65.55 2b3b h VAL 44 Cb 0.45 0.66 -0.02 0.00 -2.01 0.00 0.00 31.29 30.37 2b3b h VAL 44 CO 0.08 0.00 0.06 0.78 -1.01 0.00 0.00 177.57 177.48 2b3b h ASN 45 N -0.42 1.05 -0.81 3.17 2.35 -1.84 -3.03 115.58 116.05 2b3b h ASN 45 Ca -0.03 -0.27 -0.00 0.00 -0.55 0.00 0.00 56.30 55.44 2b3b h ASN 45 Cb 0.34 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.39 2b3b h ASN 45 CO 0.05 1.07 0.49 0.00 -1.65 0.00 0.00 177.43 177.38 2b3b h ALA 46 N 1.05 1.04 -0.43 -0.83 0.00 -1.72 -2.73 119.26 115.64 2b3b h ALA 46 Ca 0.19 -0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.09 2b3b h ALA 46 Cb 0.49 -0.33 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 2b3b h ALA 46 CO 0.02 0.50 -0.06 0.00 0.00 0.00 0.00 179.25 179.71 2b3b h ARG 47 N 1.12 0.04 -0.40 0.00 3.08 -1.00 0.23 114.38 117.45 2b3b h ARG 47 Ca 0.29 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.32 2b3b h ARG 47 Cb -0.04 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 2b3b h ARG 47 CO -0.05 0.03 0.19 0.00 -1.07 0.00 0.00 179.97 179.06 2b3b h ALA 48 N 1.41 0.52 -0.22 0.04 0.00 -1.56 0.20 119.26 119.65 2b3b h ALA 48 Ca 0.21 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2b3b h ALA 48 Cb 0.31 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2b3b h ALA 48 CO -0.40 0.09 0.09 0.28 0.00 0.00 0.00 179.25 179.31 2b3b h VAL 49 N 0.51 1.16 -0.75 0.00 2.07 -1.16 -2.22 116.25 115.86 2b3b h VAL 49 Ca 0.14 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.20 2b3b h VAL 49 Cb 0.13 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 2b3b h VAL 49 CO -0.02 0.16 0.49 0.25 0.02 0.00 0.00 177.57 178.47 2b3b h LEU 50 N 0.20 0.85 -0.62 2.57 5.85 -0.42 -2.33 115.31 121.42 2b3b h LEU 50 Ca 0.07 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.81 2b3b h LEU 50 Cb 0.16 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 2b3b h LEU 50 CO -0.01 0.61 0.36 0.50 -0.34 0.00 0.00 178.44 179.56 2b3b h LYS 51 N 1.00 0.68 -0.63 1.25 3.64 -0.64 0.04 116.57 121.91 2b3b h LYS 51 Ca 0.28 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.62 2b3b h LYS 51 Cb -0.09 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.55 2b3b h LYS 51 CO -0.07 0.45 0.39 1.15 -2.27 0.00 0.00 179.45 179.10 2b3b h THR 52 N 0.70 1.18 -0.13 1.00 2.02 -0.96 -0.98 112.91 115.73 2b3b h THR 52 Ca 0.26 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 2b3b h THR 52 Cb 0.08 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 2b3b h THR 52 CO -0.13 0.18 0.03 0.03 0.37 0.00 0.00 175.52 176.00 2b3b h ARG 53 N 0.86 0.22 -0.33 6.66 3.08 -0.88 0.37 114.38 124.37 2b3b h ARG 53 Ca 0.23 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.18 2b3b h ARG 53 Cb -0.05 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2b3b h ARG 53 CO -0.04 0.39 0.05 0.52 -1.07 0.00 0.00 179.97 179.82 2b3b h MET 54 N 0.01 0.54 0.00 0.04 2.86 -0.93 0.24 114.93 117.70 2b3b h MET 54 Ca 0.04 -0.15 -0.08 0.00 -2.06 0.00 0.00 59.70 57.45 2b3b h MET 54 Cb 0.27 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 2b3b h MET 54 CO 0.00 0.63 -0.40 -0.07 1.06 0.00 0.00 176.91 178.13 2b3b h LEU 55 N 0.37 0.00 0.00 1.22 3.38 -1.20 -2.15 115.31 116.93 2b3b h LEU 55 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2b3b h LEU 55 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2b3b h LEU 55 CO 0.01 0.40 0.00 0.61 0.09 0.00 0.00 178.44 179.55 2b3b n GLY 56 N 0.02 -0.91 2.17 0.83 0.00 0.12 -4.90 105.19 102.52 2b3b n GLY 56 Ca -0.01 -0.15 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 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 0.75 0.14 2.57 -0.02 0.00 -0.81 -4.99 105.19 102.83 2b3b n GLY 57 Ca 0.18 -0.52 -0.23 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 0.40 2.69 -4.74 1.61 2.03 0.82 -5.02 116.55 114.33 2b3b n ASP 58 Ca -0.07 -3.35 -0.36 0.00 0.52 0.00 0.00 54.79 51.52 2b3b n ASP 58 Cb 0.56 -0.59 0.05 0.00 -0.72 0.00 0.00 41.12 40.42 2b3b n ASP 58 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2b3b s PRO 59 N -2.96 2.81 1.08 -0.67 0.04 -1.26 -4.47 135.00 129.57 2b3b s PRO 59 Ca 0.45 1.92 -0.17 0.00 0.04 0.00 0.00 61.00 63.23 2b3b s PRO 59 Cb 0.31 -1.90 0.24 0.00 0.04 0.00 0.00 34.50 33.20 2b3b s PRO 59 CO -0.11 -1.36 1.21 -1.25 0.04 0.00 0.00 177.00 175.53 2b3b s PRO 60 N -3.35 -0.25 0.32 0.56 0.04 -1.26 -4.67 135.00 126.38 2b3b s PRO 60 Ca 0.79 -0.20 0.15 0.00 0.04 0.00 0.00 61.00 61.78 2b3b s PRO 60 Cb -0.33 -1.72 0.49 0.00 0.04 0.00 0.00 34.50 32.98 2b3b s PRO 60 CO 0.36 -3.04 1.66 -0.44 0.04 0.00 0.00 177.00 175.57 2b3b h ASP 61 N -2.10 0.00 -4.85 6.66 3.32 -1.74 -3.43 116.42 114.28 2b3b h ASP 61 Ca -0.45 0.00 0.03 0.00 0.02 0.00 0.00 57.03 56.63 2b3b h ASP 61 Cb 1.27 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.68 2b3b h ASP 61 CO 0.37 0.49 0.32 0.28 -1.72 0.00 0.00 179.24 178.98 2b3b s THR 62 N -3.54 0.00 -0.07 0.35 -1.32 -1.17 -4.31 115.64 105.58 2b3b s THR 62 Ca -0.00 0.00 -0.07 0.00 -1.21 0.00 0.00 61.69 60.41 2b3b s THR 62 Cb 0.11 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 70.12 2b3b s THR 62 CO 0.72 0.00 0.20 0.72 -2.21 0.00 0.00 174.62 174.05 2b3b s PHE 63 N -3.31 -0.19 0.22 9.09 -0.12 -1.26 -1.53 117.98 120.87 2b3b s PHE 63 Ca 0.02 0.46 -0.32 0.00 -0.05 0.00 0.00 56.93 57.03 2b3b s PHE 63 Cb -0.01 0.06 -0.12 0.00 -0.63 0.00 0.00 43.02 42.32 2b3b s PHE 63 CO -0.10 -0.13 1.65 0.94 -0.05 0.00 0.00 175.22 177.53 2b3b n GLN 64 N 2.76 2.58 -3.67 1.99 7.27 -0.13 -4.18 117.38 124.00 2b3b n GLN 64 Ca -0.14 0.93 -0.14 0.00 0.07 0.00 0.00 57.00 57.72 2b3b n GLN 64 Cb 0.58 -2.74 -0.08 0.00 2.41 0.00 0.00 30.24 30.41 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 0.82 0.00 0.13 1.69 0.11 0.09 -4.93 120.40 118.32 2b3b s VAL 65 Ca 0.73 -0.03 -0.30 0.00 -2.93 0.00 0.00 61.98 59.45 2b3b s VAL 65 Cb -0.55 -0.80 -0.07 0.00 -1.53 0.00 0.00 36.38 33.43 2b3b s VAL 65 CO 0.37 -0.02 1.11 -1.00 -3.33 0.00 0.00 175.10 172.23 2b3b s HIS 66 N 0.03 3.57 0.34 1.54 3.76 -1.26 -0.59 115.29 122.69 2b3b s HIS 66 Ca -0.02 1.54 -0.29 0.00 -0.15 0.00 0.00 55.06 56.15 2b3b s HIS 66 Cb -0.04 -3.29 -0.11 0.00 1.11 0.00 0.00 32.58 30.26 2b3b s HIS 66 CO 0.02 -0.68 1.46 0.00 -0.85 0.00 0.00 174.74 174.68 2b3b s ALA 67 N 0.18 3.59 0.00 -1.40 0.00 -0.26 -2.72 121.76 121.15 2b3b s ALA 67 Ca 0.52 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.95 2b3b s ALA 67 Cb -0.28 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.26 2b3b s ALA 67 CO 0.33 -0.92 0.00 0.41 0.00 0.00 0.00 175.76 175.58 2b3b n GLY 68 N 0.98 0.22 0.23 0.00 0.00 -0.90 -3.65 105.19 102.06 2b3b n GLY 68 Ca 0.02 -1.95 0.08 0.00 0.00 0.00 0.00 46.02 44.17 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 0.09 1.61 2.86 -1.06 -2.08 114.93 116.35 2b3b h MET 69 Ca 0.00 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2b3b h MET 69 Cb 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 2b3b h MET 69 CO 0.00 0.21 -0.12 1.49 1.06 0.00 0.00 176.91 179.55 2b3b h GLU 70 N 0.00 -0.24 0.43 1.72 4.81 -1.20 -0.88 114.58 119.21 2b3b h GLU 70 Ca -0.00 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 2b3b h GLU 70 Cb 0.45 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.89 2b3b h GLU 70 CO 0.03 -0.16 -0.21 1.25 -0.73 0.00 0.00 179.01 179.19 2b3b h LEU 71 N -0.25 -0.49 -0.06 1.64 5.85 -1.23 -3.21 115.31 117.56 2b3b h LEU 71 Ca 0.01 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2b3b h LEU 71 Cb 0.26 0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.41 2b3b h LEU 71 CO -0.05 -0.33 0.01 0.40 -0.34 0.00 0.00 178.44 178.12 2b3b h ILE 72 N -0.59 1.22 0.00 4.05 1.08 -1.36 -3.01 117.51 118.90 2b3b h ILE 72 Ca -0.06 -0.68 0.00 0.00 -0.39 0.00 0.00 64.86 63.73 2b3b h ILE 72 Cb 0.45 1.57 0.00 0.00 -3.07 0.00 0.00 36.82 35.77 2b3b h ILE 72 CO 0.10 0.19 0.00 0.61 -0.69 0.00 0.00 178.15 178.35 2b3b n GLY 73 N -0.37 -1.19 0.07 5.37 0.00 -0.34 -0.81 105.19 107.91 2b3b n GLY 73 Ca -0.07 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2b3b n GLY 73 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2b3b n THR 74 N -1.22 0.00 0.08 2.61 -1.04 -1.21 -4.80 114.28 108.70 2b3b n THR 74 Ca 0.16 0.03 0.07 0.00 -2.04 0.00 0.00 64.05 62.28 2b3b n THR 74 Cb 0.20 -0.82 -0.03 0.00 -1.82 0.00 0.00 70.33 67.87 2b3b n THR 74 CO 0.00 0.00 0.00 -0.50 -0.64 0.00 0.00 175.07 173.93 2b3b h TRP 75 N 0.00 0.00 0.04 -1.42 -0.00 -1.73 -3.18 115.95 109.66 2b3b h TRP 75 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 58.89 58.81 2b3b h TRP 75 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 29.16 29.17 2b3b h TRP 75 CO 0.00 0.23 -0.33 0.28 -0.00 0.00 0.00 178.44 178.62 2b3b h VAL 76 N 0.00 1.62 0.00 1.49 2.07 -1.57 -0.56 116.25 119.30 2b3b h VAL 76 Ca -0.06 -2.24 -0.01 0.00 0.82 0.00 0.00 66.70 65.20 2b3b h VAL 76 Cb 1.23 3.09 -0.00 0.00 -1.52 0.00 0.00 31.29 34.09 2b3b h VAL 76 CO 0.02 0.61 -0.06 -0.37 0.02 0.00 0.00 177.57 177.78 2b3b h VAL 77 N -0.62 0.26 -0.08 2.57 -1.51 -1.13 0.42 116.25 116.15 2b3b h VAL 77 Ca -0.05 -0.47 0.00 0.00 -1.23 0.00 0.00 66.70 64.95 2b3b h VAL 77 Cb 1.18 1.36 0.00 0.00 -2.13 0.00 0.00 31.29 31.71 2b3b h VAL 77 CO 0.06 0.06 0.00 0.00 -1.23 0.00 0.00 177.57 176.47 2b3b n ALA 78 N -2.17 2.56 -3.89 5.19 0.00 -1.20 -4.93 120.51 116.08 2b3b n ALA 78 Ca -0.01 -0.29 -0.29 0.00 0.00 0.00 0.00 53.44 52.85 2b3b n ALA 78 Cb 0.24 -1.18 0.03 0.00 0.00 0.00 0.00 19.45 18.54 2b3b n ALA 78 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2b3b n ASN 79 N -0.28 -4.58 -0.33 0.00 3.02 0.14 -4.89 115.26 108.34 2b3b n ASN 79 Ca 0.14 -0.77 0.09 0.00 -0.03 0.00 0.00 54.58 54.00 2b3b n ASN 79 Cb 0.17 -3.94 -0.02 0.00 -0.61 0.00 0.00 39.78 35.38 2b3b n ASN 79 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2b3b n ARG 80 N -4.67 1.48 -4.30 3.52 5.12 -0.23 -4.97 116.66 112.61 2b3b n ARG 80 Ca 0.01 -0.70 -0.30 0.00 -1.93 0.00 0.00 57.85 54.93 2b3b n ARG 80 Cb 0.54 -1.34 -0.11 0.00 -1.16 0.00 0.00 32.46 30.39 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 -2.20 2.01 0.11 5.56 -1.94 -1.24 -0.96 119.30 120.64 2b3b s MET 81 Ca 0.13 -1.07 -0.24 0.00 -1.71 0.00 0.00 55.69 52.80 2b3b s MET 81 Cb 0.14 -2.23 -0.07 0.00 2.01 0.00 0.00 34.83 34.68 2b3b s MET 81 CO 0.51 0.50 0.74 -1.21 -0.01 0.00 0.00 175.02 175.56 2b3b s GLU 82 N -2.10 4.50 0.09 2.03 2.02 0.29 -4.76 118.70 120.77 2b3b s GLU 82 Ca 0.19 1.07 -0.31 0.00 0.02 0.00 0.00 54.97 55.94 2b3b s GLU 82 Cb -0.11 -3.29 -0.08 0.00 0.10 0.00 0.00 34.13 30.75 2b3b s GLU 82 CO 0.12 0.49 1.45 0.34 0.02 0.00 0.00 175.26 177.68 2b3b s ASP 83 N -0.79 6.77 0.00 -0.19 2.15 -1.26 -4.63 116.67 118.72 2b3b s ASP 83 Ca 0.36 2.35 0.21 0.00 0.43 0.00 0.00 52.55 55.90 2b3b s ASP 83 Cb -0.22 -2.58 0.52 0.00 -0.30 0.00 0.00 42.92 40.34 2b3b s ASP 83 CO 0.24 -0.72 1.44 0.18 -0.17 0.00 0.00 175.17 176.14 2b3b n LEU 84 N 4.44 3.62 -0.25 -1.34 4.77 0.10 -4.61 117.00 123.73 2b3b n LEU 84 Ca 0.13 -1.81 0.06 0.00 -0.03 0.00 0.00 56.01 54.36 2b3b n LEU 84 Cb 0.42 -0.37 0.18 0.00 -2.33 0.00 0.00 43.42 41.32 2b3b n LEU 84 CO 0.60 0.86 0.90 0.28 -1.33 0.00 0.00 177.39 178.70 2b3b h SER 85 N 4.02 -0.09 -0.19 -1.43 0.02 -1.92 0.41 113.55 114.38 2b3b h SER 85 Ca 0.00 0.16 -0.09 0.00 -0.84 0.00 0.00 61.79 61.02 2b3b h SER 85 Cb 0.94 0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.71 2b3b h SER 85 CO 0.00 -0.09 -0.19 0.00 -1.14 0.00 0.00 176.83 175.41 2b3b h ALA 86 N 1.65 1.05 -0.40 3.77 0.00 -1.96 -0.54 119.26 122.84 2b3b h ALA 86 Ca 0.43 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2b3b h ALA 86 Cb 0.75 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2b3b h ALA 86 CO -0.56 0.57 0.11 1.25 0.00 0.00 0.00 179.25 180.62 2b3b h LEU 87 N 0.55 0.59 -0.60 0.00 5.85 -1.38 -0.29 115.31 120.02 2b3b h LEU 87 Ca 0.09 -0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.61 2b3b h LEU 87 Cb 0.63 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.47 2b3b h LEU 87 CO 0.04 0.66 0.37 -0.26 -0.34 0.00 0.00 178.44 178.91 2b3b h PHE 88 N 0.49 0.69 0.13 1.25 -1.00 -0.79 -0.20 116.94 117.51 2b3b h PHE 88 Ca 0.13 0.02 0.01 0.00 2.81 0.00 0.00 57.97 60.94 2b3b h PHE 88 Cb 0.29 -0.22 -0.03 0.00 3.61 0.00 0.00 35.95 39.61 2b3b h PHE 88 CO 0.02 0.39 -0.21 -0.09 -1.61 0.00 0.00 178.31 176.81 2b3b h ARG 89 N 0.72 -0.39 -0.96 1.51 9.65 -0.89 -0.01 114.38 124.01 2b3b h ARG 89 Ca 0.24 0.03 0.08 0.00 -1.10 0.00 0.00 59.98 59.23 2b3b h ARG 89 Cb 0.03 0.09 -0.07 0.00 -1.39 0.00 0.00 29.97 28.62 2b3b h ARG 89 CO -0.10 -0.26 0.61 0.37 2.80 0.00 0.00 179.97 183.39 2b3b h GLN 90 N -0.40 1.05 -0.01 0.20 4.15 -0.75 -2.61 115.11 116.73 2b3b h GLN 90 Ca 0.02 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.38 2b3b h GLN 90 Cb 0.41 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.87 2b3b h GLN 90 CO -0.10 0.69 -0.32 0.39 -1.93 0.00 0.00 178.83 177.56 2b3b n GLU 91 N -4.56 0.78 -2.30 1.69 -0.58 -0.11 -4.95 120.64 110.61 2b3b n GLU 91 Ca 0.15 -0.49 -0.06 0.00 -0.42 0.00 0.00 57.16 56.34 2b3b n GLU 91 Cb 0.22 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.61 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 1.37 0.22 0.09 0.62 0.00 -0.54 -4.97 105.19 101.98 2b3b n GLY 92 Ca 0.11 -0.57 0.12 0.00 0.00 0.00 0.00 46.02 45.68 2b3b n GLY 92 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2b3b h TRP 93 N -0.21 0.00 0.00 1.61 6.55 -1.30 -3.36 115.95 119.24 2b3b h TRP 93 Ca -0.15 0.00 -0.03 0.00 0.95 0.00 0.00 58.89 59.66 2b3b h TRP 93 Cb 1.11 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 29.40 2b3b h TRP 93 CO 0.16 0.00 -0.14 1.25 -1.05 0.00 0.00 178.44 178.66 2b3b h LEU 94 N 0.00 0.00 -2.76 -4.49 5.85 -1.94 -0.97 115.31 111.00 2b3b h LEU 94 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2b3b h LEU 94 Cb 0.85 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.88 2b3b h LEU 94 CO 0.00 0.14 0.00 0.00 -0.34 0.00 0.00 178.44 178.24 2b3b n GLN 95 N -3.85 2.74 0.00 1.25 1.13 -1.26 -4.49 117.38 112.90 2b3b n GLN 95 Ca -0.02 -2.32 0.11 0.00 -1.94 0.00 0.00 57.00 52.83 2b3b n GLN 95 Cb 0.24 -1.41 -0.01 0.00 0.11 0.00 0.00 30.24 29.16 2b3b n GLN 95 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2b3b n ALA 96 N 1.07 4.14 -2.59 -1.58 0.00 -0.37 -4.94 120.51 116.24 2b3b n ALA 96 Ca 0.18 -0.50 -0.18 0.00 0.00 0.00 0.00 53.44 52.94 2b3b n ALA 96 Cb 0.52 -0.89 -0.11 0.00 0.00 0.00 0.00 19.45 18.97 2b3b n ALA 96 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2b3b s PHE 97 N -3.06 1.26 0.49 0.00 0.08 -1.23 -0.60 117.98 114.92 2b3b s PHE 97 Ca 0.07 -0.52 -0.23 0.00 0.12 0.00 0.00 56.93 56.36 2b3b s PHE 97 Cb 0.16 -0.69 -0.07 0.00 -0.57 0.00 0.00 43.02 41.85 2b3b s PHE 97 CO 0.82 0.08 1.30 -2.30 -0.10 0.00 0.00 175.22 175.02 2b3b n PRO 98 N 0.89 1.78 -0.20 0.24 -0.02 -1.26 -4.80 135.00 131.63 2b3b n PRO 98 Ca -0.18 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 2b3b n PRO 98 Cb 0.56 -2.47 0.24 0.00 -0.02 0.00 0.00 33.50 31.81 2b3b n PRO 98 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2b3b h LYS 99 N 1.70 0.96 -0.68 -0.52 3.64 -1.99 -1.12 116.57 118.55 2b3b h LYS 99 Ca -0.49 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 58.80 2b3b h LYS 99 Cb 1.30 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.88 2b3b h LYS 99 CO 0.58 0.66 0.37 0.78 -2.27 0.00 0.00 179.45 179.57 2b3b h GLY 100 N 1.00 1.01 1.30 5.01 0.00 -1.99 0.06 103.07 109.46 2b3b h GLY 100 Ca 0.26 -0.45 -0.19 0.00 0.00 0.00 0.00 47.33 46.95 2b3b h GLY 100 CO -0.05 0.43 -0.63 -2.00 0.00 0.00 0.00 176.54 174.29 2b3b h LEU 101 N 0.95 0.82 -0.58 3.11 5.85 -1.70 -2.19 115.31 121.57 2b3b h LEU 101 Ca 0.24 -0.48 0.04 0.00 0.84 0.00 0.00 57.88 58.53 2b3b h LEU 101 Cb 0.03 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.78 2b3b h LEU 101 CO -0.04 1.25 0.33 0.40 -0.34 0.00 0.00 178.44 180.04 2b3b h ILE 102 N 0.53 1.00 -0.53 4.05 1.08 -0.91 -2.24 117.51 120.49 2b3b h ILE 102 Ca -0.01 -0.22 -0.01 0.00 -0.39 0.00 0.00 64.86 64.23 2b3b h ILE 102 Cb 1.23 0.31 -0.03 0.00 -3.07 0.00 0.00 36.82 35.26 2b3b h ILE 102 CO 0.13 0.12 0.27 0.44 -0.69 0.00 0.00 178.15 178.42 2b3b h ASP 103 N 0.63 0.66 -0.02 1.72 3.32 -0.81 -2.60 116.42 119.32 2b3b h ASP 103 Ca 0.25 -0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.18 2b3b h ASP 103 Cb 0.11 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 2b3b h ASP 103 CO -0.14 0.55 -0.15 0.25 -1.72 0.00 0.00 179.24 178.03 2b3b h LEU 104 N 0.74 0.33 -1.40 1.55 5.85 -0.81 -2.87 115.31 118.71 2b3b h LEU 104 Ca 0.19 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.83 2b3b h LEU 104 Cb 0.05 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.00 2b3b h LEU 104 CO -0.03 0.51 0.00 2.30 -0.34 0.00 0.00 178.44 180.88 2b3b n ILE 105 N -4.22 0.09 -4.06 4.05 -5.35 -1.01 -2.12 119.36 106.74 2b3b n ILE 105 Ca -0.00 -0.39 -0.34 0.00 -0.27 0.00 0.00 62.75 61.75 2b3b n ILE 105 Cb 0.31 0.80 -0.07 0.00 -1.74 0.00 0.00 39.64 38.94 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 -1.87 5.86 -0.27 7.28 0.01 -1.02 -1.32 113.70 122.38 2b3b s SER 106 Ca 0.34 0.23 -0.22 0.00 1.31 0.00 0.00 55.95 57.60 2b3b s SER 106 Cb 0.20 -1.74 0.07 0.00 0.21 0.00 0.00 66.02 64.76 2b3b s SER 106 CO 0.31 0.30 0.72 -0.47 0.41 0.00 0.00 173.24 174.51 2b3b s TYR 107 N -1.17 -0.86 -1.70 2.43 5.04 -0.49 -4.94 117.35 115.65 2b3b s TYR 107 Ca 0.22 1.96 -0.12 0.00 -2.44 0.00 0.00 57.07 56.69 2b3b s TYR 107 Cb -0.12 0.37 0.12 0.00 0.35 0.00 0.00 41.96 42.68 2b3b s TYR 107 CO 0.13 -0.42 0.36 1.63 -1.34 0.00 0.00 175.55 175.91 2b3b n LYS 108 N 3.13 -1.19 0.00 4.97 4.76 -1.26 -0.78 118.16 127.79 2b3b n LYS 108 Ca -0.16 0.16 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2b3b n LYS 108 Cb 0.56 -4.28 0.00 0.00 -1.84 0.00 0.00 35.03 29.47 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 -1.77 2.97 3.91 0.72 0.00 -1.26 -5.03 105.19 104.73 2b3b n GLY 109 Ca -0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.60 1.53 -0.15 -0.02 0.00 0.04 -5.02 107.32 102.11 2b3b s GLY 110 Ca 0.00 -0.56 0.02 0.00 0.00 0.00 0.00 44.72 44.18 2b3b s GLY 110 CO 0.00 -0.36 -0.20 -0.42 0.00 0.00 0.00 173.10 172.12 2b3b s ILE 111 N -2.81 2.27 -0.30 0.90 1.01 -1.26 -1.39 121.20 119.62 2b3b s ILE 111 Ca 0.49 -0.91 0.07 0.00 0.00 0.00 0.00 60.65 60.31 2b3b s ILE 111 Cb -0.10 -1.93 -0.09 0.00 0.01 0.00 0.00 42.46 40.35 2b3b s ILE 111 CO 0.45 0.54 0.29 0.79 0.00 0.00 0.00 174.94 177.01 2b3b n TRP 112 N 4.08 0.00 -3.97 3.97 7.02 -0.44 0.02 117.44 128.13 2b3b n TRP 112 Ca -0.20 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.19 2b3b n TRP 112 Cb 0.52 -0.03 -0.04 0.00 -2.42 0.00 0.00 31.31 29.34 2b3b n TRP 112 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 2b3b s SER 113 N -1.89 0.00 -0.26 -0.99 1.04 -1.26 -4.49 113.70 105.85 2b3b s SER 113 Ca 0.02 -0.95 -0.04 0.00 0.48 0.00 0.00 55.95 55.46 2b3b s SER 113 Cb 0.06 0.65 0.02 0.00 0.10 0.00 0.00 66.02 66.84 2b3b s SER 113 CO 0.31 -1.25 -0.01 -0.69 0.98 0.00 0.00 173.24 172.58 2b3b s VAL 114 N -3.73 3.31 0.13 5.02 1.01 0.15 -4.92 120.40 121.37 2b3b s VAL 114 Ca 0.21 -0.86 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 2b3b s VAL 114 Cb -0.02 -2.68 -0.06 0.00 0.00 0.00 0.00 36.38 33.62 2b3b s VAL 114 CO 0.10 0.17 1.05 -2.16 0.00 0.00 0.00 175.10 174.27 2b3b s PRO 115 N 1.40 4.61 -0.02 2.72 0.04 -1.26 -1.65 135.00 140.84 2b3b s PRO 115 Ca 0.01 1.61 0.22 0.00 0.04 0.00 0.00 61.00 62.88 2b3b s PRO 115 Cb -0.17 -3.33 -0.33 0.00 0.04 0.00 0.00 34.50 30.71 2b3b s PRO 115 CO -0.02 0.08 0.51 1.55 0.04 0.00 0.00 177.00 179.16 2b3b n VAL 116 N 2.79 0.01 -3.82 -0.36 3.14 -0.00 -4.70 118.33 115.39 2b3b n VAL 116 Ca 0.03 -0.48 -0.08 0.00 -2.96 0.00 0.00 64.34 60.86 2b3b n VAL 116 Cb 0.48 0.04 0.02 0.00 -1.06 0.00 0.00 33.84 33.32 2b3b n VAL 116 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2b3b s ASN 117 N -4.47 0.01 -0.08 6.55 2.20 -1.23 -4.01 114.94 113.92 2b3b s ASN 117 Ca -0.07 -1.10 -0.00 0.00 -0.94 0.00 0.00 52.86 50.75 2b3b s ASN 117 Cb 0.14 0.81 0.02 0.00 -2.00 0.00 0.00 41.25 40.22 2b3b s ASN 117 CO 0.91 -1.60 -0.05 -0.63 -2.94 0.00 0.00 177.10 172.78 2b3b s ILE 118 N -2.23 0.72 0.16 0.54 -1.09 0.72 -4.18 121.20 115.84 2b3b s ILE 118 Ca 0.17 -0.14 0.05 0.00 -2.23 0.00 0.00 60.65 58.50 2b3b s ILE 118 Cb -0.05 -0.78 -0.04 0.00 -1.58 0.00 0.00 42.46 40.01 2b3b s ILE 118 CO 0.11 0.30 0.10 -1.00 -1.23 0.00 0.00 174.94 173.22 2b3b s HIS 119 N 1.55 3.09 -0.10 3.97 3.76 -0.38 -1.14 115.29 126.03 2b3b s HIS 119 Ca 0.00 -0.03 -0.01 0.00 -0.15 0.00 0.00 55.06 54.87 2b3b s HIS 119 Cb -0.13 -1.50 -0.03 0.00 1.11 0.00 0.00 32.58 32.04 2b3b s HIS 119 CO -0.04 0.52 -0.07 0.50 -0.85 0.00 0.00 174.74 174.79 2b3b s ARG 120 N -3.01 3.11 -0.14 1.40 3.52 -1.26 -1.59 118.95 120.98 2b3b s ARG 120 Ca 0.30 -0.56 -0.15 0.00 -0.13 0.00 0.00 55.73 55.19 2b3b s ARG 120 Cb -0.10 -2.69 -0.25 0.00 -1.56 0.00 0.00 34.95 30.36 2b3b s ARG 120 CO 0.22 0.47 0.40 1.03 -0.81 0.00 0.00 175.30 176.62 2b3b h SER 121 N 5.89 0.28 -1.79 -2.12 0.87 -1.12 -2.19 113.55 113.36 2b3b h SER 121 Ca -0.40 -0.79 -0.77 0.00 -1.23 0.00 0.00 61.79 58.60 2b3b h SER 121 Cb 1.18 -0.09 -0.19 0.00 -0.44 0.00 0.00 62.40 62.86 2b3b h SER 121 CO 0.56 1.65 1.71 -0.46 -0.53 0.00 0.00 176.83 179.76 2b3b n ASN 122 N -3.94 6.21 -4.23 6.23 6.94 -1.26 -3.52 115.26 121.70 2b3b n ASN 122 Ca -0.29 -3.25 -0.29 0.00 -0.02 0.00 0.00 54.58 50.74 2b3b n ASN 122 Cb 0.88 -1.38 -0.16 0.00 -2.36 0.00 0.00 39.78 36.77 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 -1.14 1.77 -0.20 3.53 1.01 -1.25 -1.06 120.40 123.06 2b3b s VAL 123 Ca 0.40 -0.93 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 2b3b s VAL 123 Cb 0.11 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 2b3b s VAL 123 CO 0.00 0.50 0.02 -0.32 0.00 0.00 0.00 175.10 175.30 2b3b s MET 124 N -0.27 3.72 0.00 2.72 1.75 0.12 -1.78 119.30 125.57 2b3b s MET 124 Ca 0.02 -0.47 0.01 0.00 -1.25 0.00 0.00 55.69 53.99 2b3b s MET 124 Cb -0.11 -3.14 -0.04 0.00 2.84 0.00 0.00 34.83 34.39 2b3b s MET 124 CO 0.01 0.07 0.05 -1.58 -0.65 0.00 0.00 175.02 172.92 2b3b s TRP 125 N 0.88 3.20 0.20 4.11 0.52 0.12 -1.69 118.94 126.28 2b3b s TRP 125 Ca 0.02 0.15 -0.23 0.00 0.02 0.00 0.00 56.10 56.06 2b3b s TRP 125 Cb -0.14 -1.70 0.05 0.00 -1.15 0.00 0.00 33.47 30.52 2b3b s TRP 125 CO 0.02 0.52 0.79 1.52 0.02 0.00 0.00 176.95 179.82 2b3b s TYR 126 N -1.17 -0.24 -0.37 -1.98 -0.85 -0.89 -2.42 117.35 109.42 2b3b s TYR 126 Ca 0.22 -0.11 -0.08 0.00 -0.52 0.00 0.00 57.07 56.58 2b3b s TYR 126 Cb -0.12 0.65 0.05 0.00 0.38 0.00 0.00 41.96 42.92 2b3b s TYR 126 CO 0.13 -1.00 0.18 -0.51 -1.52 0.00 0.00 175.55 172.83 2b3b s LEU 127 N -2.86 4.67 0.35 -3.49 1.02 -1.26 -0.34 118.68 116.76 2b3b s LEU 127 Ca 0.09 -1.20 0.13 0.00 0.02 0.00 0.00 54.13 53.17 2b3b s LEU 127 Cb -0.03 -1.94 0.95 0.00 0.02 0.00 0.00 46.19 45.18 2b3b s LEU 127 CO 0.01 -0.40 1.76 -0.65 0.02 0.00 0.00 176.35 177.09 2b3b h PRO 128 N 8.33 0.53 -0.36 1.29 0.11 -1.87 -0.95 132.00 139.07 2b3b h PRO 128 Ca -0.24 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.74 2b3b h PRO 128 Cb 1.09 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 2b3b h PRO 128 CO 0.66 0.35 -0.21 0.00 -0.21 0.00 0.00 178.00 178.59 2b3b h ALA 129 N 1.66 0.96 -0.23 -0.75 0.00 -1.94 -1.02 119.26 117.94 2b3b h ALA 129 Ca 0.60 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 2b3b h ALA 129 Cb 1.25 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2b3b h ALA 129 CO -0.37 0.61 -0.30 0.87 0.00 0.00 0.00 179.25 180.06 2b3b h LYS 130 N 0.61 0.61 -0.65 0.00 1.79 -1.63 -1.92 116.57 115.39 2b3b h LYS 130 Ca 0.09 -0.35 -0.03 0.00 -2.18 0.00 0.00 60.65 58.17 2b3b h LYS 130 Cb 0.69 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 31.34 2b3b h LYS 130 CO 0.05 0.96 0.27 -0.07 -1.08 0.00 0.00 179.45 179.58 2b3b h LEU 131 N 0.31 0.89 -0.22 2.94 3.38 -1.26 -0.96 115.31 120.39 2b3b h LEU 131 Ca 0.03 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.85 2b3b h LEU 131 Cb 0.88 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2b3b h LEU 131 CO 0.07 0.81 0.08 0.50 0.09 0.00 0.00 178.44 179.99 2b3b h LYS 132 N 0.91 0.18 -0.89 1.13 3.64 -1.21 0.78 116.57 121.12 2b3b h LYS 132 Ca 0.22 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.65 2b3b h LYS 132 Cb 0.19 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 31.91 2b3b h LYS 132 CO -0.02 0.12 0.58 0.78 -2.27 0.00 0.00 179.45 178.64 2b3b h GLY 133 N 0.19 1.29 1.65 5.01 0.00 -1.04 -2.03 103.07 108.13 2b3b h GLY 133 Ca 0.10 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2b3b h GLY 133 CO -0.09 0.30 -0.20 0.79 0.00 0.00 0.00 176.54 177.33 2b3b n TRP 134 N -4.48 0.22 -2.29 5.60 8.01 -0.39 -4.94 117.44 119.17 2b3b n TRP 134 Ca 0.13 0.06 -0.03 0.00 -1.31 0.00 0.00 57.50 56.36 2b3b n TRP 134 Cb 0.19 -0.53 0.00 0.00 -2.01 0.00 0.00 31.31 28.97 2b3b n TRP 134 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2b3b n GLY 135 N 1.45 0.44 3.28 6.99 0.00 0.05 -5.02 105.19 112.39 2b3b n GLY 135 Ca 0.06 -0.68 -0.19 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.50 1.53 0.25 1.61 -7.23 0.02 -5.02 120.40 109.05 2b3b s VAL 136 Ca 0.03 -1.87 0.06 0.00 -1.81 0.00 0.00 61.98 58.39 2b3b s VAL 136 Cb -0.01 -1.72 -0.03 0.00 0.56 0.00 0.00 36.38 35.18 2b3b s VAL 136 CO 0.04 -0.43 0.32 0.20 -0.31 0.00 0.00 175.10 174.92 2b3b s ASN 137 N -2.68 6.08 0.06 4.85 0.02 -1.26 -4.23 114.94 117.77 2b3b s ASN 137 Ca 0.13 -0.03 -0.31 0.00 -1.02 0.00 0.00 52.86 51.64 2b3b s ASN 137 Cb -0.04 -1.70 -0.08 0.00 0.02 0.00 0.00 41.25 39.45 2b3b s ASN 137 CO 0.04 -0.08 1.61 -2.84 0.02 0.00 0.00 177.10 175.86 2b3b s PRO 138 N -3.95 4.21 0.18 -0.60 0.02 -1.26 -4.95 135.00 128.65 2b3b s PRO 138 Ca 0.34 2.27 -0.30 0.00 0.02 0.00 0.00 61.00 63.33 2b3b s PRO 138 Cb -0.09 -3.60 -0.08 0.00 0.02 0.00 0.00 34.50 30.75 2b3b s PRO 138 CO 0.28 -0.71 1.24 -1.25 -0.33 0.00 0.00 177.00 176.23 2b3b s PRO 139 N 2.63 4.45 0.00 5.54 0.04 -1.26 -4.93 135.00 141.47 2b3b s PRO 139 Ca 0.72 1.93 0.22 0.00 0.04 0.00 0.00 61.00 63.91 2b3b s PRO 139 Cb -0.38 -3.23 -0.13 0.00 0.04 0.00 0.00 34.50 30.79 2b3b s PRO 139 CO 0.31 -0.16 0.92 0.54 0.04 0.00 0.00 177.00 178.66 2b3b n ARG 140 N 2.64 0.10 -4.16 4.56 1.74 -1.26 -4.50 116.66 115.78 2b3b n ARG 140 Ca 0.05 -0.02 -0.10 0.00 -0.77 0.00 0.00 57.85 57.01 2b3b n ARG 140 Cb 0.44 -1.51 -0.10 0.00 -1.02 0.00 0.00 32.46 30.27 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 -3.07 0.59 0.34 0.55 -4.23 -1.26 -0.84 115.64 107.72 2b3b s THR 141 Ca 0.06 -1.92 0.05 0.00 -1.18 0.00 0.00 61.69 58.71 2b3b s THR 141 Cb 0.16 -1.70 0.15 0.00 1.34 0.00 0.00 72.50 72.45 2b3b s THR 141 CO 0.85 -0.86 1.87 -0.50 -0.54 0.00 0.00 174.62 175.45 2b3b h TRP 142 N 2.98 0.49 -0.00 3.99 4.06 -1.93 -0.34 115.95 125.19 2b3b h TRP 142 Ca -0.35 -0.05 0.00 0.00 2.06 0.00 0.00 58.89 60.55 2b3b h TRP 142 Cb 1.16 -0.14 -0.00 0.00 -1.00 0.00 0.00 29.16 29.18 2b3b h TRP 142 CO 0.57 0.51 -0.02 -0.44 -3.56 0.00 0.00 178.44 175.50 2b3b h ASP 143 N 0.45 -0.05 -0.04 -3.49 3.32 -1.99 -0.79 116.42 113.82 2b3b h ASP 143 Ca 0.09 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.08 2b3b h ASP 143 Cb 0.35 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2b3b h ASP 143 CO 0.01 -0.03 -0.17 0.11 -1.72 0.00 0.00 179.24 177.44 2b3b h LYS 144 N -0.03 0.40 -0.08 3.56 1.57 -1.89 -2.24 116.57 117.85 2b3b h LYS 144 Ca 0.01 -0.12 0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2b3b h LYS 144 Cb 0.04 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2b3b h LYS 144 CO -0.02 0.56 0.02 0.35 -0.57 0.00 0.00 179.45 179.79 2b3b h PHE 145 N 0.37 0.03 -0.39 -1.35 3.57 -0.76 0.19 116.94 118.60 2b3b h PHE 145 Ca 0.07 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 2b3b h PHE 145 Cb 0.52 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 2b3b h PHE 145 CO 0.01 0.02 0.22 -0.07 -2.23 0.00 0.00 178.31 176.26 2b3b h LEU 146 N 0.06 0.48 -0.36 0.59 3.38 -0.83 0.68 115.31 119.31 2b3b h LEU 146 Ca 0.04 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2b3b h LEU 146 Cb 0.03 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2b3b h LEU 146 CO -0.04 0.42 0.12 0.00 0.09 0.00 0.00 178.44 179.02 2b3b h ALA 147 N 1.08 0.47 -0.69 1.53 0.00 -1.35 -1.09 119.26 119.23 2b3b h ALA 147 Ca 0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2b3b h ALA 147 Cb 0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2b3b h ALA 147 CO -0.02 0.11 0.35 1.15 0.00 0.00 0.00 179.25 180.84 2b3b h THR 148 N 0.44 1.22 -0.57 0.00 2.02 -0.81 -1.58 112.91 113.61 2b3b h THR 148 Ca 0.12 -0.58 -0.08 0.00 0.77 0.00 0.00 66.41 66.64 2b3b h THR 148 Cb 0.25 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 2b3b h THR 148 CO -0.00 0.25 0.05 0.00 0.37 0.00 0.00 175.52 176.18 2b3b h GLN 150 N 0.87 0.31 -0.79 0.00 5.75 -0.79 -0.71 115.11 119.75 2b3b h GLN 150 Ca 0.17 -0.02 0.11 0.00 -0.15 0.00 0.00 58.65 58.76 2b3b h GLN 150 Cb 0.48 -0.07 -0.08 0.00 1.07 0.00 0.00 27.48 28.88 2b3b h GLN 150 CO 0.02 0.21 0.42 1.15 -2.65 0.00 0.00 178.83 177.97 2b3b h THR 151 N 0.32 0.83 -0.23 2.39 2.02 -1.10 -2.43 112.91 114.71 2b3b h THR 151 Ca 0.13 -0.23 -0.11 0.00 0.77 0.00 0.00 66.41 66.97 2b3b h THR 151 Cb 0.04 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.54 2b3b h THR 151 CO -0.09 0.12 -0.33 -0.07 0.37 0.00 0.00 175.52 175.52 2b3b h LEU 152 N 0.67 0.50 -1.20 2.58 3.38 -0.70 -1.99 115.31 118.56 2b3b h LEU 152 Ca 0.40 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 2b3b h LEU 152 Cb 0.45 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 2b3b h LEU 152 CO -0.29 0.80 0.28 0.11 0.09 0.00 0.00 178.44 179.43 2b3b h LYS 153 N 0.42 0.84 0.00 1.13 1.57 -0.76 -1.52 116.57 118.25 2b3b h LYS 153 Ca 0.05 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 2b3b h LYS 153 Cb 0.78 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.93 2b3b h LYS 153 CO 0.06 0.66 -0.09 1.96 -0.57 0.00 0.00 179.45 181.47 2b3b h GLN 154 N 0.84 0.00 -0.50 3.15 4.20 -0.91 -1.23 115.11 120.66 2b3b h GLN 154 Ca 0.21 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.92 2b3b h GLN 154 Cb 0.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.88 2b3b h GLN 154 CO -0.03 0.09 0.00 1.63 -0.67 0.00 0.00 178.83 179.85 2b3b n LYS 155 N -3.25 2.23 -0.37 1.46 5.02 -0.66 -4.93 118.16 117.65 2b3b n LYS 155 Ca -0.00 -1.76 0.00 0.00 -2.02 0.00 0.00 58.31 54.53 2b3b n LYS 155 Cb 0.32 -1.43 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 1.19 0.72 3.44 0.72 0.00 -0.46 -5.02 105.19 105.79 2b3b n GLY 156 Ca 0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 2b3b n GLY 156 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2b3b s LEU 157 N 0.00 4.98 0.45 0.99 2.96 -0.69 -4.89 118.68 122.48 2b3b s LEU 157 Ca 0.00 -1.76 0.22 0.00 -0.22 0.00 0.00 54.13 52.37 2b3b s LEU 157 Cb 0.00 -2.39 1.05 0.00 0.50 0.00 0.00 46.19 45.35 2b3b s LEU 157 CO 0.00 -1.14 1.91 1.05 -1.32 0.00 0.00 176.35 176.85 2b3b h GLU 158 N 9.01 0.00 -2.51 1.98 4.11 -1.85 -3.19 114.58 122.14 2b3b h GLU 158 Ca 0.01 0.00 -0.60 0.00 0.07 0.00 0.00 59.36 58.84 2b3b h GLU 158 Cb 1.04 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.90 2b3b h GLU 158 CO 1.11 0.24 -0.87 0.00 0.07 0.00 0.00 179.01 179.57 2b3b n ALA 159 N -2.31 3.02 0.28 1.06 0.00 -1.26 -4.87 120.51 116.43 2b3b n ALA 159 Ca -0.01 -3.59 0.14 0.00 0.00 0.00 0.00 53.44 49.98 2b3b n ALA 159 Cb 0.36 -0.84 0.80 0.00 0.00 0.00 0.00 19.45 19.77 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 5.34 0.00 -5.21 0.00 0.11 -1.58 -3.40 132.00 127.26 2b3b h PRO 160 Ca 0.22 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.69 2b3b h PRO 160 Cb 0.85 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 31.81 2b3b h PRO 160 CO 0.49 0.08 -0.10 -1.17 -0.21 0.00 0.00 178.00 177.09 2b3b s LEU 161 N -7.16 4.26 0.16 2.35 2.96 -0.19 -0.58 118.68 120.47 2b3b s LEU 161 Ca -0.03 0.09 -0.30 0.00 -0.22 0.00 0.00 54.13 53.67 2b3b s LEU 161 Cb 0.13 -2.54 -0.07 0.00 0.50 0.00 0.00 46.19 44.21 2b3b s LEU 161 CO 0.56 -0.38 1.07 0.00 -1.32 0.00 0.00 176.35 176.28 2b3b s ALA 162 N 2.28 3.34 -0.03 5.97 0.00 0.48 -2.48 121.76 131.32 2b3b s ALA 162 Ca 0.18 0.76 -0.12 0.00 0.00 0.00 0.00 51.96 52.78 2b3b s ALA 162 Cb -0.16 -3.34 0.02 0.00 0.00 0.00 0.00 23.12 19.64 2b3b s ALA 162 CO 0.12 -0.18 0.27 -1.17 0.00 0.00 0.00 175.76 174.80 2b3b s LEU 163 N -0.21 1.01 0.00 0.00 2.96 -1.26 -4.55 118.68 116.62 2b3b s LEU 163 Ca 0.49 0.12 0.00 0.00 -0.22 0.00 0.00 54.13 54.53 2b3b s LEU 163 Cb -0.28 1.09 0.00 0.00 0.50 0.00 0.00 46.19 47.50 2b3b s LEU 163 CO 0.33 -0.36 0.00 0.61 -1.32 0.00 0.00 176.35 175.61 2b3b n GLY 164 N 1.64 4.92 3.41 7.98 0.00 -1.26 -4.42 105.19 117.46 2b3b n GLY 164 Ca -0.20 -1.81 -0.30 0.00 0.00 0.00 0.00 46.02 43.71 2b3b n GLY 164 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2b3b n GLU 165 N 0.00 -1.78 -0.35 1.61 0.28 0.47 -4.14 120.64 116.74 2b3b n GLU 165 Ca 0.00 -0.49 0.08 0.00 -0.16 0.00 0.00 57.16 56.59 2b3b n GLU 165 Cb 0.00 -1.99 0.18 0.00 1.43 0.00 0.00 31.44 31.06 2b3b n GLU 165 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2b3b n ASN 166 N -3.38 -0.28 0.16 -1.84 2.85 -1.26 -0.30 115.26 111.20 2b3b n ASN 166 Ca 0.03 1.67 0.02 0.00 -0.11 0.00 0.00 54.58 56.19 2b3b n ASN 166 Cb 0.57 -0.53 0.35 0.00 1.24 0.00 0.00 39.78 41.41 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 0.11 0.00 1.20 5.08 -1.97 -1.38 115.95 118.99 2b3b h TRP 167 Ca 0.50 -0.02 -0.05 0.00 1.08 0.00 0.00 58.89 60.40 2b3b h TRP 167 Cb 0.85 -0.03 -0.01 0.00 -3.00 0.00 0.00 29.16 26.98 2b3b h TRP 167 CO -0.68 0.40 -0.23 1.79 -1.28 0.00 0.00 178.44 178.44 2b3b h THR 168 N 0.09 0.63 -0.11 0.12 1.35 -0.95 -0.25 112.91 113.79 2b3b h THR 168 Ca 0.01 -1.07 -0.08 0.00 -0.55 0.00 0.00 66.41 64.72 2b3b h THR 168 Cb 0.59 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 68.71 2b3b h THR 168 CO 0.04 0.23 -0.23 1.56 -0.25 0.00 0.00 175.52 176.87 2b3b h GLN 169 N 0.00 0.36 -0.95 4.72 4.20 -0.89 -0.99 115.11 121.56 2b3b h GLN 169 Ca -0.00 -0.23 0.10 0.00 0.06 0.00 0.00 58.65 58.58 2b3b h GLN 169 Cb 0.69 0.03 -0.08 0.00 0.30 0.00 0.00 27.48 28.42 2b3b h GLN 169 CO 0.03 0.83 0.59 1.96 -0.67 0.00 0.00 178.83 181.57 2b3b h GLN 170 N -0.07 0.95 -0.27 1.46 4.20 -1.11 0.12 115.11 120.39 2b3b h GLN 170 Ca 0.00 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 2b3b h GLN 170 Cb 0.82 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.37 2b3b h GLN 170 CO 0.05 0.63 0.14 1.25 -0.67 0.00 0.00 178.83 180.23 2b3b h HIS 171 N 0.97 0.38 -0.67 2.96 2.76 -0.92 -0.76 115.15 119.88 2b3b h HIS 171 Ca 0.46 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.65 2b3b h HIS 171 Cb 0.39 -0.12 -0.05 0.00 1.55 0.00 0.00 27.41 29.18 2b3b h HIS 171 CO -0.02 0.34 0.40 1.25 -1.30 0.00 0.00 177.93 178.60 2b3b h LEU 172 N 0.32 0.64 -0.78 0.26 5.85 -0.89 -2.88 115.31 117.83 2b3b h LEU 172 Ca 0.10 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.88 2b3b h LEU 172 Cb 0.09 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.94 2b3b h LEU 172 CO -0.01 0.43 0.48 -0.25 -0.34 0.00 0.00 178.44 178.74 2b3b h TRP 173 N 0.77 0.88 -0.25 1.25 7.01 -0.21 -2.31 115.95 123.08 2b3b h TRP 173 Ca 0.28 0.03 -0.08 0.00 2.11 0.00 0.00 58.89 61.23 2b3b h TRP 173 Cb 0.08 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 26.84 2b3b h TRP 173 CO -0.06 0.46 -0.17 1.05 -2.79 0.00 0.00 178.44 176.94 2b3b h GLU 174 N 0.89 0.44 -0.24 2.65 4.11 -0.94 0.78 114.58 122.27 2b3b h GLU 174 Ca 0.33 -0.14 -0.03 0.00 0.07 0.00 0.00 59.36 59.60 2b3b h GLU 174 Cb 0.13 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2b3b h GLU 174 CO -0.16 0.60 0.04 0.77 0.07 0.00 0.00 179.01 180.34 2b3b h SER 175 N 0.41 0.38 -0.13 3.06 0.02 -1.47 -1.40 113.55 114.41 2b3b h SER 175 Ca 0.07 -0.26 0.04 0.00 -0.84 0.00 0.00 61.79 60.80 2b3b h SER 175 Cb 0.53 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.94 2b3b h SER 175 CO 0.03 0.54 -0.09 0.58 -1.14 0.00 0.00 176.83 176.75 2b3b h VAL 176 N 0.20 0.73 -0.91 2.27 2.07 -0.91 -0.64 116.25 119.05 2b3b h VAL 176 Ca 0.07 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.62 2b3b h VAL 176 Cb 0.32 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 30.76 2b3b h VAL 176 CO 0.00 0.00 0.60 0.00 0.02 0.00 0.00 177.57 178.19 2b3b h ALA 177 N 1.01 1.19 -0.57 1.67 0.00 -0.86 0.98 119.26 122.68 2b3b h ALA 177 Ca 0.08 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2b3b h ALA 177 Cb 0.22 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2b3b h ALA 177 CO -0.19 0.49 0.21 1.25 0.00 0.00 0.00 179.25 181.01 2b3b h LEU 178 N 1.18 0.81 -0.51 0.00 5.85 -0.94 0.12 115.31 121.81 2b3b h LEU 178 Ca 0.35 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 2b3b h LEU 178 Cb -0.05 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.74 2b3b h LEU 178 CO -0.10 0.78 0.23 0.00 -0.34 0.00 0.00 178.44 179.00 2b3b h ALA 179 N 1.06 0.66 -0.20 1.25 0.00 -0.17 -0.99 119.26 120.88 2b3b h ALA 179 Ca 0.19 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.77 2b3b h ALA 179 Cb 0.24 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2b3b h ALA 179 CO -0.01 0.25 -0.64 0.28 0.00 0.00 0.00 179.25 179.13 2b3b h VAL 180 N 0.69 1.30 0.00 0.00 2.07 -0.66 -3.34 116.25 116.30 2b3b h VAL 180 Ca 0.17 -1.87 -0.28 0.00 0.82 0.00 0.00 66.70 65.55 2b3b h VAL 180 Cb 0.16 1.83 -0.05 0.00 -1.52 0.00 0.00 31.29 31.70 2b3b h VAL 180 CO -0.02 0.59 -1.84 0.18 0.02 0.00 0.00 177.57 176.51 2b3b n LEU 181 N -3.95 0.61 0.00 2.57 4.77 0.39 -5.01 117.00 116.37 2b3b n LEU 181 Ca -0.05 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 2b3b n LEU 181 Cb 0.67 0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.99 2b3b n LEU 181 CO 0.50 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.52 2b3b n GLY 182 N 1.56 -1.96 0.30 -0.72 0.00 -0.38 -4.24 105.19 99.75 2b3b n GLY 182 Ca -0.19 -1.51 -0.02 0.00 0.00 0.00 0.00 46.02 44.29 2b3b n GLY 182 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2b3b h PRO 183 N 0.00 0.78 -0.35 1.61 0.13 -1.95 -0.29 132.00 131.93 2b3b h PRO 183 Ca 0.00 -0.16 -0.11 0.00 -0.87 0.00 0.00 66.00 64.86 2b3b h PRO 183 Cb 0.00 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.01 2b3b h PRO 183 CO 0.00 0.71 -0.23 -0.44 -0.23 0.00 0.00 178.00 177.82 2b3b h ASP 184 N 0.75 0.80 0.81 1.44 3.32 -1.98 -0.79 116.42 120.78 2b3b h ASP 184 Ca 0.16 -0.43 -0.17 0.00 0.02 0.00 0.00 57.03 56.62 2b3b h ASP 184 Cb 0.30 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 2b3b h ASP 184 CO 0.00 1.06 -0.81 0.44 -1.72 0.00 0.00 179.24 178.21 2b3b h ASP 185 N 0.55 0.00 0.03 6.45 3.32 -1.72 -0.77 116.42 124.28 2b3b h ASP 185 Ca 0.07 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.15 2b3b h ASP 185 Cb 0.78 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.29 2b3b h ASP 185 CO 0.06 0.81 -0.33 -0.25 -1.72 0.00 0.00 179.24 177.81 2b3b h TRP 186 N 0.00 -0.90 -0.79 4.55 2.91 -0.87 -2.29 115.95 118.56 2b3b h TRP 186 Ca -0.01 0.03 0.09 0.00 1.13 0.00 0.00 58.89 60.13 2b3b h TRP 186 Cb 1.43 0.39 -0.05 0.00 -0.51 0.00 0.00 29.16 30.42 2b3b h TRP 186 CO 0.00 -0.42 0.52 -0.91 -1.03 0.00 0.00 178.44 176.59 2b3b h ASN 187 N -0.50 0.67 0.65 2.65 2.35 -0.96 -1.90 115.58 118.54 2b3b h ASN 187 Ca 0.05 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 2b3b h ASN 187 Cb 0.57 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.82 2b3b h ASN 187 CO -0.25 0.40 -0.03 0.78 -1.65 0.00 0.00 177.43 176.68 2b3b h ASN 188 N 0.74 0.00 -0.84 5.81 2.35 -0.57 -1.61 115.58 121.45 2b3b h ASN 188 Ca 0.36 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.09 2b3b h ASN 188 Cb 0.42 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.75 2b3b h ASN 188 CO -0.14 0.03 0.43 -0.07 -1.65 0.00 0.00 177.43 176.03 2b3b h LEU 189 N 0.00 1.09 0.00 1.61 3.38 -1.04 -0.09 115.31 120.26 2b3b h LEU 189 Ca -0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2b3b h LEU 189 Cb 0.36 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2b3b h LEU 189 CO 0.00 0.90 -0.90 -0.50 0.09 0.00 0.00 178.44 178.03 2b3b h TRP 190 N 1.20 0.00 -0.08 1.13 4.06 -1.40 -3.04 115.95 117.81 2b3b h TRP 190 Ca 0.29 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.24 2b3b h TRP 190 Cb 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.24 2b3b h TRP 190 CO 0.01 0.00 0.00 0.27 -3.56 0.00 0.00 178.44 175.16 2b3b n ASN 191 N -2.64 2.64 0.00 -3.49 0.23 -1.11 -4.05 115.26 106.84 2b3b n ASN 191 Ca 0.01 -1.87 0.00 0.00 -0.53 0.00 0.00 54.58 52.19 2b3b n ASN 191 Cb 0.54 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 38.20 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 1.32 0.57 0.10 4.83 0.00 -1.10 -4.79 105.19 106.12 2b3b n GLY 192 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 2b3b n GLY 192 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b3b h LYS 193 N 1.36 0.08 -5.17 1.61 1.57 -1.44 -3.43 116.57 111.15 2b3b h LYS 193 Ca 0.00 -0.10 -0.64 0.00 -1.87 0.00 0.00 60.65 58.04 2b3b h LYS 193 Cb 0.00 0.03 -0.22 0.00 0.08 0.00 0.00 32.23 32.12 2b3b h LYS 193 CO 0.00 0.94 -0.66 -1.17 -0.57 0.00 0.00 179.45 177.99 2b3b s LEU 194 N -7.11 3.27 0.44 2.94 2.96 -0.19 -5.00 118.68 115.99 2b3b s LEU 194 Ca -0.01 -0.18 -0.21 0.00 -0.22 0.00 0.00 54.13 53.52 2b3b s LEU 194 Cb 0.10 -1.82 -0.10 0.00 0.50 0.00 0.00 46.19 44.87 2b3b s LEU 194 CO 0.82 0.09 0.97 -0.54 -1.32 0.00 0.00 176.35 176.37 2b3b s LYS 195 N 0.83 4.14 0.54 1.98 -0.14 -1.26 -4.25 119.74 121.57 2b3b s LYS 195 Ca 0.00 1.16 0.30 0.00 -1.36 0.00 0.00 55.97 56.08 2b3b s LYS 195 Cb -0.14 -2.16 1.52 0.00 -1.68 0.00 0.00 37.83 35.37 2b3b s LYS 195 CO 0.02 -0.11 2.08 0.74 -0.76 0.00 0.00 175.35 177.32 2b3b h PHE 196 N 1.82 0.00 -0.01 3.18 0.04 -1.94 -2.33 116.94 117.70 2b3b h PHE 196 Ca -0.49 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.28 2b3b h PHE 196 Cb 1.19 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.34 2b3b h PHE 196 CO 0.61 0.10 -0.12 0.25 -0.60 0.00 0.00 178.31 178.54 2b3b n THR 197 N -3.49 0.00 -1.79 -1.55 -2.24 -1.26 -3.63 114.28 100.31 2b3b n THR 197 Ca -0.02 -0.10 -0.41 0.00 -2.27 0.00 0.00 64.05 61.25 2b3b n THR 197 Cb 0.24 0.09 -0.01 0.00 -2.10 0.00 0.00 70.33 68.55 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 -2.37 6.37 0.37 3.42 -1.08 -0.88 -4.76 116.67 117.74 2b3b s ASP 198 Ca 0.30 2.98 0.18 0.00 -0.52 0.00 0.00 52.55 55.50 2b3b s ASP 198 Cb 0.20 -2.65 1.17 0.00 -1.46 0.00 0.00 42.92 40.19 2b3b s ASP 198 CO 0.46 -0.89 1.66 -0.65 0.52 0.00 0.00 175.17 176.26 2b3b h PRO 199 N 4.21 0.26 -0.96 4.34 0.11 -1.90 0.24 132.00 138.29 2b3b h PRO 199 Ca -0.48 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.62 2b3b h PRO 199 Cb 1.23 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 32.23 2b3b h PRO 199 CO 0.74 0.17 0.64 0.87 -0.21 0.00 0.00 178.00 180.21 2b3b h LYS 200 N 0.26 1.26 0.08 1.05 1.57 -1.94 -1.47 116.57 117.38 2b3b h LYS 200 Ca 0.75 -0.08 -0.27 0.00 -1.87 0.00 0.00 60.65 59.18 2b3b h LYS 200 Cb 1.87 -0.28 0.02 0.00 0.08 0.00 0.00 32.23 33.91 2b3b h LYS 200 CO -0.55 0.83 -1.16 0.00 -0.57 0.00 0.00 179.45 178.01 2b3b h ALA 201 N 1.35 0.12 -0.85 3.86 0.00 -0.91 -3.16 119.26 119.66 2b3b h ALA 201 Ca 0.35 -0.77 0.09 0.00 0.00 0.00 0.00 54.91 54.58 2b3b h ALA 201 Cb -0.14 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 2b3b h ALA 201 CO -0.08 0.77 0.55 0.28 0.00 0.00 0.00 179.25 180.77 2b3b h VAL 202 N 0.24 0.99 0.00 0.00 2.07 -0.68 -2.43 116.25 116.44 2b3b h VAL 202 Ca -0.15 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.05 2b3b h VAL 202 Cb 1.82 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 31.64 2b3b h VAL 202 CO 0.21 0.16 -0.14 -0.09 0.02 0.00 0.00 177.57 177.72 2b3b h ARG 203 N 0.86 0.00 -0.76 1.57 2.43 -1.24 -1.57 114.38 115.67 2b3b h ARG 203 Ca 0.39 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.65 2b3b h ARG 203 Cb 0.37 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.84 2b3b h ARG 203 CO -0.15 0.14 0.40 0.00 -1.51 0.00 0.00 179.97 178.85 2b3b h ALA 204 N 1.86 1.06 -0.20 2.80 0.00 -1.51 -1.69 119.26 121.58 2b3b h ALA 204 Ca -0.00 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 2b3b h ALA 204 Cb 0.26 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2b3b h ALA 204 CO 0.02 0.01 -0.30 -1.49 0.00 0.00 0.00 179.25 177.49 2b3b h TRP 205 N 0.67 0.45 -0.01 0.00 4.06 -1.42 -0.43 115.95 119.28 2b3b h TRP 205 Ca 0.37 -0.10 -0.00 0.00 2.06 0.00 0.00 58.89 61.22 2b3b h TRP 205 Cb 0.38 -0.11 -0.00 0.00 -1.00 0.00 0.00 29.16 28.43 2b3b h TRP 205 CO -0.09 0.66 0.01 0.93 -3.56 0.00 0.00 178.44 176.39 2b3b h GLU 206 N 0.35 0.02 -0.36 0.49 5.08 -1.18 0.39 114.58 119.36 2b3b h GLU 206 Ca 0.05 -0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 2b3b h GLU 206 Cb 0.70 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 2b3b h GLU 206 CO 0.05 0.16 0.02 0.28 -1.00 0.00 0.00 179.01 178.52 2b3b h VAL 207 N -0.12 1.25 -0.51 3.13 2.07 -1.29 -2.82 116.25 117.96 2b3b h VAL 207 Ca 0.00 -0.93 0.06 0.00 0.82 0.00 0.00 66.70 66.66 2b3b h VAL 207 Cb 0.14 1.14 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 2b3b h VAL 207 CO -0.00 0.31 0.21 0.15 0.02 0.00 0.00 177.57 178.26 2b3b h PHE 208 N 0.45 0.37 -0.49 1.57 3.57 -1.00 -0.81 116.94 120.60 2b3b h PHE 208 Ca 0.11 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.71 2b3b h PHE 208 Cb 0.42 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 39.01 2b3b h PHE 208 CO 0.03 0.14 0.13 0.78 -2.23 0.00 0.00 178.31 177.16 2b3b h GLY 209 N 0.40 0.62 1.02 2.40 0.00 -0.78 0.36 103.07 107.09 2b3b h GLY 209 Ca 0.24 -0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.51 2b3b h GLY 209 CO -0.23 -0.04 0.51 3.21 0.00 0.00 0.00 176.54 180.00 2b3b h ARG 210 N 0.28 1.20 -0.66 4.80 3.08 -1.12 -2.62 114.38 119.34 2b3b h ARG 210 Ca 0.24 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 60.14 2b3b h ARG 210 Cb 0.30 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 2b3b h ARG 210 CO -0.29 0.85 0.26 0.28 -1.07 0.00 0.00 179.97 180.01 2b3b h VAL 211 N 1.21 1.24 -0.26 2.04 2.07 -0.52 -2.72 116.25 119.30 2b3b h VAL 211 Ca 0.31 -0.74 0.03 0.00 0.82 0.00 0.00 66.70 67.12 2b3b h VAL 211 Cb -0.02 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 2b3b h VAL 211 CO -0.06 0.30 0.18 -0.07 0.02 0.00 0.00 177.57 177.93 2b3b h LEU 212 N 0.93 0.20 0.00 2.57 3.38 -0.59 -1.01 115.31 120.80 2b3b h LEU 212 Ca 0.22 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2b3b h LEU 212 Cb 0.20 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2b3b h LEU 212 CO -0.02 0.14 0.00 0.47 0.09 0.00 0.00 178.44 179.12 2b3b n ASP 213 N -4.50 0.00 -0.48 -0.43 8.00 -1.03 -1.44 116.55 116.68 2b3b n ASP 213 Ca 0.02 -0.03 0.12 0.00 0.71 0.00 0.00 54.79 55.61 2b3b n ASP 213 Cb 0.16 -0.23 0.24 0.00 -0.02 0.00 0.00 41.12 41.27 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 -2.33 3.48 0.36 0.00 0.00 -0.52 -1.02 121.76 121.73 2b3b s ALA 215 Ca 0.25 -0.49 -0.28 0.00 0.00 0.00 0.00 51.96 51.44 2b3b s ALA 215 Cb 0.19 -2.49 -0.10 0.00 0.00 0.00 0.00 23.12 20.73 2b3b s ALA 215 CO 0.47 -0.08 1.33 0.54 0.00 0.00 0.00 175.76 178.02 2b3b s ASN 216 N -3.63 6.56 0.41 0.00 4.22 -1.04 -4.80 114.94 116.66 2b3b s ASN 216 Ca 0.47 2.72 0.25 0.00 -2.14 0.00 0.00 52.86 54.16 2b3b s ASN 216 Cb -0.10 -2.65 0.64 0.00 1.28 0.00 0.00 41.25 40.42 2b3b s ASN 216 CO 0.37 -0.69 1.71 0.11 -2.04 0.00 0.00 177.10 176.56 2b3b h LYS 217 N 3.08 0.00 -0.84 3.55 1.79 -1.96 -3.04 116.57 119.15 2b3b h LYS 217 Ca -0.49 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 57.92 2b3b h LYS 217 Cb 1.23 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.85 2b3b h LYS 217 CO 0.64 0.00 0.08 -0.40 -1.08 0.00 0.00 179.45 178.69 2b3b n ASP 218 N -2.89 3.35 -0.36 0.86 5.75 -1.26 -4.60 116.55 117.40 2b3b n ASP 218 Ca 0.04 -2.54 -0.01 0.00 -0.01 0.00 0.00 54.79 52.27 2b3b n ASP 218 Cb 0.46 -0.61 0.12 0.00 -1.03 0.00 0.00 41.12 40.06 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 2.64 1.27 -0.54 2.12 0.00 -1.74 -3.07 119.26 119.94 2b3b h ALA 219 Ca 0.07 -0.06 0.16 0.00 0.00 0.00 0.00 54.91 55.08 2b3b h ALA 219 Cb 1.40 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2b3b h ALA 219 CO 0.32 0.57 0.39 0.00 0.00 0.00 0.00 179.25 180.53 2b3b h ALA 220 N 1.38 2.51 -0.40 0.00 0.00 -1.81 -0.81 119.26 120.12 2b3b h ALA 220 Ca 0.37 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2b3b h ALA 220 Cb -0.07 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2b3b h ALA 220 CO -0.10 -0.66 0.00 0.41 0.00 0.00 0.00 179.25 178.89 2b3b n GLY 221 N -1.64 1.41 3.78 0.00 0.00 -1.16 -4.20 105.19 103.38 2b3b n GLY 221 Ca 0.10 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 45.14 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 -1.37 3.92 0.81 0.99 1.43 -0.38 -4.92 118.68 119.16 2b3b s LEU 222 Ca 0.38 0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 53.58 2b3b s LEU 222 Cb 0.21 -2.11 0.08 0.00 0.03 0.00 0.00 46.19 44.40 2b3b s LEU 222 CO 0.29 0.33 1.13 -0.94 0.23 0.00 0.00 176.35 177.39 2b3b s SER 223 N -1.35 4.41 0.31 2.29 1.04 -1.26 -0.40 113.70 118.74 2b3b s SER 223 Ca 0.19 1.05 0.00 0.00 0.48 0.00 0.00 55.95 57.67 2b3b s SER 223 Cb -0.12 -1.70 0.52 0.00 0.10 0.00 0.00 66.02 64.82 2b3b s SER 223 CO 0.09 -1.99 1.96 4.11 0.98 0.00 0.00 173.24 178.38 2b3b h TRP 224 N -1.11 0.99 -0.63 5.02 5.08 -1.98 -1.76 115.95 121.56 2b3b h TRP 224 Ca -0.47 0.02 -0.06 0.00 1.08 0.00 0.00 58.89 59.46 2b3b h TRP 224 Cb 1.30 -0.33 -0.03 0.00 -3.00 0.00 0.00 29.16 27.10 2b3b h TRP 224 CO 0.39 0.58 0.16 1.96 -1.28 0.00 0.00 178.44 180.25 2b3b h GLN 225 N 1.03 0.97 -0.30 0.12 7.50 -1.99 -1.70 115.11 120.74 2b3b h GLN 225 Ca 0.32 -0.21 -0.10 0.00 0.50 0.00 0.00 58.65 59.16 2b3b h GLN 225 Cb 0.01 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.39 2b3b h GLN 225 CO -0.09 0.86 -0.23 1.96 -1.50 0.00 0.00 178.83 179.82 2b3b h GLN 226 N 0.93 0.57 -0.37 1.46 4.20 -1.72 0.27 115.11 120.46 2b3b h GLN 226 Ca 0.20 -0.22 -0.09 0.00 0.06 0.00 0.00 58.65 58.60 2b3b h GLN 226 Cb 0.32 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 2b3b h GLN 226 CO -0.00 0.77 -0.11 0.00 -0.67 0.00 0.00 178.83 178.81 2b3b h ALA 227 N 1.24 0.51 -0.80 3.87 0.00 -1.04 -2.79 119.26 120.26 2b3b h ALA 227 Ca 0.07 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.70 2b3b h ALA 227 Cb 0.68 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 2b3b h ALA 227 CO 0.05 0.39 0.50 0.28 0.00 0.00 0.00 179.25 180.48 2b3b h VAL 228 N 0.53 1.10 -0.58 0.00 2.07 -0.96 -2.13 116.25 116.28 2b3b h VAL 228 Ca 0.09 -0.33 0.10 0.00 0.82 0.00 0.00 66.70 67.38 2b3b h VAL 228 Cb 0.64 0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 2b3b h VAL 228 CO 0.04 0.18 0.39 0.44 0.02 0.00 0.00 177.57 178.64 2b3b h ASP 229 N 0.97 0.33 -0.77 0.57 3.32 -0.73 -0.68 116.42 119.42 2b3b h ASP 229 Ca 0.33 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.38 2b3b h ASP 229 Cb 0.05 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.50 2b3b h ASP 229 CO -0.13 0.20 0.45 0.03 -1.72 0.00 0.00 179.24 178.07 2b3b h ARG 230 N 0.37 1.06 -0.18 3.56 3.08 -1.12 0.16 114.38 121.30 2b3b h ARG 230 Ca 0.27 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 60.16 2b3b h ARG 230 Cb 0.56 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2b3b h ARG 230 CO -0.07 0.76 -0.07 0.28 -1.07 0.00 0.00 179.97 179.80 2b3b h VAL 231 N 1.06 1.30 -0.93 2.04 2.07 -1.16 0.84 116.25 121.46 2b3b h VAL 231 Ca 0.27 -1.09 0.04 0.00 0.82 0.00 0.00 66.70 66.74 2b3b h VAL 231 Cb -0.01 1.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 2b3b h VAL 231 CO -0.05 0.33 0.61 0.58 0.02 0.00 0.00 177.57 179.06 2b3b h VAL 232 N 0.07 1.16 -0.03 2.57 2.07 -1.01 -2.11 116.25 118.97 2b3b h VAL 232 Ca 0.04 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.16 2b3b h VAL 232 Cb 0.53 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 2b3b h VAL 232 CO 0.02 0.21 0.00 0.00 0.02 0.00 0.00 177.57 177.83 2b3b n GLN 233 N -4.44 1.44 -1.07 1.57 6.02 0.52 -4.93 117.38 116.49 2b3b n GLN 233 Ca 0.13 -0.64 -0.02 0.00 -0.01 0.00 0.00 57.00 56.45 2b3b n GLN 233 Cb 0.11 -1.46 -0.01 0.00 1.02 0.00 0.00 30.24 29.89 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 1.09 0.56 0.28 1.08 0.00 -0.79 -4.86 105.19 102.55 2b3b n GLY 234 Ca 0.20 -0.35 0.14 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.34 1.06 -3.86 1.61 5.02 0.20 -4.87 118.16 114.98 2b3b n LYS 235 Ca -0.02 -0.57 -0.09 0.00 -2.02 0.00 0.00 58.31 55.60 2b3b n LYS 235 Cb 0.15 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.61 2b3b n LYS 235 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2b3b s ALA 236 N -2.33 -0.34 -0.24 7.82 0.00 -0.70 -4.68 121.76 121.30 2b3b s ALA 236 Ca 0.30 -0.61 0.07 0.00 0.00 0.00 0.00 51.96 51.72 2b3b s ALA 236 Cb 0.20 0.77 -0.19 0.00 0.00 0.00 0.00 23.12 23.90 2b3b s ALA 236 CO 0.45 -0.65 -0.14 0.00 0.00 0.00 0.00 175.76 175.42 2b3b n ALA 237 N -0.21 1.47 -2.57 0.00 0.00 0.25 -4.37 120.51 115.09 2b3b n ALA 237 Ca -0.10 -1.15 -0.11 0.00 0.00 0.00 0.00 53.44 52.08 2b3b n ALA 237 Cb 0.63 -0.11 -0.11 0.00 0.00 0.00 0.00 19.45 19.86 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 -2.50 0.65 -0.11 0.00 0.08 -0.41 -4.31 117.98 111.38 2b3b s PHE 238 Ca -0.27 -0.71 -0.06 0.00 0.12 0.00 0.00 56.93 56.01 2b3b s PHE 238 Cb 0.08 -0.40 0.05 0.00 -0.57 0.00 0.00 43.02 42.17 2b3b s PHE 238 CO 0.65 -0.16 0.28 1.21 -0.10 0.00 0.00 175.22 177.10 2b3b s ASN 239 N -2.18 -0.31 -0.38 1.36 2.47 -1.02 -0.39 114.94 114.49 2b3b s ASN 239 Ca -0.02 0.58 -0.17 0.00 0.42 0.00 0.00 52.86 53.68 2b3b s ASN 239 Cb -0.03 0.49 0.01 0.00 -1.45 0.00 0.00 41.25 40.26 2b3b s ASN 239 CO -0.03 -0.16 0.43 -0.63 -3.72 0.00 0.00 177.10 172.99 2b3b s ILE 240 N 1.12 5.09 -0.03 -5.21 -1.09 -1.26 -0.71 121.20 119.11 2b3b s ILE 240 Ca -0.08 -0.08 -0.30 0.00 -2.23 0.00 0.00 60.65 57.96 2b3b s ILE 240 Cb -0.09 -3.96 0.08 0.00 -1.58 0.00 0.00 42.46 36.91 2b3b s ILE 240 CO -0.08 -0.28 0.71 -0.32 -1.23 0.00 0.00 174.94 173.74 2b3b s MET 241 N 2.16 1.04 0.87 2.79 1.75 -0.73 -4.63 119.30 122.54 2b3b s MET 241 Ca 0.13 0.13 -0.10 0.00 -1.25 0.00 0.00 55.69 54.60 2b3b s MET 241 Cb -0.16 0.49 0.12 0.00 2.84 0.00 0.00 34.83 38.11 2b3b s MET 241 CO 0.13 -0.35 1.13 0.20 -0.65 0.00 0.00 175.02 175.49 2b3b s GLY 242 N -1.43 1.70 0.00 2.11 0.00 -1.23 -3.97 107.32 104.50 2b3b s GLY 242 Ca -0.08 0.51 0.09 0.00 0.00 0.00 0.00 44.72 45.24 2b3b s GLY 242 CO 0.06 0.91 1.27 2.09 0.00 0.00 0.00 173.10 177.42 2b3b n ASP 243 N -3.99 0.00 0.18 1.64 5.68 -0.82 -1.31 116.55 117.93 2b3b n ASP 243 Ca 0.11 -1.48 0.18 0.00 -0.50 0.00 0.00 54.79 53.10 2b3b n ASP 243 Cb 0.52 0.00 0.81 0.00 -1.14 0.00 0.00 41.12 41.31 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 -0.65 2.11 0.09 -1.81 -1.98 115.95 113.71 2b3b h TRP 244 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 58.89 58.91 2b3b h TRP 244 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 29.16 29.21 2b3b h TRP 244 CO 0.00 0.00 0.13 0.00 0.09 0.00 0.00 178.44 178.66 2b3b h ALA 245 N 1.60 1.01 -0.43 0.11 0.00 -1.48 -0.90 119.26 119.17 2b3b h ALA 245 Ca 0.12 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.79 2b3b h ALA 245 Cb 0.75 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2b3b h ALA 245 CO -0.00 0.64 0.26 0.00 0.00 0.00 0.00 179.25 180.15 2b3b h ALA 246 N 1.16 0.54 -0.55 0.00 0.00 -1.59 0.28 119.26 119.10 2b3b h ALA 246 Ca 0.20 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.13 2b3b h ALA 246 Cb 0.38 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2b3b h ALA 246 CO 0.01 -0.05 0.33 0.78 0.00 0.00 0.00 179.25 180.31 2b3b h GLY 247 N 0.53 0.78 0.90 0.00 0.00 -1.41 -0.78 103.07 103.09 2b3b h GLY 247 Ca 0.17 -0.24 0.01 0.00 0.00 0.00 0.00 47.33 47.27 2b3b h GLY 247 CO -0.07 0.20 -0.01 -1.82 0.00 0.00 0.00 176.54 174.84 2b3b h TYR 248 N 0.64 -0.03 -0.06 5.60 3.20 -0.71 0.39 116.97 126.01 2b3b h TYR 248 Ca 0.22 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.05 2b3b h TYR 248 Cb 0.04 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.32 2b3b h TYR 248 CO -0.07 -0.02 -0.21 0.52 -1.64 0.00 0.00 178.16 176.74 2b3b h MET 249 N 0.00 0.10 0.00 1.82 2.86 -0.72 -1.18 114.93 117.81 2b3b h MET 249 Ca 0.02 -0.03 -0.18 0.00 -2.06 0.00 0.00 59.70 57.46 2b3b h MET 249 Cb 0.04 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.66 2b3b h MET 249 CO -0.05 0.31 -1.20 0.25 1.06 0.00 0.00 176.91 177.28 2b3b n THR 250 N -4.25 1.50 -0.08 2.22 -2.24 -0.32 -0.83 114.28 110.29 2b3b n THR 250 Ca -0.02 0.01 -0.14 0.00 -2.27 0.00 0.00 64.05 61.63 2b3b n THR 250 Cb 0.30 -2.15 -0.05 0.00 -2.10 0.00 0.00 70.33 66.33 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 1.30 0.03 4.28 2.02 -0.32 -2.35 112.91 116.88 2b3b h THR 251 Ca -0.27 -1.63 -0.35 0.00 0.77 0.00 0.00 66.41 64.93 2b3b h THR 251 Cb 1.09 1.71 -0.04 0.00 -1.74 0.00 0.00 68.15 69.17 2b3b h THR 251 CO -0.16 0.52 -1.97 0.41 0.37 0.00 0.00 175.52 174.68 2b3b n THR 252 N -4.16 1.59 1.01 3.16 -1.04 -0.70 -4.55 114.28 109.60 2b3b n THR 252 Ca -0.05 -0.37 0.11 0.00 -2.04 0.00 0.00 64.05 61.71 2b3b n THR 252 Cb 0.56 -1.82 0.12 0.00 -1.82 0.00 0.00 70.33 67.37 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 -3.95 0.73 -2.60 -4.42 4.77 -0.53 -4.96 117.00 106.04 2b3b n LEU 253 Ca -0.40 -0.20 -0.19 0.00 -0.03 0.00 0.00 56.01 55.19 2b3b n LEU 253 Cb 0.88 -0.15 0.03 0.00 -2.33 0.00 0.00 43.42 41.85 2b3b n LEU 253 CO 0.22 0.18 -0.01 0.29 -1.33 0.00 0.00 177.39 176.74 2b3b n LYS 254 N -1.43 -4.16 -3.53 3.23 4.76 -0.87 -4.92 118.16 111.24 2b3b n LYS 254 Ca 0.05 0.79 -0.32 0.00 -2.87 0.00 0.00 58.31 55.96 2b3b n LYS 254 Cb 0.34 -5.37 -0.05 0.00 -1.84 0.00 0.00 35.03 28.10 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 -5.77 4.23 -0.27 -0.35 1.43 -0.01 -4.99 118.68 112.96 2b3b s LEU 255 Ca 0.25 0.78 -0.19 0.00 -1.03 0.00 0.00 54.13 53.95 2b3b s LEU 255 Cb -0.11 -3.45 -0.02 0.00 0.03 0.00 0.00 46.19 42.64 2b3b s LEU 255 CO 0.31 0.01 0.57 -0.54 0.23 0.00 0.00 176.35 176.94 2b3b s LYS 256 N -2.63 4.02 0.21 1.70 1.02 -1.26 -4.36 119.74 118.45 2b3b s LYS 256 Ca 0.43 0.36 -0.32 0.00 0.02 0.00 0.00 55.97 56.46 2b3b s LYS 256 Cb -0.12 -3.68 -0.12 0.00 -0.52 0.00 0.00 37.83 33.39 2b3b s LYS 256 CO 0.22 -0.43 1.66 -2.30 -0.92 0.00 0.00 175.35 173.58 2b3b n PRO 257 N 5.68 2.60 0.00 -1.68 -0.02 -1.26 -0.76 135.00 139.55 2b3b n PRO 257 Ca -0.02 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 2b3b n PRO 257 Cb 0.49 -2.75 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 2b3b n PRO 257 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b3b n GLY 258 N 3.51 2.89 0.32 -1.23 0.00 0.12 -4.78 105.19 106.01 2b3b n GLY 258 Ca 0.15 -0.18 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 1.39 0.77 2.61 -1.04 -0.89 -4.63 114.28 112.48 2b3b n THR 259 Ca 0.00 0.11 0.12 0.00 -2.04 0.00 0.00 64.05 62.24 2b3b n THR 259 Cb 0.00 -2.10 0.25 0.00 -1.82 0.00 0.00 70.33 66.66 2b3b n THR 259 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2b3b n ASP 260 N -4.19 0.56 -3.72 8.00 8.00 0.06 -4.59 116.55 120.68 2b3b n ASP 260 Ca -0.17 0.04 -0.07 0.00 0.71 0.00 0.00 54.79 55.30 2b3b n ASP 260 Cb 0.48 0.10 -0.02 0.00 -0.02 0.00 0.00 41.12 41.66 2b3b n ASP 260 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2b3b s PHE 261 N -3.09 -0.25 0.31 1.24 -0.12 -1.23 -4.80 117.98 110.04 2b3b s PHE 261 Ca 0.09 -0.10 -0.04 0.00 -0.05 0.00 0.00 56.93 56.83 2b3b s PHE 261 Cb 0.15 0.65 -0.00 0.00 -0.63 0.00 0.00 43.02 43.19 2b3b s PHE 261 CO 0.69 -1.01 0.44 0.00 -0.05 0.00 0.00 175.22 175.29 2b3b s ALA 262 N -3.66 0.65 0.06 1.99 0.00 0.54 0.14 121.76 121.47 2b3b s ALA 262 Ca 0.09 -1.43 -0.16 0.00 0.00 0.00 0.00 51.96 50.46 2b3b s ALA 262 Cb -0.04 1.17 0.03 0.00 0.00 0.00 0.00 23.12 24.28 2b3b s ALA 262 CO 0.01 -0.78 0.35 1.67 0.00 0.00 0.00 175.76 177.01 2b3b s TRP 263 N -3.35 -0.17 0.09 0.00 -2.14 -1.26 -2.10 118.94 110.01 2b3b s TRP 263 Ca 0.30 0.04 -0.16 0.00 2.66 0.00 0.00 56.10 58.93 2b3b s TRP 263 Cb 0.00 0.16 0.03 0.00 -3.10 0.00 0.00 33.47 30.56 2b3b s TRP 263 CO 0.18 -0.56 0.39 0.00 -2.66 0.00 0.00 176.95 174.30 2b3b s ALA 264 N -2.74 -0.92 0.69 2.67 0.00 -0.68 -4.99 121.76 115.79 2b3b s ALA 264 Ca -0.04 0.07 -0.17 0.00 0.00 0.00 0.00 51.96 51.83 2b3b s ALA 264 Cb -0.00 0.53 -0.00 0.00 0.00 0.00 0.00 23.12 23.64 2b3b s ALA 264 CO -0.04 -0.55 1.10 -2.30 0.00 0.00 0.00 175.76 173.96 2b3b n PRO 265 N 0.11 0.73 -1.58 0.00 -0.02 -1.26 0.16 135.00 133.15 2b3b n PRO 265 Ca -0.17 0.31 -0.44 0.00 -2.02 0.00 0.00 63.50 61.18 2b3b n PRO 265 Cb 0.62 -2.34 -0.01 0.00 -0.02 0.00 0.00 33.50 31.75 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 -1.77 1.08 -4.58 2.55 7.64 -0.23 -4.38 113.62 113.93 2b3b n SER 266 Ca 0.14 1.14 -0.46 0.00 1.01 0.00 0.00 58.87 60.70 2b3b n SER 266 Cb 0.49 -1.28 -0.03 0.00 -1.01 0.00 0.00 64.21 62.38 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 0.64 1.24 -0.95 1.43 -0.02 -1.26 -1.51 135.00 134.57 2b3b n PRO 267 Ca 0.10 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2b3b n PRO 267 Cb 0.33 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 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 1.60 0.56 0.00 -1.23 0.00 -0.02 -4.58 105.19 101.52 2b3b n GLY 268 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.44 0.77 -1.62 2.61 -2.24 -0.57 -4.42 114.28 106.37 2b3b n THR 269 Ca 0.00 -0.85 -0.56 0.00 -2.27 0.00 0.00 64.05 60.37 2b3b n THR 269 Cb 0.06 0.63 -0.07 0.00 -2.10 0.00 0.00 70.33 68.85 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 -0.38 0.81 0.00 -0.78 3.00 -1.26 -1.10 117.38 117.67 2b3b n GLN 270 Ca 0.00 0.30 0.00 0.00 -0.01 0.00 0.00 57.00 57.29 2b3b n GLN 270 Cb 0.22 -1.91 0.00 0.00 0.00 0.00 0.00 30.24 28.55 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 2.88 1.80 3.39 1.08 0.00 -1.26 -5.05 105.19 108.03 2b3b n GLY 271 Ca 0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 2b3b n GLY 271 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b3b s VAL 272 N -2.42 2.97 -0.34 1.61 1.01 -0.26 -1.40 120.40 121.58 2b3b s VAL 272 Ca 0.00 -0.71 -0.06 0.00 0.00 0.00 0.00 61.98 61.21 2b3b s VAL 272 Cb 0.00 -2.22 0.04 0.00 0.00 0.00 0.00 36.38 34.20 2b3b s VAL 272 CO 0.00 0.54 0.10 0.12 0.00 0.00 0.00 175.10 175.87 2b3b s PHE 273 N 0.07 3.26 -0.49 5.22 5.99 0.23 -4.95 117.98 127.31 2b3b s PHE 273 Ca -0.06 -1.47 -0.24 0.00 0.00 0.00 0.00 56.93 55.17 2b3b s PHE 273 Cb -0.15 -2.30 0.03 0.00 0.00 0.00 0.00 43.02 40.61 2b3b s PHE 273 CO 0.05 -0.74 0.87 1.41 -0.00 0.00 0.00 175.22 176.81 2b3b s MET 274 N 1.39 3.41 0.29 10.12 -2.45 -1.26 -1.80 119.30 129.00 2b3b s MET 274 Ca -0.02 -0.10 0.06 0.00 -1.25 0.00 0.00 55.69 54.39 2b3b s MET 274 Cb -0.20 -3.98 -0.02 0.00 1.25 0.00 0.00 34.83 31.89 2b3b s MET 274 CO 0.02 -1.27 0.36 0.00 1.05 0.00 0.00 175.02 175.19 2b3b s MET 275 N 3.61 3.12 0.17 4.11 0.23 -0.14 -0.50 119.30 129.90 2b3b s MET 275 Ca 0.32 -0.99 -0.08 0.00 -1.03 0.00 0.00 55.69 53.90 2b3b s MET 275 Cb -0.12 -2.74 -0.01 0.00 -1.53 0.00 0.00 34.83 30.43 2b3b s MET 275 CO 0.22 0.24 0.28 -0.48 -2.03 0.00 0.00 175.02 173.25 2b3b s LEU 276 N -4.03 0.98 -0.05 0.18 2.34 -0.62 -1.76 118.68 115.72 2b3b s LEU 276 Ca 0.39 -0.90 -0.02 0.00 0.06 0.00 0.00 54.13 53.66 2b3b s LEU 276 Cb -0.08 1.15 0.04 0.00 -0.56 0.00 0.00 46.19 46.73 2b3b s LEU 276 CO 0.29 -0.89 0.09 -0.55 -1.06 0.00 0.00 176.35 174.23 2b3b s SER 277 N -2.98 0.34 0.06 1.48 0.15 -1.26 -1.25 113.70 110.23 2b3b s SER 277 Ca 0.18 0.17 -0.30 0.00 0.70 0.00 0.00 55.95 56.70 2b3b s SER 277 Cb 0.03 0.05 -0.05 0.00 -1.71 0.00 0.00 66.02 64.35 2b3b s SER 277 CO 0.01 -0.18 1.00 -1.81 1.20 0.00 0.00 173.24 173.46 2b3b s ASP 278 N 1.52 7.38 0.09 5.45 1.01 -1.26 -1.10 116.67 129.76 2b3b s ASP 278 Ca -0.04 1.77 -0.02 0.00 0.71 0.00 0.00 52.55 54.97 2b3b s ASP 278 Cb -0.12 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.19 2b3b s ASP 278 CO -0.04 -0.21 0.04 -0.94 0.21 0.00 0.00 175.17 174.22 2b3b s SER 279 N 0.59 0.36 -0.01 0.27 1.04 0.24 -0.82 113.70 115.37 2b3b s SER 279 Ca 0.51 -1.06 0.04 0.00 0.48 0.00 0.00 55.95 55.91 2b3b s SER 279 Cb -0.23 0.26 -0.01 0.00 0.10 0.00 0.00 66.02 66.14 2b3b s SER 279 CO 0.29 -0.68 -0.14 -0.36 0.98 0.00 0.00 173.24 173.33 2b3b s PHE 280 N -3.98 1.24 0.00 5.02 0.08 -0.66 -0.73 117.98 118.95 2b3b s PHE 280 Ca 0.15 -0.25 0.00 0.00 0.12 0.00 0.00 56.93 56.95 2b3b s PHE 280 Cb 0.07 -0.81 0.00 0.00 -0.57 0.00 0.00 43.02 41.72 2b3b s PHE 280 CO -0.04 -0.04 0.00 0.41 -0.10 0.00 0.00 175.22 175.45 2b3b n GLY 281 N 2.80 5.25 2.89 4.36 0.00 -1.26 0.30 105.19 119.53 2b3b n GLY 281 Ca -0.15 -1.99 -0.30 0.00 0.00 0.00 0.00 46.02 43.58 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 3.66 0.29 0.99 2.96 -1.26 -4.47 118.68 120.85 2b3b s LEU 282 Ca 0.00 -2.10 -0.29 0.00 -0.22 0.00 0.00 54.13 51.51 2b3b s LEU 282 Cb 0.00 -1.31 -0.10 0.00 0.50 0.00 0.00 46.19 45.28 2b3b s LEU 282 CO 0.00 -0.37 1.27 -2.84 -1.32 0.00 0.00 176.35 173.09 2b3b s PRO 283 N 0.99 4.42 0.27 0.98 0.02 -1.26 -0.55 135.00 139.87 2b3b s PRO 283 Ca 0.12 2.10 -0.30 0.00 0.02 0.00 0.00 61.00 62.94 2b3b s PRO 283 Cb -0.20 -3.12 -0.13 0.00 0.02 0.00 0.00 34.50 31.07 2b3b s PRO 283 CO -0.12 -0.12 1.27 1.63 -0.33 0.00 0.00 177.00 179.33 2b3b n LYS 284 N 1.30 1.83 -0.77 5.54 5.02 -0.13 -2.53 118.16 128.42 2b3b n LYS 284 Ca 0.01 0.65 0.00 0.00 -2.02 0.00 0.00 58.31 56.95 2b3b n LYS 284 Cb 0.43 -2.21 0.00 0.00 -0.02 0.00 0.00 35.03 33.22 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 1.58 0.88 3.54 0.72 0.00 -1.26 -4.83 105.19 105.82 2b3b n GLY 285 Ca 0.10 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.58 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 0.32 -2.15 0.14 4.61 0.00 -1.05 -4.80 120.51 117.57 2b3b n ALA 286 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 53.44 53.98 2b3b n ALA 286 Cb 0.00 -1.91 0.29 0.00 0.00 0.00 0.00 19.45 17.84 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 3.47 0.12 -2.19 0.00 1.57 -1.86 -3.33 116.57 114.35 2b3b h LYS 287 Ca -0.47 -0.05 -0.59 0.00 -1.87 0.00 0.00 60.65 57.67 2b3b h LYS 287 Cb 1.38 -0.00 -0.42 0.00 0.08 0.00 0.00 32.23 33.27 2b3b h LYS 287 CO 0.70 0.49 -0.69 0.09 -0.57 0.00 0.00 179.45 179.47 2b3b n ASN 288 N -4.07 3.51 -0.17 0.86 3.02 -1.26 -4.96 115.26 112.19 2b3b n ASN 288 Ca -0.02 -3.43 -0.08 0.00 -0.03 0.00 0.00 54.58 51.03 2b3b n ASN 288 Cb 0.44 -0.63 0.01 0.00 -0.61 0.00 0.00 39.78 38.99 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 3.74 0.68 -0.66 3.52 2.43 -1.94 -1.58 114.38 120.56 2b3b h ARG 289 Ca 0.16 -0.08 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 2b3b h ARG 289 Cb 0.65 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.04 2b3b h ARG 289 CO 0.78 0.54 0.12 0.37 -1.51 0.00 0.00 179.97 180.27 2b3b h GLN 290 N 0.64 1.08 -0.48 0.20 5.75 -1.94 0.02 115.11 120.37 2b3b h GLN 290 Ca 0.17 -0.28 -0.05 0.00 -0.15 0.00 0.00 58.65 58.33 2b3b h GLN 290 Cb 0.07 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.46 2b3b h GLN 290 CO -0.03 0.99 0.08 -0.91 -2.65 0.00 0.00 178.83 176.31 2b3b h ASN 291 N 1.00 0.70 -0.38 -0.69 2.35 -1.83 -0.80 115.58 115.93 2b3b h ASN 291 Ca 0.20 -0.13 -0.11 0.00 -0.55 0.00 0.00 56.30 55.71 2b3b h ASN 291 Cb 0.42 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 2b3b h ASN 291 CO 0.01 0.72 -0.18 0.00 -1.65 0.00 0.00 177.43 176.33 2b3b h ALA 292 N 1.37 0.53 -0.65 -0.83 0.00 -0.92 -1.21 119.26 117.54 2b3b h ALA 292 Ca 0.15 -0.36 0.05 0.00 0.00 0.00 0.00 54.91 54.76 2b3b h ALA 292 Cb 0.33 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 2b3b h ALA 292 CO 0.00 0.47 0.37 0.82 0.00 0.00 0.00 179.25 180.92 2b3b h ILE 293 N 0.58 1.00 -0.38 0.00 2.04 -0.51 -1.36 117.51 118.88 2b3b h ILE 293 Ca 0.08 -0.24 -0.06 0.00 1.00 0.00 0.00 64.86 65.65 2b3b h ILE 293 Cb 0.73 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 2b3b h ILE 293 CO 0.05 0.13 0.00 0.78 0.00 0.00 0.00 178.15 179.12 2b3b h ASN 294 N 0.71 0.57 -0.29 1.72 2.35 -1.00 -0.14 115.58 119.50 2b3b h ASN 294 Ca 0.28 -0.11 0.04 0.00 -0.55 0.00 0.00 56.30 55.96 2b3b h ASN 294 Cb 0.13 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.32 2b3b h ASN 294 CO -0.16 0.63 0.04 -0.25 -1.65 0.00 0.00 177.43 176.05 2b3b h TRP 295 N 0.57 0.07 -0.77 1.19 2.91 -0.67 -1.52 115.95 117.74 2b3b h TRP 295 Ca 0.12 0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.17 2b3b h TRP 295 Cb 0.36 0.01 -0.04 0.00 -0.51 0.00 0.00 29.16 28.98 2b3b h TRP 295 CO 0.01 0.00 0.50 -0.07 -1.03 0.00 0.00 178.44 177.86 2b3b h LEU 296 N 0.14 0.86 -0.92 0.65 3.38 -0.63 0.18 115.31 118.97 2b3b h LEU 296 Ca 0.13 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.10 2b3b h LEU 296 Cb 0.15 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.65 2b3b h LEU 296 CO -0.19 0.61 0.61 0.03 0.09 0.00 0.00 178.44 179.59 2b3b h ARG 297 N 1.01 1.21 -0.05 1.13 3.08 -0.84 0.28 114.38 120.19 2b3b h ARG 297 Ca 0.29 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.26 2b3b h ARG 297 Cb -0.08 -0.27 -0.00 0.00 0.08 0.00 0.00 29.97 29.70 2b3b h ARG 297 CO -0.08 0.80 0.01 1.25 -1.07 0.00 0.00 179.97 180.88 2b3b h LEU 298 N 1.24 0.08 -1.53 3.04 5.85 -0.58 -3.03 115.31 120.38 2b3b h LEU 298 Ca 0.34 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 2b3b h LEU 298 Cb -0.14 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 2b3b h LEU 298 CO -0.07 0.30 0.23 0.58 -0.34 0.00 0.00 178.44 179.14 2b3b h VAL 299 N -0.15 1.12 -0.06 1.05 2.07 -0.32 -1.69 116.25 118.27 2b3b h VAL 299 Ca 0.02 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2b3b h VAL 299 Cb 0.26 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 2b3b h VAL 299 CO 0.00 0.13 0.00 0.61 0.02 0.00 0.00 177.57 178.33 2b3b n GLY 300 N -1.38 -0.07 3.91 2.17 0.00 0.06 -4.56 105.19 105.32 2b3b n GLY 300 Ca 0.03 -0.39 -0.28 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.83 6.42 0.20 1.61 1.04 -0.63 -4.98 113.70 115.52 2b3b s SER 301 Ca 0.36 0.69 -0.06 0.00 0.48 0.00 0.00 55.95 57.43 2b3b s SER 301 Cb 0.19 -2.14 0.13 0.00 0.10 0.00 0.00 66.02 64.31 2b3b s SER 301 CO 0.31 -0.23 1.62 0.50 0.98 0.00 0.00 173.24 176.42 2b3b h LYS 302 N 1.50 0.87 -0.03 4.02 3.64 -1.92 -1.28 116.57 123.37 2b3b h LYS 302 Ca -0.48 -0.34 0.02 0.00 -1.27 0.00 0.00 60.65 58.58 2b3b h LYS 302 Cb 1.19 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 2b3b h LYS 302 CO 0.65 0.98 -0.13 1.49 -2.27 0.00 0.00 179.45 180.18 2b3b h GLU 303 N 0.77 -0.19 0.01 1.90 4.81 -1.94 -0.89 114.58 119.04 2b3b h GLU 303 Ca 0.11 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2b3b h GLU 303 Cb 0.72 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.14 2b3b h GLU 303 CO 0.05 -0.13 -0.01 0.78 -0.73 0.00 0.00 179.01 178.98 2b3b h GLY 304 N -0.20 -0.02 2.00 1.92 0.00 -1.67 -2.50 103.07 102.60 2b3b h GLY 304 Ca 0.06 0.01 -0.10 0.00 0.00 0.00 0.00 47.33 47.30 2b3b h GLY 304 CO -0.15 -0.01 -0.46 1.46 0.00 0.00 0.00 176.54 177.38 2b3b h GLN 305 N -0.02 0.00 -0.00 4.80 4.20 -1.05 -1.98 115.11 121.06 2b3b h GLN 305 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2b3b h GLN 305 Cb 0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.80 2b3b h GLN 305 CO 0.00 0.46 -0.42 -0.25 -0.67 0.00 0.00 178.83 177.96 2b3b n ASP 306 N -3.97 0.91 -0.06 1.46 8.00 -0.36 -2.20 116.55 120.33 2b3b n ASP 306 Ca -0.02 -0.72 -0.17 0.00 0.71 0.00 0.00 54.79 54.60 2b3b n ASP 306 Cb 0.48 0.27 -0.13 0.00 -0.02 0.00 0.00 41.12 41.72 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 0.78 1.48 0.22 -3.53 2.02 -1.20 -3.42 112.91 109.26 2b3b h THR 307 Ca 0.00 -2.33 -0.35 0.00 0.77 0.00 0.00 66.41 64.51 2b3b h THR 307 Cb 0.52 3.02 0.02 0.00 -1.74 0.00 0.00 68.15 69.98 2b3b h THR 307 CO 0.00 0.55 -1.62 0.77 0.37 0.00 0.00 175.52 175.59 2b3b h SER 308 N -0.89 0.74 0.04 4.18 4.64 -1.43 -3.39 113.55 117.44 2b3b h SER 308 Ca -0.13 -0.93 -0.14 0.00 -0.47 0.00 0.00 61.79 60.12 2b3b h SER 308 Cb 1.20 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 63.04 2b3b h SER 308 CO -0.04 1.76 -0.47 0.78 -0.87 0.00 0.00 176.83 177.99 2b3b h ASN 309 N 0.12 0.54 -0.95 4.97 2.35 -1.69 -2.45 115.58 118.47 2b3b h ASN 309 Ca -0.30 -0.26 0.16 0.00 -0.55 0.00 0.00 56.30 55.35 2b3b h ASN 309 Cb 2.14 -0.15 -0.08 0.00 0.05 0.00 0.00 38.32 40.27 2b3b h ASN 309 CO 0.23 0.93 0.60 -0.65 -1.65 0.00 0.00 177.43 176.88 2b3b h PRO 310 N 0.40 0.71 -0.00 0.81 0.11 -1.78 -1.82 132.00 130.44 2b3b h PRO 310 Ca 0.02 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.99 2b3b h PRO 310 Cb 0.97 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.91 2b3b h PRO 310 CO 0.09 0.47 -0.50 -0.07 -0.21 0.00 0.00 178.00 177.78 2b3b h LEU 311 N 0.74 0.00 0.06 2.35 3.38 -1.65 -3.34 115.31 116.85 2b3b h LEU 311 Ca 0.50 -0.00 -0.27 0.00 0.09 0.00 0.00 57.88 58.20 2b3b h LEU 311 Cb 0.78 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 2b3b h LEU 311 CO -0.26 0.50 -1.35 0.50 0.09 0.00 0.00 178.44 177.93 2b3b h LYS 312 N 0.00 0.14 0.00 1.13 1.63 -0.92 -3.43 116.57 115.12 2b3b h LYS 312 Ca -0.00 -0.23 0.00 0.00 -0.85 0.00 0.00 60.65 59.56 2b3b h LYS 312 Cb 0.88 0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.60 2b3b h LYS 312 CO 0.06 1.00 0.00 0.41 -3.45 0.00 0.00 179.45 177.47 2b3b n GLY 313 N 1.53 3.19 3.81 5.01 0.00 -0.88 -3.68 105.19 114.17 2b3b n GLY 313 Ca -0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.09 3.78 0.33 1.61 1.04 -1.24 -4.60 113.70 113.52 2b3b s SER 314 Ca 0.00 0.95 0.07 0.00 0.48 0.00 0.00 55.95 57.45 2b3b s SER 314 Cb 0.00 -1.52 -0.02 0.00 0.10 0.00 0.00 66.02 64.58 2b3b s SER 314 CO 0.00 -2.38 0.33 0.27 0.98 0.00 0.00 173.24 172.44 2b3b s ILE 315 N -3.33 3.68 0.56 -1.02 -4.36 -0.29 -4.44 121.20 111.99 2b3b s ILE 315 Ca 0.63 -1.29 -0.19 0.00 -0.26 0.00 0.00 60.65 59.54 2b3b s ILE 315 Cb -0.14 -3.24 -0.05 0.00 1.25 0.00 0.00 42.46 40.28 2b3b s ILE 315 CO 0.52 -0.17 1.17 0.00 0.24 0.00 0.00 174.94 176.70 2b3b s ALA 316 N -2.27 2.65 0.03 2.27 0.00 -1.26 -0.20 121.76 122.97 2b3b s ALA 316 Ca 0.42 0.92 0.13 0.00 0.00 0.00 0.00 51.96 53.42 2b3b s ALA 316 Cb -0.07 -3.40 0.12 0.00 0.00 0.00 0.00 23.12 19.77 2b3b s ALA 316 CO 0.28 -0.94 1.46 0.00 0.00 0.00 0.00 175.76 176.55 2b3b h ALA 317 N 1.11 0.66 -2.73 0.00 0.00 -1.77 -3.39 119.26 113.15 2b3b h ALA 317 Ca -0.50 -0.59 -0.52 0.00 0.00 0.00 0.00 54.91 53.30 2b3b h ALA 317 Cb 1.28 -0.10 0.04 0.00 0.00 0.00 0.00 17.79 19.00 2b3b h ALA 317 CO 0.56 0.81 0.64 1.03 0.00 0.00 0.00 179.25 182.29 2b3b s ARG 318 N -3.06 4.40 0.58 0.00 0.52 -1.26 -4.37 118.95 115.76 2b3b s ARG 318 Ca 0.02 2.07 0.29 0.00 -0.52 0.00 0.00 55.73 57.59 2b3b s ARG 318 Cb 0.09 -3.17 1.79 0.00 0.52 0.00 0.00 34.95 34.19 2b3b s ARG 318 CO 0.76 -0.21 2.24 -0.07 0.02 0.00 0.00 175.30 178.04 2b3b h LEU 319 N 4.87 0.00 -2.84 2.53 3.38 -1.20 -2.95 115.31 119.09 2b3b h LEU 319 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2b3b h LEU 319 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2b3b h LEU 319 CO 0.74 0.01 0.00 -0.90 0.09 0.00 0.00 178.44 178.38 2b3b n ASP 320 N -3.84 4.37 -4.70 -0.43 5.75 -1.26 -4.98 116.55 111.46 2b3b n ASP 320 Ca -0.03 -2.44 -0.43 0.00 -0.01 0.00 0.00 54.79 51.88 2b3b n ASP 320 Cb 0.09 -0.56 -0.01 0.00 -1.03 0.00 0.00 41.12 39.62 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 0.93 2.88 -4.57 -1.12 2.88 -1.12 -4.93 113.62 108.57 2b3b n SER 321 Ca 0.23 1.20 -0.43 0.00 -1.33 0.00 0.00 58.87 58.54 2b3b n SER 321 Cb 0.84 -1.49 -0.04 0.00 -0.75 0.00 0.00 64.21 62.76 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 -0.19 6.53 0.64 -3.46 2.15 -1.26 -4.92 116.67 116.15 2b3b s ASP 322 Ca 0.57 0.21 0.39 0.00 0.43 0.00 0.00 52.55 54.15 2b3b s ASP 322 Cb -0.57 -2.45 2.19 0.00 -0.30 0.00 0.00 42.92 41.79 2b3b s ASP 322 CO 0.60 -1.01 2.32 1.55 -0.17 0.00 0.00 175.17 178.46 2b3b h PRO 323 N 8.96 0.00 0.00 4.34 0.13 -1.96 -2.41 132.00 141.06 2b3b h PRO 323 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2b3b h PRO 323 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2b3b h PRO 323 CO 1.02 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.45 2b3b h SER 324 N 0.00 0.00 1.17 1.44 4.64 -2.00 -1.22 113.55 117.58 2b3b h SER 324 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b3b h SER 324 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2b3b h SER 324 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 2b3b n LYS 325 N -2.74 0.10 -4.42 4.77 4.76 -0.91 -4.88 118.16 114.85 2b3b n LYS 325 Ca -0.00 0.08 -0.35 0.00 -2.87 0.00 0.00 58.31 55.17 2b3b n LYS 325 Cb 0.17 -1.61 -0.10 0.00 -1.84 0.00 0.00 35.03 31.64 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 -3.04 3.10 0.21 2.13 2.02 -0.46 -4.76 117.35 116.56 2b3b s TYR 326 Ca 0.13 0.10 -0.04 0.00 -0.37 0.00 0.00 57.07 56.89 2b3b s TYR 326 Cb 0.16 -1.80 0.05 0.00 -0.40 0.00 0.00 41.96 39.98 2b3b s TYR 326 CO 0.55 0.37 0.17 0.27 -1.57 0.00 0.00 175.55 175.35 2b3b n ASN 327 N 2.37 -1.47 0.04 2.29 0.23 -1.26 -4.59 115.26 112.86 2b3b n ASN 327 Ca -0.18 -0.50 -0.00 0.00 -0.53 0.00 0.00 54.58 53.37 2b3b n ASN 327 Cb 0.53 -0.17 0.30 0.00 -2.08 0.00 0.00 39.78 38.37 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 -2.16 1.34 0.25 -2.53 0.00 -1.98 -1.04 119.26 113.14 2b3b h ALA 328 Ca -0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 2b3b h ALA 328 Cb 0.21 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2b3b h ALA 328 CO 0.04 0.45 -0.12 -0.92 0.00 0.00 0.00 179.25 178.70 2b3b h TYR 329 N 0.41 -0.31 -0.91 0.00 3.20 -1.92 -2.13 116.97 115.31 2b3b h TYR 329 Ca 0.08 -0.01 0.18 0.00 3.14 0.00 0.00 58.73 62.12 2b3b h TYR 329 Cb 0.42 0.10 -0.11 0.00 1.54 0.00 0.00 36.73 38.69 2b3b h TYR 329 CO 0.01 0.04 0.48 0.78 -1.64 0.00 0.00 178.16 177.83 2b3b h GLY 330 N -0.71 1.54 1.08 1.82 0.00 -1.81 0.08 103.07 105.06 2b3b h GLY 330 Ca -0.03 -0.26 -0.14 0.00 0.00 0.00 0.00 47.33 46.89 2b3b h GLY 330 CO 0.06 -0.10 -0.30 1.46 0.00 0.00 0.00 176.54 177.66 2b3b h GLN 331 N 0.61 0.90 -0.41 4.80 4.20 -1.22 -1.32 115.11 122.67 2b3b h GLN 331 Ca 0.52 -0.44 0.01 0.00 0.06 0.00 0.00 58.65 58.81 2b3b h GLN 331 Cb 0.83 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.58 2b3b h GLN 331 CO -0.41 1.09 0.26 1.03 -0.67 0.00 0.00 178.83 180.13 2b3b h SER 332 N 0.71 0.43 -0.64 1.46 0.87 -0.61 -2.24 113.55 113.54 2b3b h SER 332 Ca 0.08 -0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.60 2b3b h SER 332 Cb 0.88 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.71 2b3b h SER 332 CO 0.08 0.31 0.26 0.00 -0.53 0.00 0.00 176.83 176.94 2b3b h ALA 333 N 1.17 0.83 -0.77 6.23 0.00 -0.89 -1.58 119.26 124.25 2b3b h ALA 333 Ca 0.16 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2b3b h ALA 333 Cb -0.02 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.46 2b3b h ALA 333 CO -0.06 0.44 0.47 0.52 0.00 0.00 0.00 179.25 180.63 2b3b h MET 334 N 0.89 0.85 -0.32 0.00 2.07 -1.05 0.24 114.93 117.62 2b3b h MET 334 Ca 0.21 -0.05 -0.01 0.00 -2.07 0.00 0.00 59.70 57.78 2b3b h MET 334 Cb 0.20 -0.19 -0.01 0.00 -1.87 0.00 0.00 31.60 29.73 2b3b h MET 334 CO -0.02 0.56 0.14 0.00 1.07 0.00 0.00 176.91 178.67 2b3b h ARG 335 N 0.88 0.46 -0.57 1.72 3.08 -0.98 -2.31 114.38 116.66 2b3b h ARG 335 Ca 0.33 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 60.21 2b3b h ARG 335 Cb 0.12 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 2b3b h ARG 335 CO -0.15 0.45 0.00 -0.44 -1.07 0.00 0.00 179.97 178.76 2b3b h ASP 336 N 0.37 0.98 -0.98 7.04 5.19 -0.89 -2.07 116.42 126.07 2b3b h ASP 336 Ca 0.11 -0.30 0.17 0.00 -0.62 0.00 0.00 57.03 56.38 2b3b h ASP 336 Cb 0.15 -0.26 -0.09 0.00 0.18 0.00 0.00 39.33 39.30 2b3b h ASP 336 CO -0.01 1.05 0.61 -0.25 -3.12 0.00 0.00 179.24 177.52 2b3b h TRP 337 N 0.89 0.99 0.00 4.55 -0.00 -0.38 -0.95 115.95 121.05 2b3b h TRP 337 Ca 0.16 0.03 -0.16 0.00 -0.00 0.00 0.00 58.89 58.92 2b3b h TRP 337 Cb 0.54 -0.30 -0.02 0.00 -0.00 0.00 0.00 29.16 29.38 2b3b h TRP 337 CO 0.04 0.29 -0.76 0.00 -0.00 0.00 0.00 178.44 178.01 2b3b h ARG 338 N 0.76 0.00 0.00 2.65 3.08 -0.83 -3.38 114.38 116.66 2b3b h ARG 338 Ca 0.53 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.38 2b3b h ARG 338 Cb 0.82 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.83 2b3b h ARG 338 CO -0.30 0.76 -1.80 -1.13 -1.07 0.00 0.00 179.97 176.42 2b3b n SER 339 N -3.38 2.04 -4.85 7.04 3.41 -0.83 -5.04 113.62 112.00 2b3b n SER 339 Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.30 2b3b n SER 339 Cb 0.81 0.87 -0.02 0.00 -0.26 0.00 0.00 64.21 65.61 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 -4.38 6.49 0.22 4.04 -0.87 -0.39 -5.02 114.94 115.03 2b3b s ASN 340 Ca -0.06 1.48 -0.31 0.00 -1.57 0.00 0.00 52.86 52.40 2b3b s ASN 340 Cb 0.04 -2.48 -0.12 0.00 -0.02 0.00 0.00 41.25 38.68 2b3b s ASN 340 CO 0.50 -0.66 1.67 -0.60 -2.57 0.00 0.00 177.10 175.44 2b3b s ARG 341 N -4.40 4.14 -0.19 -0.60 6.06 -0.49 -4.81 118.95 118.64 2b3b s ARG 341 Ca 0.57 2.56 -0.07 0.00 -2.50 0.00 0.00 55.73 56.29 2b3b s ARG 341 Cb -0.10 -3.07 -0.04 0.00 0.06 0.00 0.00 34.95 31.80 2b3b s ARG 341 CO 0.38 -0.70 0.06 0.42 -2.50 0.00 0.00 175.30 172.96 2b3b s ILE 342 N 0.90 4.67 0.35 4.11 -1.09 -1.26 -0.60 121.20 128.28 2b3b s ILE 342 Ca 0.71 -0.07 0.05 0.00 -2.23 0.00 0.00 60.65 59.11 2b3b s ILE 342 Cb -0.48 -3.11 -0.07 0.00 -1.58 0.00 0.00 42.46 37.21 2b3b s ILE 342 CO 0.35 0.44 0.04 0.68 -1.23 0.00 0.00 174.94 175.22 2b3b s VAL 343 N 0.60 1.44 0.14 2.92 -7.23 -0.75 -4.97 120.40 112.55 2b3b s VAL 343 Ca 0.03 -2.01 0.03 0.00 -1.81 0.00 0.00 61.98 58.22 2b3b s VAL 343 Cb -0.13 -2.84 -0.04 0.00 0.56 0.00 0.00 36.38 33.93 2b3b s VAL 343 CO 0.01 -0.01 0.21 -0.83 -0.31 0.00 0.00 175.10 174.17 2b3b s GLY 344 N -3.55 1.80 0.27 2.32 0.00 -1.26 -0.97 107.32 105.93 2b3b s GLY 344 Ca 0.36 -1.06 -0.23 0.00 0.00 0.00 0.00 44.72 43.79 2b3b s GLY 344 CO 0.16 -1.06 0.84 -0.45 0.00 0.00 0.00 173.10 172.60 2b3b s SER 345 N -3.02 7.24 -0.14 1.64 0.15 -0.72 -4.74 113.70 114.11 2b3b s SER 345 Ca 0.33 1.65 -0.19 0.00 0.70 0.00 0.00 55.95 58.45 2b3b s SER 345 Cb -0.11 -2.51 -0.17 0.00 -1.71 0.00 0.00 66.02 61.52 2b3b s SER 345 CO 0.26 -0.00 0.43 0.25 1.20 0.00 0.00 173.24 175.39 2b3b h LEU 346 N 3.38 0.00 -1.78 3.45 5.85 -1.96 -1.90 115.31 122.36 2b3b h LEU 346 Ca -0.47 -0.60 -0.03 0.00 0.84 0.00 0.00 57.88 57.61 2b3b h LEU 346 Cb 1.19 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 2b3b h LEU 346 CO 0.65 0.90 -0.14 0.58 -0.34 0.00 0.00 178.44 180.09 2b3b h VAL 347 N -1.00 0.97 -0.36 1.05 2.07 -1.95 -2.66 116.25 114.37 2b3b h VAL 347 Ca -0.04 -0.52 -0.20 0.00 0.82 0.00 0.00 66.70 66.76 2b3b h VAL 347 Cb 0.72 1.29 -0.12 0.00 -1.52 0.00 0.00 31.29 31.66 2b3b h VAL 347 CO -0.02 0.14 -0.16 1.41 0.02 0.00 0.00 177.57 178.96 2b3b n HIS 348 N -4.17 1.14 -0.31 1.57 8.25 -1.26 -4.98 115.22 115.46 2b3b n HIS 348 Ca -0.02 -1.69 0.00 0.00 -0.26 0.00 0.00 57.72 55.74 2b3b n HIS 348 Cb 0.22 -0.49 0.00 0.00 1.12 0.00 0.00 29.99 30.84 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 -1.09 1.38 0.12 -1.41 0.00 -1.00 -4.66 105.19 98.52 2b3b n GLY 349 Ca 0.33 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.23 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 -1.43 -0.61 119.26 122.05 2b3b h ALA 350 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2b3b h ALA 350 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2b3b h ALA 350 CO 0.00 -0.02 -1.40 1.33 0.00 0.00 0.00 179.25 179.16 2b3b n VAL 351 N -4.69 0.00 -4.18 0.00 0.24 -0.92 -1.90 118.33 106.88 2b3b n VAL 351 Ca -0.05 -0.29 -0.16 0.00 -2.04 0.00 0.00 64.34 61.80 2b3b n VAL 351 Cb 0.25 0.41 -0.13 0.00 -1.47 0.00 0.00 33.84 32.91 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 0.81 0.67 2.33 0.00 -1.26 -4.86 121.76 116.57 2b3b s ALA 352 Ca -0.02 -0.73 -0.14 0.00 0.00 0.00 0.00 51.96 51.07 2b3b s ALA 352 Cb 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.16 2b3b s ALA 352 CO 0.64 0.10 1.09 -1.25 0.00 0.00 0.00 175.76 176.34 2b3b s PRO 353 N -1.23 2.83 0.50 0.00 0.04 -1.26 -3.75 135.00 132.12 2b3b s PRO 353 Ca -0.03 1.28 0.22 0.00 0.04 0.00 0.00 61.00 62.51 2b3b s PRO 353 Cb -0.08 -1.96 1.30 0.00 0.04 0.00 0.00 34.50 33.80 2b3b s PRO 353 CO 0.01 -1.21 1.98 0.93 0.04 0.00 0.00 177.00 178.75 2b3b h GLU 354 N -0.14 0.11 -0.90 4.56 5.08 -1.85 0.51 114.58 121.95 2b3b h GLU 354 Ca -0.46 -0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.00 2b3b h GLU 354 Cb 1.24 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 30.39 2b3b h GLU 354 CO 0.55 0.07 0.58 0.66 -1.00 0.00 0.00 179.01 179.87 2b3b h SER 355 N 0.11 0.79 0.04 1.42 4.64 -1.91 0.23 113.55 118.87 2b3b h SER 355 Ca 0.28 0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.50 2b3b h SER 355 Cb 0.94 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 2b3b h SER 355 CO -0.03 0.45 -0.65 0.15 -0.87 0.00 0.00 176.83 175.88 2b3b h PHE 356 N 0.87 0.15 -0.62 4.77 3.57 -1.33 -3.35 116.94 121.00 2b3b h PHE 356 Ca 0.43 -0.11 0.09 0.00 3.53 0.00 0.00 57.97 61.91 2b3b h PHE 356 Cb 0.46 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 39.12 2b3b h PHE 356 CO -0.00 1.25 0.24 0.52 -2.23 0.00 0.00 178.31 178.10 2b3b h MET 357 N -0.79 0.42 0.00 1.11 2.86 -0.90 -1.66 114.93 115.97 2b3b h MET 357 Ca -0.15 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 2b3b h MET 357 Cb 1.29 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.86 2b3b h MET 357 CO -0.02 0.28 -0.09 0.66 1.06 0.00 0.00 176.91 178.80 2b3b h SER 358 N 0.43 0.00 0.39 1.22 4.64 -0.74 -2.55 113.55 116.94 2b3b h SER 358 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 2b3b h SER 358 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2b3b h SER 358 CO -0.30 0.09 -1.01 0.00 -0.87 0.00 0.00 176.83 174.74 2b3b n GLN 359 N -3.85 0.25 0.21 4.77 6.02 -0.68 -4.17 117.38 119.93 2b3b n GLN 359 Ca -0.02 -0.01 0.05 0.00 -0.01 0.00 0.00 57.00 57.01 2b3b n GLN 359 Cb 0.19 -1.58 0.45 0.00 1.02 0.00 0.00 30.24 30.33 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 -0.95 1.08 3.57 -0.96 -1.46 116.94 118.22 2b3b h PHE 360 Ca 0.00 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.59 2b3b h PHE 360 Cb 0.70 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.37 2b3b h PHE 360 CO 0.00 0.29 0.61 0.78 -2.23 0.00 0.00 178.31 177.76 2b3b h GLY 361 N 1.05 1.44 1.10 2.40 0.00 -1.72 0.08 103.07 107.42 2b3b h GLY 361 Ca -0.00 -0.42 -0.18 0.00 0.00 0.00 0.00 47.33 46.73 2b3b h GLY 361 CO 0.04 0.25 -0.55 -0.84 0.00 0.00 0.00 176.54 175.43 2b3b h THR 362 N 1.01 1.29 -0.44 4.70 2.02 -1.53 -1.15 112.91 118.81 2b3b h THR 362 Ca 0.43 -1.74 0.05 0.00 0.77 0.00 0.00 66.41 65.92 2b3b h THR 362 Cb 0.33 1.73 -0.05 0.00 -1.74 0.00 0.00 68.15 68.43 2b3b h THR 362 CO -0.19 0.56 0.17 0.58 0.37 0.00 0.00 175.52 177.01 2b3b h VAL 363 N 0.57 0.88 -0.65 3.16 2.07 -1.16 -0.84 116.25 120.28 2b3b h VAL 363 Ca 0.00 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.40 2b3b h VAL 363 Cb 1.16 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 2b3b h VAL 363 CO 0.12 0.06 0.42 -0.03 0.02 0.00 0.00 177.57 178.16 2b3b h MET 364 N 0.35 0.87 -0.39 1.57 4.05 -0.69 -1.09 114.93 119.60 2b3b h MET 364 Ca 0.20 -0.06 0.04 0.00 -0.28 0.00 0.00 59.70 59.60 2b3b h MET 364 Cb 0.18 -0.19 -0.04 0.00 -0.80 0.00 0.00 31.60 30.75 2b3b h MET 364 CO -0.19 0.60 0.18 0.93 0.23 0.00 0.00 176.91 178.65 2b3b h GLU 365 N 0.89 0.35 -0.67 0.39 5.08 -0.86 -0.52 114.58 119.24 2b3b h GLU 365 Ca 0.24 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.60 2b3b h GLU 365 Cb -0.07 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.06 2b3b h GLU 365 CO -0.05 0.23 0.42 0.82 -1.00 0.00 0.00 179.01 179.44 2b3b h ILE 366 N 0.36 1.11 -0.36 3.13 2.04 -0.75 0.60 117.51 123.64 2b3b h ILE 366 Ca 0.17 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 2b3b h ILE 366 Cb 0.10 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 2b3b h ILE 366 CO -0.14 0.15 0.22 0.15 0.00 0.00 0.00 178.15 178.53 2b3b h PHE 367 N 0.84 0.47 -0.82 1.37 3.57 -0.89 0.53 116.94 122.02 2b3b h PHE 367 Ca 0.26 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.81 2b3b h PHE 367 Cb -0.01 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.52 2b3b h PHE 367 CO -0.04 0.34 0.52 -0.07 -2.23 0.00 0.00 178.31 176.82 2b3b h LEU 368 N 0.47 0.83 -0.02 0.59 -0.00 -0.22 1.29 115.31 118.24 2b3b h LEU 368 Ca 0.13 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 58.00 2b3b h LEU 368 Cb 0.00 -0.17 0.00 0.00 -0.00 0.00 0.00 40.66 40.49 2b3b h LEU 368 CO -0.02 0.56 -0.05 1.56 -0.00 0.00 0.00 178.44 180.49 2b3b h GLN 369 N 0.98 0.07 0.00 1.13 4.20 -0.80 -3.36 115.11 117.33 2b3b h GLN 369 Ca 0.34 -0.05 -0.19 0.00 0.06 0.00 0.00 58.65 58.82 2b3b h GLN 369 Cb 0.07 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.83 2b3b h GLN 369 CO -0.14 0.63 -1.26 1.79 -0.67 0.00 0.00 178.83 179.18 2b3b h THR 370 N -0.49 0.77 -5.13 -0.54 1.35 -0.77 -3.48 112.91 104.62 2b3b h THR 370 Ca 0.00 -2.34 -0.28 0.00 -0.55 0.00 0.00 66.41 63.24 2b3b h THR 370 Cb 0.63 2.27 -0.07 0.00 -1.73 0.00 0.00 68.15 69.25 2b3b h THR 370 CO 0.01 0.44 -0.40 0.54 -0.25 0.00 0.00 175.52 175.86 2b3b n ARG 371 N -3.03 -2.77 -3.63 4.72 5.12 0.44 -4.93 116.66 112.57 2b3b n ARG 371 Ca -0.08 0.36 -0.40 0.00 -1.93 0.00 0.00 57.85 55.80 2b3b n ARG 371 Cb 0.88 -4.98 -0.11 0.00 -1.16 0.00 0.00 32.46 27.09 2b3b n ARG 371 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 2b3b s ASN 372 N -2.44 5.60 0.34 0.55 3.84 -1.26 -4.98 114.94 116.59 2b3b s ASN 372 Ca 0.25 -1.29 0.04 0.00 0.21 0.00 0.00 52.86 52.08 2b3b s ASN 372 Cb -0.14 -1.97 0.68 0.00 -0.55 0.00 0.00 41.25 39.27 2b3b s ASN 372 CO 0.31 -0.45 1.94 -0.65 -2.79 0.00 0.00 177.10 175.46 2b3b h PRO 373 N 8.37 0.81 -0.40 0.43 0.11 -1.91 -2.55 132.00 136.86 2b3b h PRO 373 Ca -0.24 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.72 2b3b h PRO 373 Cb 1.09 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 2b3b h PRO 373 CO 0.70 0.54 -0.17 0.37 -0.21 0.00 0.00 178.00 179.23 2b3b h GLN 374 N 0.84 0.81 -0.51 1.05 5.75 -1.93 -0.99 115.11 120.12 2b3b h GLN 374 Ca 0.35 -0.35 -0.04 0.00 -0.15 0.00 0.00 58.65 58.47 2b3b h GLN 374 Cb 0.27 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.77 2b3b h GLN 374 CO -0.12 0.97 0.18 0.00 -2.65 0.00 0.00 178.83 177.21 2b3b h ALA 375 N 0.82 0.66 -0.09 3.38 0.00 -1.92 -0.29 119.26 121.82 2b3b h ALA 375 Ca 0.09 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2b3b h ALA 375 Cb 0.72 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2b3b h ALA 375 CO 0.05 0.30 0.04 0.00 0.00 0.00 0.00 179.25 179.64 2b3b h ALA 376 N 1.03 0.11 -0.40 0.00 0.00 -1.39 0.83 119.26 119.44 2b3b h ALA 376 Ca 0.17 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.08 2b3b h ALA 376 Cb 0.24 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 2b3b h ALA 376 CO -0.01 -0.32 -0.02 0.00 0.00 0.00 0.00 179.25 178.89 2b3b h ALA 377 N 0.91 0.35 -0.80 0.00 0.00 -1.10 -0.64 119.26 117.98 2b3b h ALA 377 Ca 0.03 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2b3b h ALA 377 Cb 0.12 0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2b3b h ALA 377 CO -0.00 -0.41 0.32 -0.91 0.00 0.00 0.00 179.25 178.25 2b3b h ASN 378 N 0.08 1.10 -0.12 0.00 2.35 -0.90 -1.40 115.58 116.69 2b3b h ASN 378 Ca 0.20 -0.17 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2b3b h ASN 378 Cb 0.29 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 2b3b h ASN 378 CO -0.35 0.98 0.06 0.00 -1.65 0.00 0.00 177.43 176.47 2b3b h ALA 379 N 1.17 0.15 -0.80 -0.83 0.00 -0.55 -0.22 119.26 118.18 2b3b h ALA 379 Ca 0.27 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.20 2b3b h ALA 379 Cb 0.22 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 2b3b h ALA 379 CO -0.02 -0.31 0.47 0.00 0.00 0.00 0.00 179.25 179.38 2b3b h ALA 380 N 0.97 1.12 -0.52 0.00 0.00 -0.94 -1.74 119.26 118.15 2b3b h ALA 380 Ca 0.04 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 2b3b h ALA 380 Cb 0.07 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2b3b h ALA 380 CO -0.01 0.15 -0.09 0.37 0.00 0.00 0.00 179.25 179.67 2b3b h GLN 381 N 0.83 0.97 -0.35 0.00 5.75 -1.02 -1.04 115.11 120.25 2b3b h GLN 381 Ca 0.37 -0.36 0.03 0.00 -0.15 0.00 0.00 58.65 58.54 2b3b h GLN 381 Cb 0.26 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.71 2b3b h GLN 381 CO -0.21 1.03 0.14 0.00 -2.65 0.00 0.00 178.83 177.14 2b3b h ALA 382 N 0.91 0.41 -0.18 3.38 0.00 -0.50 0.56 119.26 123.84 2b3b h ALA 382 Ca 0.13 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2b3b h ALA 382 Cb 0.65 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2b3b h ALA 382 CO 0.04 -0.25 0.10 0.82 0.00 0.00 0.00 179.25 179.97 2b3b h ILE 383 N 0.30 1.09 -0.76 0.00 2.04 -1.19 -0.36 117.51 118.63 2b3b h ILE 383 Ca 0.15 -0.24 0.11 0.00 1.00 0.00 0.00 64.86 65.88 2b3b h ILE 383 Cb 0.10 0.92 -0.08 0.00 -0.74 0.00 0.00 36.82 37.03 2b3b h ILE 383 CO -0.14 0.09 0.39 0.00 0.00 0.00 0.00 178.15 178.48 2b3b h ALA 384 N 1.01 1.08 -0.69 1.87 0.00 -0.90 -0.55 119.26 121.08 2b3b h ALA 384 Ca 0.06 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 2b3b h ALA 384 Cb 0.05 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2b3b h ALA 384 CO -0.01 -0.04 0.20 -0.44 0.00 0.00 0.00 179.25 178.95 2b3b h ASP 385 N 0.63 1.02 -0.35 0.00 3.32 -0.62 -0.48 116.42 119.94 2b3b h ASP 385 Ca 0.39 -0.22 -0.13 0.00 0.02 0.00 0.00 57.03 57.08 2b3b h ASP 385 Cb 0.44 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2b3b h ASP 385 CO -0.29 0.97 -0.27 1.56 -1.72 0.00 0.00 179.24 179.48 2b3b h GLN 386 N 1.02 0.87 -0.00 3.56 4.20 0.27 -3.07 115.11 121.95 2b3b h GLN 386 Ca 0.22 -0.39 0.00 0.00 0.06 0.00 0.00 58.65 58.54 2b3b h GLN 386 Cb 0.33 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.09 2b3b h GLN 386 CO -0.00 1.03 -0.35 1.33 -0.67 0.00 0.00 178.83 180.17 2b3b n VAL 387 N -4.09 0.00 -3.08 -0.54 0.24 -0.35 -4.97 118.33 105.55 2b3b n VAL 387 Ca -0.01 -0.04 -0.13 0.00 -2.04 0.00 0.00 64.34 62.13 2b3b n VAL 387 Cb 0.47 0.17 0.06 0.00 -1.47 0.00 0.00 33.84 33.07 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 1.44 -0.07 3.66 7.63 0.00 -0.34 -4.91 105.19 112.60 2b3b n GLY 388 Ca 0.08 -0.08 -0.51 0.00 0.00 0.00 0.00 46.02 45.52 2b3b n GLY 388 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2b3b n LEU 389 N -3.28 2.68 0.00 0.99 7.94 -0.33 -1.08 117.00 123.92 2b3b n LEU 389 Ca -0.10 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 55.86 2b3b n LEU 389 Cb 0.58 -1.29 0.00 0.00 0.53 0.00 0.00 43.42 43.24 2b3b n LEU 389 CO 0.42 -0.43 0.00 0.61 -1.11 0.00 0.00 177.39 176.88 2b3b n GLY 390 N 3.68 2.53 0.30 -3.96 0.00 -1.26 -4.59 105.19 101.90 2b3b n GLY 390 Ca 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.16 2b3b n GLY 390 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2b3b h ARG 391 N 1.01 0.99 0.00 1.61 0.11 -1.46 -3.49 114.38 113.16 2b3b h ARG 391 Ca 0.00 -0.28 0.00 0.00 0.10 0.00 0.00 59.98 59.80 2b3b h ARG 391 Cb 0.00 -0.11 0.00 0.00 1.11 0.00 0.00 29.97 30.97 2b3b h ARG 391 CO 0.00 0.95 0.00 1.28 0.10 0.00 0.00 179.97 182.30