#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 0.75 -0.12 3.17 1.02 -1.26 -0.28 119.74 123.02 2b3b s LYS 2 Ca 0.00 -1.21 -0.05 0.00 0.02 0.00 0.00 55.97 54.74 2b3b s LYS 2 Cb 0.00 0.25 0.06 0.00 -0.52 0.00 0.00 37.83 37.62 2b3b s LYS 2 CO 0.00 -0.19 0.25 -1.17 -0.92 0.00 0.00 175.35 173.32 2b3b s LEU 3 N -2.94 -0.27 -0.46 3.17 2.96 0.03 -4.80 118.68 116.38 2b3b s LEU 3 Ca 0.11 0.55 -0.12 0.00 -0.22 0.00 0.00 54.13 54.45 2b3b s LEU 3 Cb 0.07 0.63 0.09 0.00 0.50 0.00 0.00 46.19 47.48 2b3b s LEU 3 CO -0.07 -0.24 0.35 -0.70 -1.32 0.00 0.00 176.35 174.37 2b3b s GLU 4 N 2.40 2.76 -0.20 1.98 2.12 -1.26 -0.46 118.70 126.04 2b3b s GLU 4 Ca 0.02 -1.51 -0.16 0.00 0.36 0.00 0.00 54.97 53.68 2b3b s GLU 4 Cb -0.12 -3.99 -0.04 0.00 0.26 0.00 0.00 34.13 30.24 2b3b s GLU 4 CO -0.08 -1.07 0.40 0.42 -0.54 0.00 0.00 175.26 174.39 2b3b s ILE 5 N 1.51 5.20 -0.18 -3.70 1.01 -0.62 -2.13 121.20 122.29 2b3b s ILE 5 Ca 0.04 0.71 -0.04 0.00 0.00 0.00 0.00 60.65 61.36 2b3b s ILE 5 Cb -0.25 -3.73 -0.02 0.00 0.01 0.00 0.00 42.46 38.47 2b3b s ILE 5 CO 0.03 0.26 -0.03 0.12 0.00 0.00 0.00 174.94 175.32 2b3b s PHE 6 N 1.26 2.99 0.37 3.97 5.36 -0.51 -0.18 117.98 131.24 2b3b s PHE 6 Ca 0.19 -0.54 -0.13 0.00 -0.96 0.00 0.00 56.93 55.49 2b3b s PHE 6 Cb -0.15 -2.03 0.04 0.00 -0.34 0.00 0.00 43.02 40.55 2b3b s PHE 6 CO 0.08 -0.25 0.73 -1.54 -1.46 0.00 0.00 175.22 172.77 2b3b s SER 7 N 0.87 0.18 -0.24 6.13 1.04 -0.91 -0.54 113.70 120.23 2b3b s SER 7 Ca -0.00 -1.20 0.12 0.00 0.48 0.00 0.00 55.95 55.35 2b3b s SER 7 Cb -0.15 0.81 0.49 0.00 0.10 0.00 0.00 66.02 67.28 2b3b s SER 7 CO 0.02 -1.61 1.42 -2.67 0.98 0.00 0.00 173.24 171.38 2b3b n TRP 8 N -0.54 0.93 -2.18 5.02 2.14 -1.26 -0.70 117.44 120.85 2b3b n TRP 8 Ca -0.06 -1.34 -0.41 0.00 2.07 0.00 0.00 57.50 57.76 2b3b n TRP 8 Cb 0.60 -0.41 0.00 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 -0.97 2.69 -3.19 -2.67 8.01 -1.26 -4.62 117.44 115.43 2b3b n TRP 9 Ca 0.28 -2.79 -0.25 0.00 -1.31 0.00 0.00 57.50 53.44 2b3b n TRP 9 Cb 0.96 -1.82 -0.01 0.00 -2.01 0.00 0.00 31.31 28.43 2b3b n TRP 9 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2b3b s ALA 10 N -0.83 3.62 0.00 6.99 0.00 -1.26 -3.18 121.76 127.10 2b3b s ALA 10 Ca 0.47 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.64 2b3b s ALA 10 Cb 0.15 -2.24 0.00 0.00 0.00 0.00 0.00 23.12 21.03 2b3b s ALA 10 CO -0.05 -0.10 0.00 0.41 0.00 0.00 0.00 175.76 176.02 2b3b n GLY 11 N -1.88 3.34 0.00 0.00 0.00 -1.26 -1.60 105.19 103.80 2b3b n GLY 11 Ca -0.03 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 4.30 0.00 -0.27 1.61 5.68 -1.26 -1.36 116.55 125.25 2b3b n ASP 12 Ca 0.00 -0.69 0.14 0.00 -0.50 0.00 0.00 54.79 53.74 2b3b n ASP 12 Cb 0.00 0.00 0.49 0.00 -1.14 0.00 0.00 41.12 40.47 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 -0.99 1.03 0.15 0.11 1.02 -0.62 -4.50 120.64 116.84 2b3b n GLU 13 Ca 0.16 -0.54 0.05 0.00 -0.02 0.00 0.00 57.16 56.81 2b3b n GLU 13 Cb 0.07 -1.49 0.05 0.00 -0.02 0.00 0.00 31.44 30.05 2b3b n GLU 13 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2b3b h GLY 14 N 4.92 0.00 0.02 0.62 0.00 -1.17 -3.40 103.07 104.06 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 0.01 -2.55 0.00 0.00 0.00 176.54 174.00 2b3b h PRO 15 N 0.00 0.13 -0.15 4.80 0.11 -1.79 0.23 132.00 135.33 2b3b h PRO 15 Ca -0.02 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.11 2b3b h PRO 15 Cb 1.29 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 2b3b h PRO 15 CO 0.04 0.08 -0.00 0.00 -0.21 0.00 0.00 178.00 177.92 2b3b h ALA 16 N 1.53 0.13 -0.70 -0.75 0.00 -1.83 0.49 119.26 118.12 2b3b h ALA 16 Ca 0.30 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 2b3b h ALA 16 Cb 0.48 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2b3b h ALA 16 CO -0.49 -0.45 0.37 1.25 0.00 0.00 0.00 179.25 179.94 2b3b h LEU 17 N 0.05 0.89 -0.79 0.00 5.85 -1.69 -2.46 115.31 117.15 2b3b h LEU 17 Ca 0.07 -0.11 -0.08 0.00 0.84 0.00 0.00 57.88 58.60 2b3b h LEU 17 Cb 0.09 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 2b3b h LEU 17 CO -0.12 0.74 0.00 -0.33 -0.34 0.00 0.00 178.44 178.39 2b3b h GLU 18 N 0.97 0.91 -0.70 1.25 5.08 -0.06 -0.11 114.58 121.92 2b3b h GLU 18 Ca 0.25 -0.27 0.04 0.00 -1.00 0.00 0.00 59.36 58.38 2b3b h GLU 18 Cb 0.06 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.17 2b3b h GLU 18 CO -0.04 0.91 0.43 0.00 -1.00 0.00 0.00 179.01 179.31 2b3b h ALA 19 N 1.15 0.93 -0.51 3.43 0.00 -0.67 -1.90 119.26 121.69 2b3b h ALA 19 Ca 0.16 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 2b3b h ALA 19 Cb 0.50 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2b3b h ALA 19 CO 0.02 0.17 -0.08 1.25 0.00 0.00 0.00 179.25 180.61 2b3b h LEU 20 N 0.82 0.96 -0.96 0.00 5.85 -0.98 -2.19 115.31 118.81 2b3b h LEU 20 Ca 0.29 -0.34 -0.06 0.00 0.84 0.00 0.00 57.88 58.61 2b3b h LEU 20 Cb 0.08 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 2b3b h LEU 20 CO -0.13 1.08 0.09 0.40 -0.34 0.00 0.00 178.44 179.53 2b3b h ILE 21 N 0.83 1.23 -0.18 4.05 2.04 -0.84 0.11 117.51 124.75 2b3b h ILE 21 Ca 0.14 -0.90 -0.02 0.00 1.00 0.00 0.00 64.86 65.08 2b3b h ILE 21 Cb 0.64 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 2b3b h ILE 21 CO 0.04 0.33 0.04 0.03 0.00 0.00 0.00 178.15 178.59 2b3b h ARG 22 N 0.81 0.29 -0.16 2.37 3.08 -1.21 0.32 114.38 119.88 2b3b h ARG 22 Ca 0.17 -0.07 0.05 0.00 0.07 0.00 0.00 59.98 60.19 2b3b h ARG 22 Cb 0.36 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.32 2b3b h ARG 22 CO 0.01 0.43 -0.15 1.25 -1.07 0.00 0.00 179.97 180.44 2b3b h LEU 23 N 0.09 -0.48 -0.68 3.04 5.85 -1.03 0.45 115.31 122.55 2b3b h LEU 23 Ca 0.06 0.09 0.12 0.00 0.84 0.00 0.00 57.88 58.98 2b3b h LEU 23 Cb 0.28 0.23 -0.08 0.00 0.37 0.00 0.00 40.66 41.46 2b3b h LEU 23 CO 0.00 -0.20 0.25 0.22 -0.34 0.00 0.00 178.44 178.38 2b3b h TYR 24 N -0.18 0.44 -0.55 1.25 3.20 -0.62 -1.08 116.97 119.43 2b3b h TYR 24 Ca 0.10 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.93 2b3b h TYR 24 Cb 0.33 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 2b3b h TYR 24 CO -0.28 0.08 0.04 0.87 -1.64 0.00 0.00 178.16 177.23 2b3b h LYS 25 N 0.42 0.94 -0.22 1.82 1.57 -0.25 0.31 116.57 121.16 2b3b h LYS 25 Ca 0.36 -0.28 0.06 0.00 -1.87 0.00 0.00 60.65 58.92 2b3b h LYS 25 Cb 0.49 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 32.64 2b3b h LYS 25 CO -0.36 0.93 -0.32 1.96 -0.57 0.00 0.00 179.45 181.08 2b3b h GLN 26 N 0.82 -0.34 -0.06 3.15 4.20 -0.37 -2.85 115.11 119.66 2b3b h GLN 26 Ca 0.16 0.02 -0.10 0.00 0.06 0.00 0.00 58.65 58.79 2b3b h GLN 26 Cb 0.48 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 2b3b h GLN 26 CO 0.02 -0.22 -0.44 0.87 -0.67 0.00 0.00 178.83 178.39 2b3b h LYS 27 N -0.35 0.15 -2.76 1.46 1.57 -0.80 -3.37 116.57 112.46 2b3b h LYS 27 Ca 0.12 -0.07 -0.61 0.00 -1.87 0.00 0.00 60.65 58.22 2b3b h LYS 27 Cb 0.54 -0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.45 2b3b h LYS 27 CO -0.41 0.56 -0.77 0.71 -0.57 0.00 0.00 179.45 178.97 2b3b s TYR 28 N -4.06 2.32 0.71 -1.35 2.02 0.11 -5.10 117.35 111.99 2b3b s TYR 28 Ca -0.04 -2.80 -0.13 0.00 -0.37 0.00 0.00 57.07 53.73 2b3b s TYR 28 Cb 0.13 -1.84 0.02 0.00 -0.40 0.00 0.00 41.96 39.88 2b3b s TYR 28 CO 0.76 -0.69 1.10 -2.14 -1.57 0.00 0.00 175.55 173.01 2b3b s PRO 29 N -0.61 2.58 0.00 -1.71 0.02 -1.09 -3.11 135.00 131.07 2b3b s PRO 29 Ca 0.28 1.29 0.00 0.00 0.02 0.00 0.00 61.00 62.59 2b3b s PRO 29 Cb -0.03 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.56 2b3b s PRO 29 CO -0.16 -1.41 0.00 0.41 -0.33 0.00 0.00 177.00 175.51 2b3b n GLY 30 N -0.83 0.70 3.58 0.52 0.00 -1.26 -5.00 105.19 102.91 2b3b n GLY 30 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 2b3b n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b3b s VAL 31 N -3.01 5.23 -0.35 1.61 1.01 -1.18 -3.79 120.40 119.92 2b3b s VAL 31 Ca 0.00 0.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.95 2b3b s VAL 31 Cb 0.00 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.73 2b3b s VAL 31 CO 0.00 0.14 1.32 -0.70 0.00 0.00 0.00 175.10 175.86 2b3b s GLU 32 N 1.91 3.80 -0.30 2.72 2.12 0.61 -4.90 118.70 124.67 2b3b s GLU 32 Ca 0.11 1.11 -0.19 0.00 0.36 0.00 0.00 54.97 56.35 2b3b s GLU 32 Cb -0.16 -3.93 -0.01 0.00 0.26 0.00 0.00 34.13 30.29 2b3b s GLU 32 CO 0.11 -1.28 0.58 0.08 -0.54 0.00 0.00 175.26 174.21 2b3b s VAL 33 N 4.71 4.99 -0.41 3.70 1.01 -1.26 -0.79 120.40 132.35 2b3b s VAL 33 Ca 0.57 0.80 -0.20 0.00 0.00 0.00 0.00 61.98 63.15 2b3b s VAL 33 Cb -0.15 -3.94 0.01 0.00 0.00 0.00 0.00 36.38 32.30 2b3b s VAL 33 CO 0.27 -0.08 0.61 -0.63 0.00 0.00 0.00 175.10 175.27 2b3b s ILE 34 N 2.49 4.88 -1.05 2.22 1.09 0.39 -4.96 121.20 126.25 2b3b s ILE 34 Ca 0.23 0.23 -0.17 0.00 -1.10 0.00 0.00 60.65 59.84 2b3b s ILE 34 Cb -0.15 -4.13 0.14 0.00 -1.06 0.00 0.00 42.46 37.25 2b3b s ILE 34 CO 0.11 -0.47 1.29 0.21 -0.10 0.00 0.00 174.94 175.98 2b3b s ASN 35 N 1.91 6.78 -1.14 3.58 2.47 -1.26 -1.60 114.94 125.68 2b3b s ASN 35 Ca 0.22 -2.34 -0.16 0.00 0.42 0.00 0.00 52.86 50.99 2b3b s ASN 35 Cb -0.15 -2.42 0.14 0.00 -1.45 0.00 0.00 41.25 37.37 2b3b s ASN 35 CO 0.17 -0.99 1.41 0.00 -3.72 0.00 0.00 177.10 173.96 2b3b s ALA 36 N 2.56 3.68 0.24 1.71 0.00 0.74 -5.00 121.76 125.68 2b3b s ALA 36 Ca 0.38 -3.09 -0.16 0.00 0.00 0.00 0.00 51.96 49.09 2b3b s ALA 36 Cb -0.03 -4.21 -0.08 0.00 0.00 0.00 0.00 23.12 18.80 2b3b s ALA 36 CO -0.05 -2.95 0.67 0.95 0.00 0.00 0.00 175.76 174.38 2b3b s THR 37 N 2.43 4.71 -0.23 0.00 -4.23 -1.26 -2.13 115.64 114.93 2b3b s THR 37 Ca 0.42 0.96 0.02 0.00 -1.18 0.00 0.00 61.69 61.91 2b3b s THR 37 Cb -0.02 -3.71 0.04 0.00 1.34 0.00 0.00 72.50 70.15 2b3b s THR 37 CO -0.02 0.04 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.28 2b3b s VAL 38 N -1.71 2.25 0.20 2.29 1.01 0.12 -4.94 120.40 119.63 2b3b s VAL 38 Ca 0.46 -1.33 -0.30 0.00 0.00 0.00 0.00 61.98 60.81 2b3b s VAL 38 Cb -0.13 -2.18 -0.09 0.00 0.00 0.00 0.00 36.38 33.97 2b3b s VAL 38 CO 0.19 0.18 1.35 -0.89 0.00 0.00 0.00 175.10 175.94 2b3b s THR 39 N 1.19 3.07 0.00 3.92 2.01 -1.26 -4.35 115.64 120.22 2b3b s THR 39 Ca -0.03 0.87 0.00 0.00 0.31 0.00 0.00 61.69 62.84 2b3b s THR 39 Cb -0.17 -3.56 0.00 0.00 0.01 0.00 0.00 72.50 68.78 2b3b s THR 39 CO -0.07 0.12 0.00 0.61 -0.69 0.00 0.00 174.62 174.59 2b3b n GLY 40 N 2.46 2.45 3.65 4.40 0.00 -1.26 -4.72 105.19 112.16 2b3b n GLY 40 Ca 0.07 0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 0.14 2.66 -0.02 0.00 -1.26 -1.76 105.19 104.95 2b3b n GLY 41 Ca 0.00 0.18 -0.09 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.31 -0.14 -1.07 4.61 0.00 -1.26 -3.46 120.51 118.88 2b3b n ALA 42 Ca 0.08 0.15 -0.02 0.00 0.00 0.00 0.00 53.44 53.65 2b3b n ALA 42 Cb 0.39 -1.60 -0.01 0.00 0.00 0.00 0.00 19.45 18.22 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 0.27 0.57 0.21 0.00 0.00 -0.72 -4.91 105.19 100.60 2b3b n GLY 43 Ca -0.09 -0.39 -0.15 0.00 0.00 0.00 0.00 46.02 45.39 2b3b n GLY 43 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2b3b h VAL 44 N 0.00 0.68 -0.83 1.61 2.07 -1.72 -0.51 116.25 117.55 2b3b h VAL 44 Ca -0.05 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 2b3b h VAL 44 Cb 0.30 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 2b3b h VAL 44 CO 0.07 0.03 0.47 0.78 0.02 0.00 0.00 177.57 178.94 2b3b h ASN 45 N -0.52 1.02 -0.91 0.57 2.35 -1.84 -2.83 115.58 113.42 2b3b h ASN 45 Ca -0.05 -0.09 -0.02 0.00 -0.55 0.00 0.00 56.30 55.60 2b3b h ASN 45 Cb 0.39 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.46 2b3b h ASN 45 CO 0.08 0.82 0.50 0.00 -1.65 0.00 0.00 177.43 177.17 2b3b h ALA 46 N 1.25 1.16 -0.39 -0.83 0.00 -1.71 -2.67 119.26 116.06 2b3b h ALA 46 Ca 0.29 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.16 2b3b h ALA 46 Cb 0.01 -0.36 -0.09 0.00 0.00 0.00 0.00 17.79 17.35 2b3b h ALA 46 CO -0.05 0.66 -0.20 0.00 0.00 0.00 0.00 179.25 179.66 2b3b h ARG 47 N 1.27 -0.13 -0.22 0.00 3.08 -0.84 0.31 114.38 117.85 2b3b h ARG 47 Ca 0.32 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.37 2b3b h ARG 47 Cb 0.02 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 2b3b h ARG 47 CO -0.05 -0.09 0.11 0.00 -1.07 0.00 0.00 179.97 178.87 2b3b h ALA 48 N 1.11 0.29 -0.68 0.04 0.00 -1.46 -0.13 119.26 118.43 2b3b h ALA 48 Ca 0.19 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2b3b h ALA 48 Cb 0.43 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2b3b h ALA 48 CO -0.47 -0.16 0.39 0.28 0.00 0.00 0.00 179.25 179.29 2b3b h VAL 49 N 0.23 1.20 -0.54 0.00 2.07 -1.18 -2.52 116.25 115.52 2b3b h VAL 49 Ca 0.08 -0.47 -0.07 0.00 0.82 0.00 0.00 66.70 67.05 2b3b h VAL 49 Cb 0.11 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 2b3b h VAL 49 CO -0.01 0.21 0.06 0.25 0.02 0.00 0.00 177.57 178.10 2b3b h LEU 50 N 0.92 0.89 -0.18 2.57 5.85 -0.72 -2.37 115.31 122.27 2b3b h LEU 50 Ca 0.24 -0.28 0.04 0.00 0.84 0.00 0.00 57.88 58.72 2b3b h LEU 50 Cb -0.00 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 2b3b h LEU 50 CO -0.04 0.95 -0.07 0.50 -0.34 0.00 0.00 178.44 179.43 2b3b h LYS 51 N 0.80 -0.04 -0.29 1.25 3.64 -0.82 0.85 116.57 121.96 2b3b h LYS 51 Ca 0.16 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.50 2b3b h LYS 51 Cb 0.46 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.27 2b3b h LYS 51 CO 0.02 -0.03 -0.02 0.00 -2.27 0.00 0.00 179.45 177.14 2b3b h THR 52 N -0.05 1.19 0.27 1.00 1.03 -1.28 -0.65 112.91 114.42 2b3b h THR 52 Ca 0.10 -0.75 -0.01 0.00 -0.01 0.00 0.00 66.41 65.74 2b3b h THR 52 Cb 0.19 0.99 0.00 0.00 -1.07 0.00 0.00 68.15 68.27 2b3b h THR 52 CO -0.21 0.25 -0.13 0.03 -0.01 0.00 0.00 175.52 175.45 2b3b h ARG 53 N 0.43 -0.35 -0.16 0.00 3.08 -0.88 -2.16 114.38 114.34 2b3b h ARG 53 Ca 0.09 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.17 2b3b h ARG 53 Cb 0.32 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 2b3b h ARG 53 CO 0.01 -0.09 0.10 0.52 -1.07 0.00 0.00 179.97 179.44 2b3b h MET 54 N -0.57 0.20 0.00 0.04 2.86 -0.62 -0.31 114.93 116.52 2b3b h MET 54 Ca -0.04 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2b3b h MET 54 Cb 0.42 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.03 2b3b h MET 54 CO 0.06 0.13 0.00 1.28 1.06 0.00 0.00 176.91 179.44 2b3b n LEU 55 N -4.99 0.36 -1.39 1.22 4.77 -0.27 -2.16 117.00 114.55 2b3b n LEU 55 Ca -0.04 0.60 0.11 0.00 -0.03 0.00 0.00 56.01 56.65 2b3b n LEU 55 Cb 0.03 -0.56 0.33 0.00 -2.33 0.00 0.00 43.42 40.89 2b3b n LEU 55 CO 0.33 -0.46 0.78 0.61 -1.33 0.00 0.00 177.39 177.33 2b3b n GLY 56 N -0.16 2.59 2.15 -0.72 0.00 -0.80 -4.96 105.19 103.30 2b3b n GLY 56 Ca 0.02 -0.80 -0.07 0.00 0.00 0.00 0.00 46.02 45.18 2b3b n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b3b n GLY 57 N 1.47 0.19 2.46 -0.02 0.00 -0.92 -4.98 105.19 103.39 2b3b n GLY 57 Ca 0.24 -0.61 -0.22 0.00 0.00 0.00 0.00 46.02 45.44 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 0.67 2.17 -4.75 1.61 2.03 -0.19 -5.03 116.55 113.05 2b3b n ASP 58 Ca -0.08 -3.25 -0.37 0.00 0.52 0.00 0.00 54.79 51.61 2b3b n ASP 58 Cb 0.52 -0.60 0.04 0.00 -0.72 0.00 0.00 41.12 40.35 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 -2.74 3.03 1.06 -0.67 0.04 -1.26 -4.43 135.00 130.03 2b3b s PRO 59 Ca 0.43 1.98 -0.16 0.00 0.04 0.00 0.00 61.00 63.29 2b3b s PRO 59 Cb 0.31 -2.06 0.22 0.00 0.04 0.00 0.00 34.50 33.01 2b3b s PRO 59 CO -0.10 -1.20 1.16 -1.25 0.04 0.00 0.00 177.00 175.65 2b3b s PRO 60 N -3.14 -0.08 0.26 0.56 0.04 -1.26 -4.68 135.00 126.70 2b3b s PRO 60 Ca 0.75 0.01 0.03 0.00 0.04 0.00 0.00 61.00 61.83 2b3b s PRO 60 Cb -0.34 -1.72 0.33 0.00 0.04 0.00 0.00 34.50 32.81 2b3b s PRO 60 CO 0.39 -2.97 1.63 -0.44 0.04 0.00 0.00 177.00 175.66 2b3b h ASP 61 N -2.05 0.37 -5.00 6.66 3.32 -1.81 -3.43 116.42 114.48 2b3b h ASP 61 Ca -0.47 -0.17 -0.06 0.00 0.02 0.00 0.00 57.03 56.35 2b3b h ASP 61 Cb 1.29 -0.10 -0.18 0.00 0.22 0.00 0.00 39.33 40.56 2b3b h ASP 61 CO 0.44 0.77 0.13 0.28 -1.72 0.00 0.00 179.24 179.14 2b3b s THR 62 N -4.10 0.01 0.00 0.35 -1.32 -1.17 -4.22 115.64 105.20 2b3b s THR 62 Ca -0.05 -0.08 0.01 0.00 -1.21 0.00 0.00 61.69 60.36 2b3b s THR 62 Cb 0.13 -0.96 -0.01 0.00 -1.51 0.00 0.00 72.50 70.15 2b3b s THR 62 CO 0.79 -0.05 -0.04 0.72 -2.21 0.00 0.00 174.62 173.84 2b3b s PHE 63 N -1.73 0.37 0.23 9.09 -0.12 -1.26 -1.42 117.98 123.13 2b3b s PHE 63 Ca -0.09 -0.11 -0.32 0.00 -0.05 0.00 0.00 56.93 56.36 2b3b s PHE 63 Cb -0.01 -0.24 -0.12 0.00 -0.63 0.00 0.00 43.02 42.03 2b3b s PHE 63 CO 0.05 -0.02 1.64 0.94 -0.05 0.00 0.00 175.22 177.78 2b3b n GLN 64 N 2.83 2.62 -3.68 1.99 7.27 0.30 -4.08 117.38 124.62 2b3b n GLN 64 Ca -0.14 0.94 -0.14 0.00 0.07 0.00 0.00 57.00 57.73 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 0.68 0.01 0.06 1.69 0.11 0.31 -4.94 120.40 118.32 2b3b s VAL 65 Ca 0.72 -0.11 -0.30 0.00 -2.93 0.00 0.00 61.98 59.35 2b3b s VAL 65 Cb -0.54 -0.75 -0.04 0.00 -1.53 0.00 0.00 36.38 33.52 2b3b s VAL 65 CO 0.39 -0.06 0.98 -1.00 -3.33 0.00 0.00 175.10 172.08 2b3b s HIS 66 N -0.39 3.73 0.34 1.54 3.76 -1.26 -0.67 115.29 122.34 2b3b s HIS 66 Ca -0.05 1.74 -0.29 0.00 -0.15 0.00 0.00 55.06 56.31 2b3b s HIS 66 Cb -0.03 -3.10 -0.11 0.00 1.11 0.00 0.00 32.58 30.45 2b3b s HIS 66 CO 0.03 0.07 1.54 0.00 -0.85 0.00 0.00 174.74 175.53 2b3b s ALA 67 N 0.52 3.65 0.00 -1.40 0.00 -0.48 -2.67 121.76 121.38 2b3b s ALA 67 Ca 0.50 1.58 0.00 0.00 0.00 0.00 0.00 51.96 54.04 2b3b s ALA 67 Cb -0.22 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.27 2b3b s ALA 67 CO 0.29 -1.04 0.00 0.41 0.00 0.00 0.00 175.76 175.42 2b3b n GLY 68 N 1.15 0.35 0.24 0.00 0.00 -0.80 -3.79 105.19 102.35 2b3b n GLY 68 Ca 0.04 -1.84 0.11 0.00 0.00 0.00 0.00 46.02 44.33 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 -0.14 1.61 2.86 -0.82 -1.79 114.93 116.65 2b3b h MET 69 Ca 0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2b3b h MET 69 Cb 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 2b3b h MET 69 CO 0.00 0.17 0.02 1.49 1.06 0.00 0.00 176.91 179.65 2b3b h GLU 70 N 0.00 0.23 0.39 1.72 4.81 -1.19 -1.07 114.58 119.46 2b3b h GLU 70 Ca -0.00 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 2b3b h GLU 70 Cb 0.50 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2b3b h GLU 70 CO 0.02 0.43 -0.21 1.25 -0.73 0.00 0.00 179.01 179.77 2b3b h LEU 71 N -0.00 -0.50 -0.15 1.64 5.85 -1.26 -3.19 115.31 117.69 2b3b h LEU 71 Ca 0.04 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 2b3b h LEU 71 Cb 0.31 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.48 2b3b h LEU 71 CO 0.00 -0.34 -0.06 0.40 -0.34 0.00 0.00 178.44 178.11 2b3b h ILE 72 N -0.55 1.30 -0.00 4.05 1.08 -1.29 -3.04 117.51 119.07 2b3b h ILE 72 Ca -0.05 -1.06 0.00 0.00 -0.39 0.00 0.00 64.86 63.36 2b3b h ILE 72 Cb 0.44 1.70 0.00 0.00 -3.07 0.00 0.00 36.82 35.89 2b3b h ILE 72 CO 0.07 0.31 -0.01 0.61 -0.69 0.00 0.00 178.15 178.44 2b3b n GLY 73 N -0.05 -1.01 0.23 5.37 0.00 -0.41 -0.98 105.19 108.34 2b3b n GLY 73 Ca -0.06 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.00 0.00 0.04 2.61 -1.04 -1.18 -4.81 114.28 108.90 2b3b n THR 74 Ca 0.20 0.10 0.03 0.00 -2.04 0.00 0.00 64.05 62.34 2b3b n THR 74 Cb 0.18 -0.94 -0.07 0.00 -1.82 0.00 0.00 70.33 67.68 2b3b n THR 74 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 2b3b n TRP 75 N -1.76 0.87 -0.04 -1.42 5.03 -1.16 -3.18 117.44 115.79 2b3b n TRP 75 Ca 0.00 0.28 -0.15 0.00 3.03 0.00 0.00 57.50 60.66 2b3b n TRP 75 Cb 0.00 -1.01 -0.12 0.00 -1.03 0.00 0.00 31.31 29.15 2b3b n TRP 75 CO 0.00 0.00 0.00 0.28 -0.03 0.00 0.00 177.69 177.94 2b3b h VAL 76 N 0.00 1.61 0.00 -0.99 2.07 -1.54 0.34 116.25 117.73 2b3b h VAL 76 Ca -0.13 -1.99 -0.04 0.00 0.82 0.00 0.00 66.70 65.37 2b3b h VAL 76 Cb 1.42 2.91 -0.01 0.00 -1.52 0.00 0.00 31.29 34.09 2b3b h VAL 76 CO 0.03 0.53 -0.17 0.58 0.02 0.00 0.00 177.57 178.56 2b3b h VAL 77 N -0.67 0.80 -0.01 2.57 2.07 -1.21 -0.36 116.25 119.44 2b3b h VAL 77 Ca -0.02 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.83 2b3b h VAL 77 Cb 0.95 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.12 2b3b h VAL 77 CO 0.03 0.17 0.00 0.00 0.02 0.00 0.00 177.57 177.79 2b3b n ALA 78 N -2.36 2.57 -3.98 1.67 0.00 -1.19 -4.90 120.51 112.31 2b3b n ALA 78 Ca -0.02 -0.09 -0.31 0.00 0.00 0.00 0.00 53.44 53.03 2b3b n ALA 78 Cb 0.27 -1.19 0.01 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 -0.65 -3.75 -0.72 0.00 3.02 -0.15 -4.89 115.26 108.14 2b3b n ASN 79 Ca 0.09 -0.86 0.10 0.00 -0.03 0.00 0.00 54.58 53.88 2b3b n ASN 79 Cb 0.05 -3.55 0.07 0.00 -0.61 0.00 0.00 39.78 35.73 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 -4.55 1.70 -4.48 3.52 5.12 0.10 -4.98 116.66 113.08 2b3b n ARG 80 Ca -0.01 -1.52 -0.30 0.00 -1.93 0.00 0.00 57.85 54.09 2b3b n ARG 80 Cb 0.54 -1.38 -0.12 0.00 -1.16 0.00 0.00 32.46 30.35 2b3b n ARG 80 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 2b3b s MET 81 N -1.75 1.88 0.26 5.56 -1.94 -1.23 -1.06 119.30 121.02 2b3b s MET 81 Ca 0.22 -1.10 -0.29 0.00 -1.71 0.00 0.00 55.69 52.80 2b3b s MET 81 Cb 0.16 -2.13 -0.09 0.00 2.01 0.00 0.00 34.83 34.78 2b3b s MET 81 CO 0.29 0.50 0.95 -1.21 -0.01 0.00 0.00 175.02 175.55 2b3b s GLU 82 N -1.80 4.78 0.13 2.03 2.02 0.06 -4.77 118.70 121.15 2b3b s GLU 82 Ca 0.16 1.48 -0.31 0.00 0.02 0.00 0.00 54.97 56.32 2b3b s GLU 82 Cb -0.10 -3.17 -0.08 0.00 0.10 0.00 0.00 34.13 30.88 2b3b s GLU 82 CO 0.07 0.44 1.39 0.34 0.02 0.00 0.00 175.26 177.53 2b3b s ASP 83 N -1.26 6.82 0.00 -0.19 2.15 -1.26 -4.66 116.67 118.27 2b3b s ASP 83 Ca 0.43 2.36 0.20 0.00 0.43 0.00 0.00 52.55 55.97 2b3b s ASP 83 Cb -0.25 -2.59 0.49 0.00 -0.30 0.00 0.00 42.92 40.27 2b3b s ASP 83 CO 0.31 -0.65 1.41 0.18 -0.17 0.00 0.00 175.17 176.25 2b3b n LEU 84 N 3.78 3.53 -0.26 -1.34 4.77 0.10 -4.59 117.00 123.00 2b3b n LEU 84 Ca 0.11 -1.80 0.03 0.00 -0.03 0.00 0.00 56.01 54.32 2b3b n LEU 84 Cb 0.42 -0.35 0.11 0.00 -2.33 0.00 0.00 43.42 41.28 2b3b n LEU 84 CO 0.59 0.84 0.75 0.28 -1.33 0.00 0.00 177.39 178.51 2b3b h SER 85 N 3.84 -0.58 -0.34 -1.43 0.02 -1.92 -0.22 113.55 112.93 2b3b h SER 85 Ca 0.00 0.22 -0.10 0.00 -0.84 0.00 0.00 61.79 61.06 2b3b h SER 85 Cb 0.92 0.42 -0.02 0.00 0.14 0.00 0.00 62.40 63.87 2b3b h SER 85 CO 0.00 -0.23 -0.14 0.00 -1.14 0.00 0.00 176.83 175.32 2b3b h ALA 86 N 1.74 0.95 -0.51 3.77 0.00 -1.95 -1.86 119.26 121.39 2b3b h ALA 86 Ca 0.38 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2b3b h ALA 86 Cb 0.61 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2b3b h ALA 86 CO -0.74 0.61 0.20 1.25 0.00 0.00 0.00 179.25 180.57 2b3b h LEU 87 N 0.71 0.70 -0.95 0.00 5.85 -1.58 0.34 115.31 120.38 2b3b h LEU 87 Ca 0.11 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.68 2b3b h LEU 87 Cb 0.64 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 2b3b h LEU 87 CO 0.04 0.69 0.63 -0.26 -0.34 0.00 0.00 178.44 179.20 2b3b h PHE 88 N 0.68 1.18 0.52 1.25 -1.00 -0.87 -0.01 116.94 118.69 2b3b h PHE 88 Ca 0.17 0.03 -0.02 0.00 2.81 0.00 0.00 57.97 60.95 2b3b h PHE 88 Cb 0.21 -0.40 0.00 0.00 3.61 0.00 0.00 35.95 39.37 2b3b h PHE 88 CO 0.01 0.72 -0.27 -0.09 -1.61 0.00 0.00 178.31 177.07 2b3b h ARG 89 N 1.26 -0.69 -0.94 1.51 9.65 -1.14 0.27 114.38 124.29 2b3b h ARG 89 Ca 0.36 0.05 0.12 0.00 -1.10 0.00 0.00 59.98 59.41 2b3b h ARG 89 Cb -0.10 0.16 -0.08 0.00 -1.39 0.00 0.00 29.97 28.57 2b3b h ARG 89 CO -0.09 -0.46 0.60 1.96 2.80 0.00 0.00 179.97 184.78 2b3b h GLN 90 N -0.72 0.85 0.00 0.20 4.20 -0.47 -2.82 115.11 116.35 2b3b h GLN 90 Ca -0.07 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2b3b h GLN 90 Cb 0.56 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.15 2b3b h GLN 90 CO 0.10 0.56 -0.82 0.39 -0.67 0.00 0.00 178.83 178.40 2b3b n GLU 91 N -4.58 0.18 -1.71 1.46 -0.58 -0.06 -4.97 120.64 110.38 2b3b n GLU 91 Ca 0.18 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.93 2b3b n GLU 91 Cb 0.38 -1.57 0.00 0.00 -0.57 0.00 0.00 31.44 29.68 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 1.41 0.75 0.01 0.62 0.00 -0.43 -4.99 105.19 102.55 2b3b n GLY 92 Ca 0.03 -0.68 0.11 0.00 0.00 0.00 0.00 46.02 45.49 2b3b n GLY 92 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2b3b n TRP 93 N -3.10 0.06 0.18 1.61 8.01 0.83 -4.20 117.44 120.83 2b3b n TRP 93 Ca 0.00 0.02 0.04 0.00 -1.31 0.00 0.00 57.50 56.25 2b3b n TRP 93 Cb 0.40 -0.21 0.46 0.00 -2.01 0.00 0.00 31.31 29.95 2b3b n TRP 93 CO 0.00 0.00 0.00 1.37 -1.01 0.00 0.00 177.69 178.05 2b3b h LEU 94 N 0.00 0.09 -3.01 -0.99 8.10 -1.94 -0.77 115.31 116.79 2b3b h LEU 94 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 57.88 57.97 2b3b h LEU 94 Cb 0.55 -0.02 0.00 0.00 -0.44 0.00 0.00 40.66 40.75 2b3b h LEU 94 CO 0.00 0.25 0.00 0.00 -4.11 0.00 0.00 178.44 174.58 2b3b n GLN 95 N -4.31 2.87 0.15 0.17 6.02 -1.26 -4.54 117.38 116.47 2b3b n GLN 95 Ca -0.02 -2.27 0.11 0.00 -0.01 0.00 0.00 57.00 54.82 2b3b n GLN 95 Cb 0.25 -1.43 0.06 0.00 1.02 0.00 0.00 30.24 30.14 2b3b n GLN 95 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b3b h ALA 96 N 1.80 0.69 -3.68 -1.58 0.00 -1.30 -3.47 119.26 111.73 2b3b h ALA 96 Ca 0.00 -0.02 -0.68 0.00 0.00 0.00 0.00 54.91 54.22 2b3b h ALA 96 Cb 0.94 0.00 -0.19 0.00 0.00 0.00 0.00 17.79 18.54 2b3b h ALA 96 CO 0.07 0.02 -0.82 -0.06 0.00 0.00 0.00 179.25 178.46 2b3b s PHE 97 N -3.30 2.45 0.20 0.00 0.08 -1.23 -1.15 117.98 115.03 2b3b s PHE 97 Ca 0.02 -0.31 -0.32 0.00 0.12 0.00 0.00 56.93 56.45 2b3b s PHE 97 Cb 0.08 -1.29 -0.14 0.00 -0.57 0.00 0.00 43.02 41.09 2b3b s PHE 97 CO 0.74 0.39 1.31 -2.30 -0.10 0.00 0.00 175.22 175.27 2b3b n PRO 98 N 0.72 1.66 -0.23 0.24 -0.02 -1.26 -4.75 135.00 131.36 2b3b n PRO 98 Ca -0.16 0.59 0.13 0.00 -2.02 0.00 0.00 63.50 62.04 2b3b n PRO 98 Cb 0.53 -2.19 0.41 0.00 -0.02 0.00 0.00 33.50 32.24 2b3b n PRO 98 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2b3b h LYS 99 N 3.95 0.59 -0.33 -0.52 1.57 -1.97 0.11 116.57 119.97 2b3b h LYS 99 Ca -0.44 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.25 2b3b h LYS 99 Cb 1.30 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.46 2b3b h LYS 99 CO 0.74 0.39 -0.02 0.78 -0.57 0.00 0.00 179.45 180.78 2b3b h GLY 100 N 0.61 0.56 1.13 3.86 0.00 -2.00 -1.30 103.07 105.94 2b3b h GLY 100 Ca 0.42 -0.34 -0.20 0.00 0.00 0.00 0.00 47.33 47.21 2b3b h GLY 100 CO -0.17 0.32 -0.66 -2.00 0.00 0.00 0.00 176.54 174.02 2b3b h LEU 101 N 0.50 0.92 -0.89 3.11 5.85 -1.18 -2.68 115.31 120.95 2b3b h LEU 101 Ca 0.11 -0.59 0.07 0.00 0.84 0.00 0.00 57.88 58.30 2b3b h LEU 101 Cb 0.35 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.05 2b3b h LEU 101 CO 0.01 1.36 0.55 0.40 -0.34 0.00 0.00 178.44 180.42 2b3b h ILE 102 N 0.54 1.03 -0.91 4.05 1.08 -0.97 -2.21 117.51 120.13 2b3b h ILE 102 Ca -0.03 -0.34 0.00 0.00 -0.39 0.00 0.00 64.86 64.11 2b3b h ILE 102 Cb 1.28 -0.04 -0.04 0.00 -3.07 0.00 0.00 36.82 34.94 2b3b h ILE 102 CO 0.14 0.18 0.57 0.44 -0.69 0.00 0.00 178.15 178.79 2b3b h ASP 103 N 0.99 1.07 -0.19 1.72 3.32 -1.16 -2.12 116.42 120.05 2b3b h ASP 103 Ca 0.39 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.39 2b3b h ASP 103 Cb 0.20 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2b3b h ASP 103 CO -0.18 0.81 0.11 -0.07 -1.72 0.00 0.00 179.24 178.19 2b3b h LEU 104 N 1.25 0.25 -2.04 1.55 3.38 -1.05 -2.73 115.31 115.91 2b3b h LEU 104 Ca 0.33 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2b3b h LEU 104 Cb -0.09 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2b3b h LEU 104 CO -0.07 0.20 0.00 2.30 0.09 0.00 0.00 178.44 180.97 2b3b n ILE 105 N -4.48 0.19 -4.05 1.22 -5.35 -1.02 -1.90 119.36 103.97 2b3b n ILE 105 Ca 0.00 -0.58 -0.34 0.00 -0.27 0.00 0.00 62.75 61.56 2b3b n ILE 105 Cb 0.09 1.27 -0.07 0.00 -1.74 0.00 0.00 39.64 39.20 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 -1.81 5.89 -0.25 7.28 0.01 -0.83 -1.01 113.70 122.99 2b3b s SER 106 Ca 0.32 0.23 -0.15 0.00 1.31 0.00 0.00 55.95 57.66 2b3b s SER 106 Cb 0.21 -1.76 0.07 0.00 0.21 0.00 0.00 66.02 64.75 2b3b s SER 106 CO 0.31 0.29 0.62 -0.47 0.41 0.00 0.00 173.24 174.40 2b3b s TYR 107 N -1.19 -0.90 -1.46 2.43 5.04 -0.41 -4.95 117.35 115.92 2b3b s TYR 107 Ca 0.22 1.88 -0.11 0.00 -2.44 0.00 0.00 57.07 56.62 2b3b s TYR 107 Cb -0.12 0.49 0.08 0.00 0.35 0.00 0.00 41.96 42.75 2b3b s TYR 107 CO 0.13 -0.46 0.74 1.63 -1.34 0.00 0.00 175.55 176.25 2b3b n LYS 108 N 4.04 -4.51 0.00 4.97 4.76 -1.26 -0.59 118.16 125.58 2b3b n LYS 108 Ca -0.20 0.58 0.00 0.00 -2.87 0.00 0.00 58.31 55.82 2b3b n LYS 108 Cb 0.58 -5.39 0.00 0.00 -1.84 0.00 0.00 35.03 28.37 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 -1.46 2.67 3.92 0.72 0.00 -1.26 -5.04 105.19 104.74 2b3b n GLY 109 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.87 1.50 -0.12 -0.02 0.00 0.24 -5.01 107.32 102.04 2b3b s GLY 110 Ca 0.00 -0.63 0.02 0.00 0.00 0.00 0.00 44.72 44.11 2b3b s GLY 110 CO 0.00 -0.46 -0.19 -0.42 0.00 0.00 0.00 173.10 172.03 2b3b s ILE 111 N -2.72 1.78 -0.20 0.90 1.01 -1.26 -1.28 121.20 119.42 2b3b s ILE 111 Ca 0.48 -0.81 0.03 0.00 0.00 0.00 0.00 60.65 60.35 2b3b s ILE 111 Cb -0.10 -1.59 -0.02 0.00 0.01 0.00 0.00 42.46 40.76 2b3b s ILE 111 CO 0.43 0.50 0.23 0.79 0.00 0.00 0.00 174.94 176.89 2b3b n TRP 112 N 4.14 0.00 -3.86 3.97 7.02 -0.18 0.01 117.44 128.54 2b3b n TRP 112 Ca -0.19 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.20 2b3b n TRP 112 Cb 0.51 0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 29.37 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 -1.03 -0.23 -0.27 -0.99 1.04 -1.26 -4.52 113.70 106.44 2b3b s SER 113 Ca 0.02 -0.65 -0.04 0.00 0.48 0.00 0.00 55.95 55.76 2b3b s SER 113 Cb 0.02 0.66 0.02 0.00 0.10 0.00 0.00 66.02 66.83 2b3b s SER 113 CO 0.10 -1.24 -0.00 -0.69 0.98 0.00 0.00 173.24 172.39 2b3b s VAL 114 N -3.93 3.30 0.14 5.02 1.01 0.90 -4.91 120.40 121.93 2b3b s VAL 114 Ca 0.13 -0.91 -0.30 0.00 0.00 0.00 0.00 61.98 60.90 2b3b s VAL 114 Cb -0.04 -2.70 -0.07 0.00 0.00 0.00 0.00 36.38 33.58 2b3b s VAL 114 CO 0.05 0.14 1.22 -2.16 0.00 0.00 0.00 175.10 174.35 2b3b s PRO 115 N 1.39 4.46 -0.05 2.72 0.05 -1.26 -1.51 135.00 140.79 2b3b s PRO 115 Ca 0.01 1.86 0.20 0.00 0.05 0.00 0.00 61.00 63.12 2b3b s PRO 115 Cb -0.17 -3.28 -0.31 0.00 0.05 0.00 0.00 34.50 30.79 2b3b s PRO 115 CO -0.02 -0.18 0.40 1.55 0.05 0.00 0.00 177.00 178.81 2b3b n VAL 116 N 3.11 0.19 -3.84 -0.36 3.14 -0.17 -4.66 118.33 115.75 2b3b n VAL 116 Ca 0.07 -0.53 -0.09 0.00 -2.96 0.00 0.00 64.34 60.83 2b3b n VAL 116 Cb 0.45 -0.05 0.01 0.00 -1.06 0.00 0.00 33.84 33.19 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 -4.55 0.04 -0.08 6.55 2.20 -1.24 -3.87 114.94 114.00 2b3b s ASN 117 Ca -0.08 -1.10 0.01 0.00 -0.94 0.00 0.00 52.86 50.75 2b3b s ASN 117 Cb 0.12 0.82 0.02 0.00 -2.00 0.00 0.00 41.25 40.21 2b3b s ASN 117 CO 0.86 -1.61 -0.09 -0.63 -2.94 0.00 0.00 177.10 172.69 2b3b s ILE 118 N -2.60 0.96 0.18 0.54 -1.09 0.53 -4.20 121.20 115.52 2b3b s ILE 118 Ca 0.16 -0.32 0.07 0.00 -2.23 0.00 0.00 60.65 58.32 2b3b s ILE 118 Cb -0.05 -0.94 -0.04 0.00 -1.58 0.00 0.00 42.46 39.86 2b3b s ILE 118 CO 0.11 0.33 0.06 -1.00 -1.23 0.00 0.00 174.94 173.21 2b3b s HIS 119 N 1.14 2.96 -0.11 3.97 3.76 -0.22 -1.08 115.29 125.71 2b3b s HIS 119 Ca -0.06 -0.09 -0.01 0.00 -0.15 0.00 0.00 55.06 54.74 2b3b s HIS 119 Cb -0.14 -1.42 -0.03 0.00 1.11 0.00 0.00 32.58 32.10 2b3b s HIS 119 CO -0.02 0.52 -0.06 0.50 -0.85 0.00 0.00 174.74 174.84 2b3b s ARG 120 N -3.06 3.23 -0.04 1.40 3.52 -1.26 -1.45 118.95 121.29 2b3b s ARG 120 Ca 0.29 -0.54 -0.05 0.00 -0.13 0.00 0.00 55.73 55.30 2b3b s ARG 120 Cb -0.09 -2.75 -0.28 0.00 -1.56 0.00 0.00 34.95 30.27 2b3b s ARG 120 CO 0.21 0.44 0.67 1.03 -0.81 0.00 0.00 175.30 176.83 2b3b h SER 121 N 6.02 0.45 -1.71 -2.12 0.87 -1.13 -2.46 113.55 113.47 2b3b h SER 121 Ca -0.39 -0.72 -0.77 0.00 -1.23 0.00 0.00 61.79 58.68 2b3b h SER 121 Cb 1.19 -0.15 -0.18 0.00 -0.44 0.00 0.00 62.40 62.82 2b3b h SER 121 CO 0.57 1.62 1.79 -0.46 -0.53 0.00 0.00 176.83 179.82 2b3b n ASN 122 N -3.47 6.86 -4.22 6.23 6.94 -1.26 -3.63 115.26 122.71 2b3b n ASN 122 Ca -0.23 -3.28 -0.31 0.00 -0.02 0.00 0.00 54.58 50.74 2b3b n ASN 122 Cb 1.06 -1.34 -0.17 0.00 -2.36 0.00 0.00 39.78 36.97 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 -1.62 1.93 -0.24 3.53 1.01 -1.25 -1.49 120.40 122.27 2b3b s VAL 123 Ca 0.44 -0.98 -0.08 0.00 0.00 0.00 0.00 61.98 61.36 2b3b s VAL 123 Cb 0.14 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 2b3b s VAL 123 CO -0.04 0.54 0.09 -0.32 0.00 0.00 0.00 175.10 175.37 2b3b s MET 124 N 0.08 3.78 -0.08 2.72 1.75 0.50 -1.53 119.30 126.51 2b3b s MET 124 Ca -0.09 -0.42 -0.02 0.00 -1.25 0.00 0.00 55.69 53.90 2b3b s MET 124 Cb -0.15 -3.38 -0.04 0.00 2.84 0.00 0.00 34.83 34.11 2b3b s MET 124 CO 0.05 -0.10 0.04 -1.58 -0.65 0.00 0.00 175.02 172.78 2b3b s TRP 125 N 1.42 3.25 0.23 4.11 0.52 -0.16 -1.21 118.94 127.11 2b3b s TRP 125 Ca 0.06 0.25 -0.18 0.00 0.02 0.00 0.00 56.10 56.25 2b3b s TRP 125 Cb -0.15 -1.80 0.02 0.00 -1.15 0.00 0.00 33.47 30.39 2b3b s TRP 125 CO 0.05 0.53 0.59 1.52 0.02 0.00 0.00 176.95 179.66 2b3b s TYR 126 N -0.97 -0.08 -0.29 -1.98 -0.85 -0.95 -2.06 117.35 110.17 2b3b s TYR 126 Ca 0.15 -0.30 -0.08 0.00 -0.52 0.00 0.00 57.07 56.33 2b3b s TYR 126 Cb -0.12 0.47 -0.00 0.00 0.38 0.00 0.00 41.96 42.69 2b3b s TYR 126 CO 0.05 -1.04 0.10 -0.51 -1.52 0.00 0.00 175.55 172.63 2b3b s LEU 127 N -2.91 3.84 0.21 -3.49 1.02 -1.26 -0.20 118.68 115.89 2b3b s LEU 127 Ca 0.12 -0.55 -0.09 0.00 0.02 0.00 0.00 54.13 53.62 2b3b s LEU 127 Cb -0.03 -1.92 0.30 0.00 0.02 0.00 0.00 46.19 44.56 2b3b s LEU 127 CO 0.02 -0.16 1.71 -0.65 0.02 0.00 0.00 176.35 177.29 2b3b h PRO 128 N 8.27 0.28 -0.52 1.29 0.11 -1.87 -2.09 132.00 137.47 2b3b h PRO 128 Ca -0.33 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.78 2b3b h PRO 128 Cb 1.14 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 2b3b h PRO 128 CO 0.60 0.19 0.35 0.00 -0.21 0.00 0.00 178.00 178.93 2b3b h ALA 129 N 1.48 1.69 -0.09 -0.75 0.00 -1.95 -1.42 119.26 118.22 2b3b h ALA 129 Ca 0.32 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 2b3b h ALA 129 Cb 0.47 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2b3b h ALA 129 CO -0.39 0.26 -0.17 0.87 0.00 0.00 0.00 179.25 179.82 2b3b h LYS 130 N 0.65 0.27 -0.38 0.00 1.79 -1.81 -1.30 116.57 115.78 2b3b h LYS 130 Ca 0.20 -0.18 -0.03 0.00 -2.18 0.00 0.00 60.65 58.47 2b3b h LYS 130 Cb 0.02 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.68 2b3b h LYS 130 CO -0.05 0.77 0.12 -0.07 -1.08 0.00 0.00 179.45 179.13 2b3b h LEU 131 N -0.20 0.50 0.24 2.94 3.38 -1.35 -0.32 115.31 120.50 2b3b h LEU 131 Ca 0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2b3b h LEU 131 Cb 0.76 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2b3b h LEU 131 CO 0.04 0.49 -0.12 0.50 0.09 0.00 0.00 178.44 179.44 2b3b h LYS 132 N 0.54 -0.31 -0.67 1.13 3.64 -1.18 -0.44 116.57 119.28 2b3b h LYS 132 Ca 0.13 0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.63 2b3b h LYS 132 Cb 0.17 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 2b3b h LYS 132 CO -0.01 -0.17 0.45 0.78 -2.27 0.00 0.00 179.45 178.23 2b3b h GLY 133 N -0.37 0.75 0.65 5.01 0.00 -0.59 -1.00 103.07 107.53 2b3b h GLY 133 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2b3b h GLY 133 CO 0.05 0.13 -0.22 0.79 0.00 0.00 0.00 176.54 177.29 2b3b n TRP 134 N -4.48 0.00 -2.50 5.60 8.01 -0.19 -4.96 117.44 118.91 2b3b n TRP 134 Ca 0.11 0.00 -0.12 0.00 -1.31 0.00 0.00 57.50 56.18 2b3b n TRP 134 Cb 0.35 -0.18 0.01 0.00 -2.01 0.00 0.00 31.31 29.48 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 1.35 -0.04 3.34 6.99 0.00 -0.33 -5.00 105.19 111.50 2b3b n GLY 135 Ca 0.12 -0.32 -0.18 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.77 1.72 0.20 1.61 -7.23 -0.32 -5.04 120.40 108.57 2b3b s VAL 136 Ca 0.10 -2.21 0.04 0.00 -1.81 0.00 0.00 61.98 58.11 2b3b s VAL 136 Cb -0.05 -2.04 -0.03 0.00 0.56 0.00 0.00 36.38 34.82 2b3b s VAL 136 CO 0.13 -0.60 0.31 0.20 -0.31 0.00 0.00 175.10 174.83 2b3b s ASN 137 N -3.31 6.26 0.03 4.85 0.01 -1.26 -4.32 114.94 117.19 2b3b s ASN 137 Ca 0.22 0.09 -0.34 0.00 -0.71 0.00 0.00 52.86 52.12 2b3b s ASN 137 Cb -0.01 -1.85 -0.13 0.00 0.41 0.00 0.00 41.25 39.68 2b3b s ASN 137 CO 0.07 -0.01 1.75 -2.65 -1.51 0.00 0.00 177.10 174.75 2b3b n PRO 138 N -1.00 2.20 -2.45 -0.60 -0.02 -1.26 -4.94 135.00 126.92 2b3b n PRO 138 Ca -0.08 0.80 -0.41 0.00 -2.02 0.00 0.00 63.50 61.79 2b3b n PRO 138 Cb 0.56 -2.62 -0.04 0.00 -0.02 0.00 0.00 33.50 31.38 2b3b n PRO 138 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2b3b s PRO 139 N 2.70 4.54 -0.01 0.52 0.04 -1.26 -4.95 135.00 136.58 2b3b s PRO 139 Ca 0.86 1.78 0.21 0.00 0.04 0.00 0.00 61.00 63.90 2b3b s PRO 139 Cb -0.67 -3.27 -0.24 0.00 0.04 0.00 0.00 34.50 30.36 2b3b s PRO 139 CO 0.45 -0.02 0.79 0.54 0.04 0.00 0.00 177.00 178.81 2b3b n ARG 140 N 2.56 0.20 -4.23 4.56 1.74 -1.26 -4.42 116.66 115.81 2b3b n ARG 140 Ca 0.04 -0.06 -0.14 0.00 -0.77 0.00 0.00 57.85 56.92 2b3b n ARG 140 Cb 0.46 -1.51 -0.10 0.00 -1.02 0.00 0.00 32.46 30.29 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 -3.16 1.07 0.32 0.55 -4.23 -1.26 -0.86 115.64 108.07 2b3b s THR 141 Ca 0.03 -1.99 0.07 0.00 -1.18 0.00 0.00 61.69 58.62 2b3b s THR 141 Cb 0.15 -1.77 0.08 0.00 1.34 0.00 0.00 72.50 72.31 2b3b s THR 141 CO 0.88 -0.74 1.77 -0.50 -0.54 0.00 0.00 174.62 175.48 2b3b h TRP 142 N 2.90 0.31 -0.15 3.99 4.06 -1.92 -0.44 115.95 124.69 2b3b h TRP 142 Ca -0.36 -0.07 0.04 0.00 2.06 0.00 0.00 58.89 60.56 2b3b h TRP 142 Cb 1.19 -0.08 -0.04 0.00 -1.00 0.00 0.00 29.16 29.23 2b3b h TRP 142 CO 0.64 0.55 -0.07 -0.44 -3.56 0.00 0.00 178.44 175.56 2b3b h ASP 143 N 0.24 -0.25 -0.46 -3.49 3.32 -1.98 -1.26 116.42 112.55 2b3b h ASP 143 Ca 0.03 0.06 -0.06 0.00 0.02 0.00 0.00 57.03 57.09 2b3b h ASP 143 Cb 0.66 0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 2b3b h ASP 143 CO 0.05 -0.10 0.08 0.11 -1.72 0.00 0.00 179.24 177.66 2b3b h LYS 144 N -0.06 0.82 -0.42 3.56 1.57 -1.89 -2.32 116.57 117.84 2b3b h LYS 144 Ca 0.09 -0.19 0.03 0.00 -1.87 0.00 0.00 60.65 58.70 2b3b h LYS 144 Cb 0.19 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 2b3b h LYS 144 CO -0.19 0.77 0.23 0.35 -0.57 0.00 0.00 179.45 180.04 2b3b h PHE 145 N 0.78 0.43 -0.51 -1.35 3.57 -0.75 0.15 116.94 119.25 2b3b h PHE 145 Ca 0.16 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.59 2b3b h PHE 145 Cb 0.36 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 2b3b h PHE 145 CO 0.02 0.23 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.23 2b3b h LEU 146 N 0.46 0.90 -0.25 0.59 3.38 -1.06 -0.59 115.31 118.74 2b3b h LEU 146 Ca 0.17 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 2b3b h LEU 146 Cb 0.05 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2b3b h LEU 146 CO -0.10 1.01 0.12 0.00 0.09 0.00 0.00 178.44 179.56 2b3b h ALA 147 N 0.93 0.33 -0.64 1.53 0.00 -1.09 -2.02 119.26 118.29 2b3b h ALA 147 Ca 0.14 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2b3b h ALA 147 Cb 0.56 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2b3b h ALA 147 CO 0.03 -0.10 0.30 1.15 0.00 0.00 0.00 179.25 180.63 2b3b h THR 148 N 0.28 1.21 -0.49 0.00 2.02 -0.63 -2.22 112.91 113.07 2b3b h THR 148 Ca 0.09 -0.59 -0.11 0.00 0.77 0.00 0.00 66.41 66.57 2b3b h THR 148 Cb 0.13 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 2b3b h THR 148 CO -0.01 0.25 -0.13 0.00 0.37 0.00 0.00 175.52 176.00 2b3b h GLN 150 N 0.82 0.51 -0.45 0.00 1.08 -0.95 -0.34 115.11 115.78 2b3b h GLN 150 Ca 0.13 -0.03 0.08 0.00 -1.45 0.00 0.00 58.65 57.37 2b3b h GLN 150 Cb 0.67 -0.11 -0.07 0.00 -0.05 0.00 0.00 27.48 27.92 2b3b h GLN 150 CO 0.05 0.34 0.07 1.15 -0.95 0.00 0.00 178.83 179.48 2b3b h THR 151 N 0.52 0.73 -0.28 -0.54 2.02 -1.27 -2.28 112.91 111.82 2b3b h THR 151 Ca 0.14 -0.07 -0.08 0.00 0.77 0.00 0.00 66.41 67.18 2b3b h THR 151 Cb -0.06 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 2b3b h THR 151 CO -0.03 0.03 -0.17 -0.07 0.37 0.00 0.00 175.52 175.66 2b3b h LEU 152 N 0.19 0.48 -1.01 2.58 3.38 -0.62 -2.30 115.31 118.01 2b3b h LEU 152 Ca 0.22 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 2b3b h LEU 152 Cb 0.30 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2b3b h LEU 152 CO -0.31 0.66 0.27 0.11 0.09 0.00 0.00 178.44 179.26 2b3b h LYS 153 N 0.44 0.98 -0.11 1.13 1.57 -0.71 -0.62 116.57 119.25 2b3b h LYS 153 Ca 0.08 -0.16 0.03 0.00 -1.87 0.00 0.00 60.65 58.73 2b3b h LYS 153 Cb 0.55 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 2b3b h LYS 153 CO 0.04 0.80 0.12 1.96 -0.57 0.00 0.00 179.45 181.79 2b3b h GLN 154 N 0.96 0.00 -0.35 3.15 1.08 -0.87 -1.76 115.11 117.32 2b3b h GLN 154 Ca 0.23 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.43 2b3b h GLN 154 Cb 0.18 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.61 2b3b h GLN 154 CO -0.02 0.00 0.00 1.63 -0.95 0.00 0.00 178.83 179.49 2b3b n LYS 155 N -3.87 2.06 -0.28 1.46 5.02 -0.35 -4.92 118.16 117.29 2b3b n LYS 155 Ca -0.00 -1.62 0.00 0.00 -2.02 0.00 0.00 58.31 54.66 2b3b n LYS 155 Cb 0.22 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 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 1.27 0.80 3.39 0.72 0.00 -0.66 -5.02 105.19 105.69 2b3b n GLY 156 Ca 0.17 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.73 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 5.91 0.49 0.99 2.96 -0.57 -4.88 118.68 123.59 2b3b s LEU 157 Ca 0.00 -2.41 0.25 0.00 -0.22 0.00 0.00 54.13 51.75 2b3b s LEU 157 Cb 0.00 -2.30 1.27 0.00 0.50 0.00 0.00 46.19 45.66 2b3b s LEU 157 CO 0.00 -0.80 2.00 1.05 -1.32 0.00 0.00 176.35 177.27 2b3b h GLU 158 N 8.24 0.00 -2.60 1.98 4.11 -1.84 -3.24 114.58 121.23 2b3b h GLU 158 Ca 0.14 0.00 -0.60 0.00 0.07 0.00 0.00 59.36 58.97 2b3b h GLU 158 Cb 1.03 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.88 2b3b h GLU 158 CO 0.93 0.17 -0.86 0.00 0.07 0.00 0.00 179.01 179.32 2b3b s ALA 159 N -4.07 1.90 0.50 1.06 0.00 -1.26 -4.90 121.76 114.99 2b3b s ALA 159 Ca -0.02 -2.68 0.15 0.00 0.00 0.00 0.00 51.96 49.41 2b3b s ALA 159 Cb 0.13 -1.74 1.20 0.00 0.00 0.00 0.00 23.12 22.71 2b3b s ALA 159 CO 0.61 -2.02 2.12 -1.35 0.00 0.00 0.00 175.76 175.12 2b3b h PRO 160 N 5.85 0.05 -5.34 0.00 0.11 -1.60 -3.39 132.00 127.68 2b3b h PRO 160 Ca 0.19 -0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.69 2b3b h PRO 160 Cb 0.89 -0.01 -0.13 0.00 0.11 0.00 0.00 31.00 31.86 2b3b h PRO 160 CO 0.44 0.05 -0.13 -1.17 -0.21 0.00 0.00 178.00 176.98 2b3b s LEU 161 N -9.06 4.09 0.15 2.35 2.96 -0.26 -0.30 118.68 118.61 2b3b s LEU 161 Ca -0.05 0.47 -0.30 0.00 -0.22 0.00 0.00 54.13 54.03 2b3b s LEU 161 Cb 0.17 -2.56 -0.07 0.00 0.50 0.00 0.00 46.19 44.23 2b3b s LEU 161 CO 0.68 -0.19 0.98 0.00 -1.32 0.00 0.00 176.35 176.50 2b3b s ALA 162 N 1.89 3.29 0.00 5.97 0.00 0.29 -2.72 121.76 130.49 2b3b s ALA 162 Ca 0.19 0.63 -0.12 0.00 0.00 0.00 0.00 51.96 52.65 2b3b s ALA 162 Cb -0.15 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.71 2b3b s ALA 162 CO 0.09 -0.00 0.26 -1.17 0.00 0.00 0.00 175.76 174.94 2b3b s LEU 163 N -0.34 1.06 0.00 0.00 2.96 -1.26 -4.50 118.68 116.60 2b3b s LEU 163 Ca 0.46 -0.07 0.00 0.00 -0.22 0.00 0.00 54.13 54.30 2b3b s LEU 163 Cb -0.25 1.12 0.00 0.00 0.50 0.00 0.00 46.19 47.56 2b3b s LEU 163 CO 0.31 -0.47 0.00 0.61 -1.32 0.00 0.00 176.35 175.48 2b3b n GLY 164 N 1.13 5.99 3.33 7.98 0.00 -1.26 -4.35 105.19 118.00 2b3b n GLY 164 Ca -0.21 -1.82 -0.31 0.00 0.00 0.00 0.00 46.02 43.68 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 -2.03 -0.31 1.61 0.28 0.41 -4.17 120.64 116.42 2b3b n GLU 165 Ca 0.00 -0.57 0.02 0.00 -0.16 0.00 0.00 57.16 56.44 2b3b n GLU 165 Cb 0.00 -1.84 0.09 0.00 1.43 0.00 0.00 31.44 31.11 2b3b n GLU 165 CO 0.00 0.00 0.00 -0.97 -0.16 0.00 0.00 177.13 176.00 2b3b h ASN 166 N -2.34 -0.97 0.15 -1.84 -0.73 -1.87 0.13 115.58 108.11 2b3b h ASN 166 Ca -0.57 0.27 -0.03 0.00 1.87 0.00 0.00 56.30 57.83 2b3b h ASN 166 Cb 1.35 0.59 -0.01 0.00 0.27 0.00 0.00 38.32 40.52 2b3b h ASN 166 CO 0.42 -0.29 -0.16 4.11 -0.37 0.00 0.00 177.43 181.14 2b3b h TRP 167 N -0.02 0.02 0.00 0.67 5.08 -1.96 -1.00 115.95 118.73 2b3b h TRP 167 Ca 0.38 -0.00 -0.05 0.00 1.08 0.00 0.00 58.89 60.31 2b3b h TRP 167 Cb 0.62 -0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.77 2b3b h TRP 167 CO -0.71 0.18 -0.22 1.79 -1.28 0.00 0.00 178.44 178.19 2b3b h THR 168 N 0.02 0.54 -0.10 0.12 1.35 -1.03 -0.14 112.91 113.67 2b3b h THR 168 Ca 0.00 -1.13 -0.12 0.00 -0.55 0.00 0.00 66.41 64.61 2b3b h THR 168 Cb 0.29 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 2b3b h THR 168 CO 0.02 0.22 -0.41 1.56 -0.25 0.00 0.00 175.52 176.66 2b3b h GLN 169 N 0.00 0.45 -0.76 4.72 4.20 -0.93 -1.57 115.11 121.22 2b3b h GLN 169 Ca -0.00 -0.35 0.03 0.00 0.06 0.00 0.00 58.65 58.38 2b3b h GLN 169 Cb 0.76 0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.56 2b3b h GLN 169 CO 0.03 0.98 0.49 1.96 -0.67 0.00 0.00 178.83 181.62 2b3b h GLN 170 N 0.02 0.93 -0.40 1.46 4.20 -1.16 0.11 115.11 120.27 2b3b h GLN 170 Ca -0.02 -0.06 0.04 0.00 0.06 0.00 0.00 58.65 58.67 2b3b h GLN 170 Cb 1.05 -0.21 -0.04 0.00 0.30 0.00 0.00 27.48 28.58 2b3b h GLN 170 CO 0.09 0.62 0.18 1.25 -0.67 0.00 0.00 178.83 180.29 2b3b h HIS 171 N 0.96 0.32 -0.58 2.96 2.76 -0.95 -1.68 115.15 118.94 2b3b h HIS 171 Ca 0.30 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.52 2b3b h HIS 171 Cb -0.00 -0.09 -0.04 0.00 1.55 0.00 0.00 27.41 28.83 2b3b h HIS 171 CO -0.03 0.15 0.34 1.25 -1.30 0.00 0.00 177.93 178.35 2b3b h LEU 172 N 0.37 0.55 -0.75 0.26 5.85 -0.96 -2.91 115.31 117.72 2b3b h LEU 172 Ca 0.18 0.01 0.10 0.00 0.84 0.00 0.00 57.88 59.01 2b3b h LEU 172 Cb 0.12 -0.11 -0.08 0.00 0.37 0.00 0.00 40.66 40.96 2b3b h LEU 172 CO -0.15 0.39 0.38 -0.25 -0.34 0.00 0.00 178.44 178.47 2b3b h TRP 173 N 0.68 0.69 0.00 1.25 7.01 -0.03 -2.36 115.95 123.19 2b3b h TRP 173 Ca 0.23 0.03 -0.08 0.00 2.11 0.00 0.00 58.89 61.18 2b3b h TRP 173 Cb 0.04 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 26.89 2b3b h TRP 173 CO -0.06 0.24 -0.39 1.05 -2.79 0.00 0.00 178.44 176.48 2b3b h GLU 174 N 0.63 0.00 -0.23 2.65 4.11 -1.13 0.15 114.58 120.77 2b3b h GLU 174 Ca 0.38 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.76 2b3b h GLU 174 Cb 0.41 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2b3b h GLU 174 CO -0.28 0.39 -0.03 0.77 0.07 0.00 0.00 179.01 179.93 2b3b h SER 175 N 0.00 0.42 -0.34 3.06 0.02 -1.48 -1.46 113.55 113.78 2b3b h SER 175 Ca -0.00 -0.34 -0.01 0.00 -0.84 0.00 0.00 61.79 60.60 2b3b h SER 175 Cb 0.72 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.13 2b3b h SER 175 CO 0.05 0.67 0.19 0.58 -1.14 0.00 0.00 176.83 177.18 2b3b h VAL 176 N 0.17 1.13 -0.55 2.27 2.07 -0.90 -1.36 116.25 119.08 2b3b h VAL 176 Ca 0.06 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 67.25 2b3b h VAL 176 Cb 0.47 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 2b3b h VAL 176 CO 0.02 0.13 0.36 0.00 0.02 0.00 0.00 177.57 178.11 2b3b h ALA 177 N 1.06 0.70 -0.80 1.67 0.00 -0.74 -0.36 119.26 120.79 2b3b h ALA 177 Ca 0.12 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2b3b h ALA 177 Cb 0.05 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 2b3b h ALA 177 CO -0.02 0.14 0.45 1.25 0.00 0.00 0.00 179.25 181.06 2b3b h LEU 178 N 0.74 0.98 -0.47 0.00 5.85 -1.12 0.44 115.31 121.73 2b3b h LEU 178 Ca 0.20 -0.08 -0.12 0.00 0.84 0.00 0.00 57.88 58.72 2b3b h LEU 178 Cb -0.09 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.68 2b3b h LEU 178 CO -0.04 0.78 -0.19 0.00 -0.34 0.00 0.00 178.44 178.65 2b3b h ALA 179 N 1.38 0.65 0.01 1.25 0.00 -0.58 -0.82 119.26 121.16 2b3b h ALA 179 Ca 0.28 -0.38 -0.24 0.00 0.00 0.00 0.00 54.91 54.58 2b3b h ALA 179 Cb 0.01 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.64 2b3b h ALA 179 CO -0.05 0.61 -0.99 0.28 0.00 0.00 0.00 179.25 179.11 2b3b h VAL 180 N 0.79 1.38 0.04 0.00 2.07 -0.85 -3.36 116.25 116.33 2b3b h VAL 180 Ca 0.11 -2.45 -0.35 0.00 0.82 0.00 0.00 66.70 64.83 2b3b h VAL 180 Cb 0.76 2.45 -0.05 0.00 -1.52 0.00 0.00 31.29 32.93 2b3b h VAL 180 CO 0.06 0.73 -2.11 0.18 0.02 0.00 0.00 177.57 176.46 2b3b n LEU 181 N -3.75 1.67 0.00 2.57 4.77 0.12 -5.02 117.00 117.36 2b3b n LEU 181 Ca -0.08 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2b3b n LEU 181 Cb 0.86 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2b3b n LEU 181 CO 0.52 0.67 0.00 0.61 -1.33 0.00 0.00 177.39 177.87 2b3b n GLY 182 N 1.88 -0.41 0.34 -0.72 0.00 -0.31 -4.26 105.19 101.70 2b3b n GLY 182 Ca -0.31 -1.64 -0.00 0.00 0.00 0.00 0.00 46.02 44.06 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 0.93 -0.20 1.61 0.13 -1.96 0.22 132.00 132.74 2b3b h PRO 183 Ca 0.00 -0.09 -0.02 0.00 -0.87 0.00 0.00 66.00 65.02 2b3b h PRO 183 Cb 0.00 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 30.93 2b3b h PRO 183 CO 0.00 0.67 0.05 -0.44 -0.23 0.00 0.00 178.00 178.05 2b3b h ASP 184 N 0.95 0.31 1.09 1.44 3.32 -1.97 -1.43 116.42 120.13 2b3b h ASP 184 Ca 0.24 -0.24 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 2b3b h ASP 184 Cb -0.00 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 2b3b h ASP 184 CO -0.04 0.46 -0.49 0.44 -1.72 0.00 0.00 179.24 177.89 2b3b h ASP 185 N 0.13 0.00 -0.15 6.45 3.32 -1.69 -1.02 116.42 123.47 2b3b h ASP 185 Ca 0.06 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 2b3b h ASP 185 Cb 0.28 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 2b3b h ASP 185 CO 0.00 0.49 0.09 -0.25 -1.72 0.00 0.00 179.24 177.86 2b3b h TRP 186 N 0.00 0.19 -0.24 4.55 2.91 -0.85 -2.84 115.95 119.68 2b3b h TRP 186 Ca -0.00 0.00 -0.03 0.00 1.13 0.00 0.00 58.89 59.99 2b3b h TRP 186 Cb 1.17 -0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 29.74 2b3b h TRP 186 CO 0.00 0.16 0.04 -0.91 -1.03 0.00 0.00 178.44 176.70 2b3b h ASN 187 N 0.17 0.31 0.78 2.65 2.35 -0.80 -2.43 115.58 118.61 2b3b h ASN 187 Ca 0.05 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.76 2b3b h ASN 187 Cb 0.02 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 2b3b h ASN 187 CO -0.01 0.34 -0.03 0.78 -1.65 0.00 0.00 177.43 176.86 2b3b h ASN 188 N 0.34 0.00 -0.92 5.81 2.35 -0.96 -2.23 115.58 119.97 2b3b h ASN 188 Ca 0.08 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 2b3b h ASN 188 Cb 0.17 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.50 2b3b h ASN 188 CO -0.00 0.03 0.54 -0.07 -1.65 0.00 0.00 177.43 176.29 2b3b h LEU 189 N 0.00 1.12 0.00 1.61 3.38 -1.30 0.77 115.31 120.89 2b3b h LEU 189 Ca -0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2b3b h LEU 189 Cb 0.43 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2b3b h LEU 189 CO 0.00 0.87 -0.96 0.79 0.09 0.00 0.00 178.44 179.23 2b3b n TRP 190 N -4.36 0.75 1.00 1.13 7.02 -0.85 -2.67 117.44 119.45 2b3b n TRP 190 Ca 0.10 0.22 0.12 0.00 -1.02 0.00 0.00 57.50 56.92 2b3b n TRP 190 Cb 0.07 -0.81 0.17 0.00 -2.42 0.00 0.00 31.31 28.32 2b3b n TRP 190 CO 0.00 0.00 0.00 0.27 -2.02 0.00 0.00 177.69 175.94 2b3b n ASN 191 N -2.44 2.85 0.00 -0.99 0.23 -1.14 -3.97 115.26 109.80 2b3b n ASN 191 Ca 0.01 -1.94 0.00 0.00 -0.53 0.00 0.00 54.58 52.12 2b3b n ASN 191 Cb 0.51 -0.03 0.00 0.00 -2.08 0.00 0.00 39.78 38.19 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 1.34 0.58 0.16 4.83 0.00 -1.03 -4.79 105.19 106.28 2b3b n GLY 192 Ca 0.15 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.23 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 1.40 0.00 -5.15 1.61 1.57 -1.17 -3.43 116.57 111.40 2b3b h LYS 193 Ca 0.00 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 58.11 2b3b h LYS 193 Cb 0.00 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 31.98 2b3b h LYS 193 CO 0.00 0.29 -0.84 -1.17 -0.57 0.00 0.00 179.45 177.16 2b3b s LEU 194 N -6.23 2.28 0.47 2.94 2.96 -0.35 -4.99 118.68 115.75 2b3b s LEU 194 Ca 0.04 -0.56 -0.20 0.00 -0.22 0.00 0.00 54.13 53.19 2b3b s LEU 194 Cb 0.07 -1.51 -0.09 0.00 0.50 0.00 0.00 46.19 45.16 2b3b s LEU 194 CO 0.73 0.06 1.00 -0.54 -1.32 0.00 0.00 176.35 176.28 2b3b s LYS 195 N 0.97 3.95 0.55 1.98 -0.14 -1.26 -4.17 119.74 121.62 2b3b s LYS 195 Ca -0.03 1.26 0.32 0.00 -1.36 0.00 0.00 55.97 56.16 2b3b s LYS 195 Cb -0.15 -2.13 1.57 0.00 -1.68 0.00 0.00 37.83 35.45 2b3b s LYS 195 CO -0.04 -0.29 2.09 0.74 -0.76 0.00 0.00 175.35 177.09 2b3b h PHE 196 N 1.65 0.00 -0.00 3.18 0.04 -1.93 -1.95 116.94 117.92 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 1.20 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.35 2b3b h PHE 196 CO 0.59 0.08 -0.06 0.25 -0.60 0.00 0.00 178.31 178.56 2b3b n THR 197 N -3.40 0.00 -1.93 -1.55 -2.24 -1.26 -3.73 114.28 100.17 2b3b n THR 197 Ca -0.01 -0.06 -0.41 0.00 -2.27 0.00 0.00 64.05 61.30 2b3b n THR 197 Cb 0.24 -0.18 -0.02 0.00 -2.10 0.00 0.00 70.33 68.27 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 -2.36 6.55 0.46 3.42 -1.08 -0.74 -4.76 116.67 118.16 2b3b s ASP 198 Ca 0.33 2.78 0.27 0.00 -0.52 0.00 0.00 52.55 55.42 2b3b s ASP 198 Cb 0.20 -2.63 1.32 0.00 -1.46 0.00 0.00 42.92 40.36 2b3b s ASP 198 CO 0.44 -0.77 1.75 -0.65 0.52 0.00 0.00 175.17 176.46 2b3b h PRO 199 N 4.72 0.19 -0.79 4.34 0.11 -1.90 0.40 132.00 139.08 2b3b h PRO 199 Ca -0.47 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 2b3b h PRO 199 Cb 1.22 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 2b3b h PRO 199 CO 0.76 0.13 0.39 0.87 -0.21 0.00 0.00 178.00 179.94 2b3b h LYS 200 N 0.20 1.13 0.10 1.05 1.57 -1.93 -1.43 116.57 117.25 2b3b h LYS 200 Ca 0.64 -0.16 -0.26 0.00 -1.87 0.00 0.00 60.65 59.00 2b3b h LYS 200 Cb 2.01 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 34.11 2b3b h LYS 200 CO -0.22 0.86 -1.19 0.00 -0.57 0.00 0.00 179.45 178.34 2b3b h ALA 201 N 1.30 0.16 -0.91 3.86 0.00 -0.56 -3.22 119.26 119.90 2b3b h ALA 201 Ca 0.27 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2b3b h ALA 201 Cb 0.10 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2b3b h ALA 201 CO -0.04 1.04 0.57 0.28 0.00 0.00 0.00 179.25 181.11 2b3b h VAL 202 N 0.06 1.24 -0.35 0.00 2.07 -0.86 -2.47 116.25 115.94 2b3b h VAL 202 Ca -0.11 -0.50 0.06 0.00 0.82 0.00 0.00 66.70 66.98 2b3b h VAL 202 Cb 1.92 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 2b3b h VAL 202 CO 0.19 0.25 0.24 -0.09 0.02 0.00 0.00 177.57 178.17 2b3b h ARG 203 N 1.25 0.20 -0.92 1.57 2.43 -1.27 -0.90 114.38 116.74 2b3b h ARG 203 Ca 0.33 -0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.57 2b3b h ARG 203 Cb -0.09 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.35 2b3b h ARG 203 CO -0.07 0.13 0.59 0.00 -1.51 0.00 0.00 179.97 179.12 2b3b h ALA 204 N 1.82 1.54 -0.08 2.80 0.00 -1.47 -0.94 119.26 122.91 2b3b h ALA 204 Ca 0.16 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.87 2b3b h ALA 204 Cb 0.36 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2b3b h ALA 204 CO -0.03 0.30 -0.72 -1.49 0.00 0.00 0.00 179.25 177.32 2b3b h TRP 205 N 1.00 0.56 0.00 0.00 4.06 -1.27 -0.11 115.95 120.19 2b3b h TRP 205 Ca 0.41 -0.24 -0.00 0.00 2.06 0.00 0.00 58.89 61.12 2b3b h TRP 205 Cb 0.28 -0.09 0.00 0.00 -1.00 0.00 0.00 29.16 28.35 2b3b h TRP 205 CO -0.00 0.99 -0.00 0.93 -3.56 0.00 0.00 178.44 176.80 2b3b h GLU 206 N 0.29 -0.00 -0.17 0.49 5.08 -1.08 -0.73 114.58 118.46 2b3b h GLU 206 Ca -0.03 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2b3b h GLU 206 Cb 1.29 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 2b3b h GLU 206 CO 0.12 0.07 0.06 0.28 -1.00 0.00 0.00 179.01 178.55 2b3b h VAL 207 N -0.08 1.16 -0.83 3.13 2.07 -1.16 -2.67 116.25 117.87 2b3b h VAL 207 Ca -0.00 -0.50 0.14 0.00 0.82 0.00 0.00 66.70 67.16 2b3b h VAL 207 Cb 0.08 1.19 -0.09 0.00 -1.52 0.00 0.00 31.29 30.94 2b3b h VAL 207 CO 0.00 0.16 0.42 0.15 0.02 0.00 0.00 177.57 178.32 2b3b h PHE 208 N 0.11 0.74 -0.72 1.57 3.57 -0.91 -1.01 116.94 120.28 2b3b h PHE 208 Ca 0.06 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 2b3b h PHE 208 Cb 0.19 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.69 2b3b h PHE 208 CO -0.01 0.17 0.34 0.78 -2.23 0.00 0.00 178.31 177.36 2b3b h GLY 209 N 0.61 1.11 0.94 2.40 0.00 -0.89 0.10 103.07 107.34 2b3b h GLY 209 Ca 0.45 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 47.23 2b3b h GLY 209 CO -0.36 0.52 0.16 3.21 0.00 0.00 0.00 176.54 180.07 2b3b h ARG 210 N 1.03 0.53 -0.66 4.80 3.08 -0.96 -2.93 114.38 119.27 2b3b h ARG 210 Ca 0.25 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.18 2b3b h ARG 210 Cb 0.12 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 2b3b h ARG 210 CO -0.03 0.49 0.26 0.28 -1.07 0.00 0.00 179.97 179.89 2b3b h VAL 211 N 0.44 1.23 0.00 2.04 2.07 -0.80 -2.64 116.25 118.59 2b3b h VAL 211 Ca 0.12 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 2b3b h VAL 211 Cb 0.14 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 2b3b h VAL 211 CO -0.01 0.29 -0.09 -0.07 0.02 0.00 0.00 177.57 177.71 2b3b h LEU 212 N 0.96 0.00 0.00 2.57 3.38 -0.64 -0.74 115.31 120.83 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 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2b3b h LEU 212 CO -0.02 0.09 0.00 -0.67 0.09 0.00 0.00 178.44 177.93 2b3b n ASP 213 N -4.41 0.00 -0.62 -0.43 4.64 -0.99 -1.26 116.55 113.48 2b3b n ASP 213 Ca -0.03 0.44 0.12 0.00 -1.38 0.00 0.00 54.79 53.95 2b3b n ASP 213 Cb 0.17 -0.46 0.18 0.00 -1.04 0.00 0.00 41.12 39.96 2b3b n ASP 213 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2b3b s ALA 215 N -2.23 3.76 0.34 0.00 0.00 -0.39 -1.10 121.76 122.13 2b3b s ALA 215 Ca 0.26 -0.99 -0.29 0.00 0.00 0.00 0.00 51.96 50.94 2b3b s ALA 215 Cb 0.19 -2.04 -0.11 0.00 0.00 0.00 0.00 23.12 21.17 2b3b s ALA 215 CO 0.43 -0.01 1.42 0.54 0.00 0.00 0.00 175.76 178.13 2b3b s ASN 216 N -4.05 6.55 0.42 0.00 4.22 -1.10 -4.84 114.94 116.15 2b3b s ASN 216 Ca 0.40 2.85 0.23 0.00 -2.14 0.00 0.00 52.86 54.20 2b3b s ASN 216 Cb -0.10 -2.65 0.70 0.00 1.28 0.00 0.00 41.25 40.48 2b3b s ASN 216 CO 0.35 -0.72 1.73 0.11 -2.04 0.00 0.00 177.10 176.53 2b3b h LYS 217 N 3.54 0.00 -0.77 3.55 1.79 -1.96 -2.99 116.57 119.73 2b3b h LYS 217 Ca -0.49 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 2b3b h LYS 217 Cb 1.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 2b3b h LYS 217 CO 0.67 0.22 0.00 -0.40 -1.08 0.00 0.00 179.45 178.86 2b3b n ASP 218 N -3.27 2.59 -0.34 0.86 5.75 -1.26 -4.56 116.55 116.32 2b3b n ASP 218 Ca 0.01 -2.30 0.05 0.00 -0.01 0.00 0.00 54.79 52.54 2b3b n ASP 218 Cb 0.49 -0.52 0.22 0.00 -1.03 0.00 0.00 41.12 40.29 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 2.84 1.49 -0.56 2.12 0.00 -1.72 -3.04 119.26 120.39 2b3b h ALA 219 Ca 0.00 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.02 2b3b h ALA 219 Cb 0.96 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2b3b h ALA 219 CO 0.16 0.34 0.39 0.00 0.00 0.00 0.00 179.25 180.13 2b3b h ALA 220 N 1.50 2.24 -0.70 0.00 0.00 -1.80 -0.61 119.26 119.89 2b3b h ALA 220 Ca 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.33 2b3b h ALA 220 Cb 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2b3b h ALA 220 CO -0.19 -0.38 0.00 0.41 0.00 0.00 0.00 179.25 179.09 2b3b n GLY 221 N -1.57 2.63 3.75 0.00 0.00 -1.15 -4.19 105.19 104.66 2b3b n GLY 221 Ca 0.10 -0.83 -0.34 0.00 0.00 0.00 0.00 46.02 44.95 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 -1.40 3.81 0.87 0.99 1.43 -0.35 -4.93 118.68 119.09 2b3b s LEU 222 Ca 0.50 0.19 -0.11 0.00 -1.03 0.00 0.00 54.13 53.68 2b3b s LEU 222 Cb 0.29 -2.01 0.12 0.00 0.03 0.00 0.00 46.19 44.61 2b3b s LEU 222 CO 0.29 0.34 1.09 -0.94 0.23 0.00 0.00 176.35 177.37 2b3b s SER 223 N -1.22 3.69 0.32 2.29 1.04 -1.26 -0.45 113.70 118.12 2b3b s SER 223 Ca 0.17 1.45 0.01 0.00 0.48 0.00 0.00 55.95 58.06 2b3b s SER 223 Cb -0.12 -2.14 0.54 0.00 0.10 0.00 0.00 66.02 64.40 2b3b s SER 223 CO 0.07 -2.50 1.96 4.11 0.98 0.00 0.00 173.24 177.87 2b3b h TRP 224 N -1.45 0.87 -0.76 5.02 5.08 -1.98 -2.31 115.95 120.42 2b3b h TRP 224 Ca -0.49 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 59.44 2b3b h TRP 224 Cb 1.28 -0.29 -0.03 0.00 -3.00 0.00 0.00 29.16 27.12 2b3b h TRP 224 CO 0.43 0.58 0.30 1.96 -1.28 0.00 0.00 178.44 180.43 2b3b h GLN 225 N 0.91 1.15 -0.20 0.12 7.50 -1.99 -1.48 115.11 121.12 2b3b h GLN 225 Ca 0.24 -0.22 -0.06 0.00 0.50 0.00 0.00 58.65 59.11 2b3b h GLN 225 Cb -0.03 -0.18 -0.01 0.00 0.05 0.00 0.00 27.48 27.30 2b3b h GLN 225 CO -0.04 0.94 -0.16 1.96 -1.50 0.00 0.00 178.83 180.03 2b3b h GLN 226 N 1.11 0.33 -0.31 1.46 4.20 -1.79 0.18 115.11 120.28 2b3b h GLN 226 Ca 0.25 -0.09 -0.11 0.00 0.06 0.00 0.00 58.65 58.76 2b3b h GLN 226 Cb 0.23 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 2b3b h GLN 226 CO -0.02 0.50 -0.24 0.00 -0.67 0.00 0.00 178.83 178.40 2b3b h ALA 227 N 1.53 0.45 -0.46 3.87 0.00 -1.16 -2.49 119.26 121.00 2b3b h ALA 227 Ca 0.06 -0.38 0.05 0.00 0.00 0.00 0.00 54.91 54.63 2b3b h ALA 227 Cb 0.48 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 2b3b h ALA 227 CO 0.03 0.43 0.20 0.28 0.00 0.00 0.00 179.25 180.19 2b3b h VAL 228 N 0.48 0.91 -0.95 0.00 2.07 -0.73 -2.56 116.25 115.48 2b3b h VAL 228 Ca 0.06 -0.14 0.17 0.00 0.82 0.00 0.00 66.70 67.61 2b3b h VAL 228 Cb 0.80 0.48 -0.08 0.00 -1.52 0.00 0.00 31.29 30.96 2b3b h VAL 228 CO 0.06 0.07 0.60 0.44 0.02 0.00 0.00 177.57 178.77 2b3b h ASP 229 N 0.40 0.67 -0.99 0.57 3.32 -0.51 -0.13 116.42 119.75 2b3b h ASP 229 Ca 0.21 0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.35 2b3b h ASP 229 Cb 0.16 -0.07 -0.06 0.00 0.22 0.00 0.00 39.33 39.58 2b3b h ASP 229 CO -0.17 0.29 0.65 0.03 -1.72 0.00 0.00 179.24 178.31 2b3b h ARG 230 N 0.68 1.23 -0.17 3.56 3.08 -1.02 0.11 114.38 121.86 2b3b h ARG 230 Ca 0.50 -0.07 -0.11 0.00 0.07 0.00 0.00 59.98 60.37 2b3b h ARG 230 Cb 0.87 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2b3b h ARG 230 CO -0.26 0.82 -0.33 0.28 -1.07 0.00 0.00 179.97 179.40 2b3b h VAL 231 N 1.27 1.35 -0.55 2.04 2.07 -1.05 0.13 116.25 121.50 2b3b h VAL 231 Ca 0.39 -1.58 0.06 0.00 0.82 0.00 0.00 66.70 66.38 2b3b h VAL 231 Cb -0.03 1.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 2b3b h VAL 231 CO -0.11 0.48 0.37 0.58 0.02 0.00 0.00 177.57 178.90 2b3b h VAL 232 N 0.16 0.99 -0.02 2.57 2.07 -0.65 -2.22 116.25 119.16 2b3b h VAL 232 Ca 0.01 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.35 2b3b h VAL 232 Cb 0.93 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2b3b h VAL 232 CO 0.07 0.10 -0.12 0.00 0.02 0.00 0.00 177.57 177.64 2b3b n GLN 233 N -4.47 1.65 -0.84 1.57 6.02 0.35 -4.95 117.38 116.70 2b3b n GLN 233 Ca 0.07 -1.18 0.00 0.00 -0.01 0.00 0.00 57.00 55.88 2b3b n GLN 233 Cb 0.23 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.01 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 1.30 0.51 0.24 1.08 0.00 -0.84 -4.91 105.19 102.58 2b3b n GLY 234 Ca 0.15 -0.60 0.12 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.84 0.70 -4.11 1.61 5.02 0.36 -4.89 118.16 114.02 2b3b n LYS 235 Ca 0.00 -0.49 -0.10 0.00 -2.02 0.00 0.00 58.31 55.70 2b3b n LYS 235 Cb 0.00 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 33.43 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 -2.64 0.67 -0.19 7.82 0.00 -0.71 -4.63 121.76 122.10 2b3b s ALA 236 Ca 0.19 -1.37 0.11 0.00 0.00 0.00 0.00 51.96 50.88 2b3b s ALA 236 Cb 0.18 1.09 -0.19 0.00 0.00 0.00 0.00 23.12 24.20 2b3b s ALA 236 CO 0.61 -0.60 -0.03 0.00 0.00 0.00 0.00 175.76 175.73 2b3b n ALA 237 N -0.22 1.56 -2.83 0.00 0.00 0.59 -4.41 120.51 115.19 2b3b n ALA 237 Ca -0.02 -1.07 -0.11 0.00 0.00 0.00 0.00 53.44 52.23 2b3b n ALA 237 Cb 0.64 -0.08 -0.11 0.00 0.00 0.00 0.00 19.45 19.90 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 -2.43 0.55 -0.02 0.00 0.08 -0.66 -4.34 117.98 111.16 2b3b s PHE 238 Ca -0.16 -0.55 -0.01 0.00 0.12 0.00 0.00 56.93 56.33 2b3b s PHE 238 Cb 0.06 -0.34 0.02 0.00 -0.57 0.00 0.00 43.02 42.19 2b3b s PHE 238 CO 0.64 -0.13 0.05 1.21 -0.10 0.00 0.00 175.22 176.88 2b3b s ASN 239 N -1.67 0.02 -0.42 1.36 2.47 -0.88 -0.55 114.94 115.27 2b3b s ASN 239 Ca -0.10 0.08 -0.16 0.00 0.42 0.00 0.00 52.86 53.10 2b3b s ASN 239 Cb -0.09 0.00 0.02 0.00 -1.45 0.00 0.00 41.25 39.74 2b3b s ASN 239 CO -0.01 -0.10 0.38 -0.63 -3.72 0.00 0.00 177.10 173.02 2b3b s ILE 240 N 0.79 5.16 0.12 -5.21 -1.09 -1.26 -0.99 121.20 118.73 2b3b s ILE 240 Ca -0.06 -0.49 -0.20 0.00 -2.23 0.00 0.00 60.65 57.67 2b3b s ILE 240 Cb -0.09 -3.99 0.05 0.00 -1.58 0.00 0.00 42.46 36.85 2b3b s ILE 240 CO -0.03 -0.38 0.49 -0.32 -1.23 0.00 0.00 174.94 173.48 2b3b s MET 241 N 1.93 1.13 0.90 2.79 1.75 -0.58 -4.62 119.30 122.60 2b3b s MET 241 Ca 0.09 -0.52 -0.11 0.00 -1.25 0.00 0.00 55.69 53.90 2b3b s MET 241 Cb -0.18 0.51 0.13 0.00 2.84 0.00 0.00 34.83 38.13 2b3b s MET 241 CO 0.12 -0.45 1.10 0.20 -0.65 0.00 0.00 175.02 175.34 2b3b s GLY 242 N -2.59 1.64 0.00 2.11 0.00 -1.24 -3.75 107.32 103.49 2b3b s GLY 242 Ca 0.00 0.17 0.08 0.00 0.00 0.00 0.00 44.72 44.97 2b3b s GLY 242 CO -0.10 0.64 1.25 2.09 0.00 0.00 0.00 173.10 176.97 2b3b n ASP 243 N -4.01 0.49 0.20 1.64 5.68 -0.93 -1.48 116.55 118.14 2b3b n ASP 243 Ca 0.08 -1.85 0.18 0.00 -0.50 0.00 0.00 54.79 52.70 2b3b n ASP 243 Cb 0.54 -0.05 0.83 0.00 -1.14 0.00 0.00 41.12 41.30 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 0.56 0.00 -0.33 2.11 0.09 -1.82 -2.16 115.95 114.41 2b3b h TRP 244 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 58.89 58.93 2b3b h TRP 244 Cb 0.13 0.00 -0.02 0.00 0.08 0.00 0.00 29.16 29.35 2b3b h TRP 244 CO 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 178.44 178.56 2b3b h ALA 245 N 1.70 1.34 -0.25 0.11 0.00 -1.53 -1.20 119.26 119.43 2b3b h ALA 245 Ca 0.09 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2b3b h ALA 245 Cb 0.57 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2b3b h ALA 245 CO -0.00 0.45 0.13 0.00 0.00 0.00 0.00 179.25 179.83 2b3b h ALA 246 N 1.48 0.33 -0.97 0.00 0.00 -1.62 -0.93 119.26 117.55 2b3b h ALA 246 Ca 0.10 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.98 2b3b h ALA 246 Cb 0.36 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 2b3b h ALA 246 CO 0.01 -0.12 0.63 0.78 0.00 0.00 0.00 179.25 180.55 2b3b h GLY 247 N 0.28 1.45 0.90 0.00 0.00 -1.45 -1.08 103.07 103.17 2b3b h GLY 247 Ca 0.09 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 2b3b h GLY 247 CO -0.01 0.36 -0.06 -1.82 0.00 0.00 0.00 176.54 175.01 2b3b h TYR 248 N 1.18 -0.16 0.00 5.60 3.20 -0.98 0.10 116.97 125.91 2b3b h TYR 248 Ca 0.40 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.21 2b3b h TYR 248 Cb 0.09 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 2b3b h TYR 248 CO -0.01 -0.01 -0.30 0.52 -1.64 0.00 0.00 178.16 176.72 2b3b h MET 249 N -0.28 0.00 0.00 1.82 2.86 -0.95 -0.76 114.93 117.62 2b3b h MET 249 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2b3b h MET 249 Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 2b3b h MET 249 CO 0.03 0.30 -0.55 0.25 1.06 0.00 0.00 176.91 177.99 2b3b n THR 250 N -3.79 1.24 -0.08 2.22 -2.24 -0.43 -0.10 114.28 111.11 2b3b n THR 250 Ca -0.01 0.24 -0.03 0.00 -2.27 0.00 0.00 64.05 61.98 2b3b n THR 250 Cb 0.39 -2.26 0.21 0.00 -2.10 0.00 0.00 70.33 66.57 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 -0.86 1.22 0.00 4.28 2.02 -0.88 -0.71 112.91 117.99 2b3b h THR 251 Ca 0.00 -0.89 -0.28 0.00 0.77 0.00 0.00 66.41 66.02 2b3b h THR 251 Cb 0.55 0.85 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 2b3b h THR 251 CO 0.00 0.31 -1.80 0.41 0.37 0.00 0.00 175.52 174.81 2b3b n THR 252 N -4.25 1.51 1.02 3.16 -1.04 -0.40 -4.59 114.28 109.70 2b3b n THR 252 Ca 0.02 -0.15 0.12 0.00 -2.04 0.00 0.00 64.05 62.01 2b3b n THR 252 Cb 0.26 -2.07 0.33 0.00 -1.82 0.00 0.00 70.33 67.04 2b3b n THR 252 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2b3b n LEU 253 N -4.36 0.43 -2.81 -4.42 4.77 -0.54 -4.95 117.00 105.12 2b3b n LEU 253 Ca -0.37 0.08 -0.22 0.00 -0.03 0.00 0.00 56.01 55.46 2b3b n LEU 253 Cb 0.71 -0.29 0.02 0.00 -2.33 0.00 0.00 43.42 41.54 2b3b n LEU 253 CO 0.11 0.10 -0.09 0.29 -1.33 0.00 0.00 177.39 176.47 2b3b n LYS 254 N -1.45 -3.83 -2.92 3.23 4.76 -0.27 -4.92 118.16 112.76 2b3b n LYS 254 Ca 0.06 0.95 -0.38 0.00 -2.87 0.00 0.00 58.31 56.08 2b3b n LYS 254 Cb 0.34 -5.75 -0.06 0.00 -1.84 0.00 0.00 35.03 27.71 2b3b n LYS 254 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2b3b s LEU 255 N -6.48 4.43 -0.19 -0.35 1.43 0.86 -4.96 118.68 113.43 2b3b s LEU 255 Ca 0.20 1.68 -0.28 0.00 -1.03 0.00 0.00 54.13 54.70 2b3b s LEU 255 Cb -0.09 -3.68 -0.00 0.00 0.03 0.00 0.00 46.19 42.45 2b3b s LEU 255 CO 0.25 0.05 0.98 -0.75 0.23 0.00 0.00 176.35 177.11 2b3b s LYS 256 N -1.73 4.30 0.40 1.70 2.20 -1.26 -4.34 119.74 121.01 2b3b s LYS 256 Ca 0.44 1.29 -0.27 0.00 -0.36 0.00 0.00 55.97 57.07 2b3b s LYS 256 Cb -0.20 -3.60 -0.09 0.00 -1.51 0.00 0.00 37.83 32.42 2b3b s LYS 256 CO 0.24 -0.49 1.40 -2.14 -0.36 0.00 0.00 175.35 174.00 2b3b s PRO 257 N 2.69 3.97 0.00 4.03 0.02 -1.26 -0.44 135.00 144.00 2b3b s PRO 257 Ca 0.44 2.37 0.00 0.00 0.02 0.00 0.00 61.00 63.83 2b3b s PRO 257 Cb -0.16 -2.83 0.00 0.00 0.02 0.00 0.00 34.50 31.53 2b3b s PRO 257 CO 0.10 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 176.61 2b3b n GLY 258 N 0.59 1.87 0.27 0.52 0.00 -0.40 -4.69 105.19 103.36 2b3b n GLY 258 Ca 0.03 -0.23 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 2b3b n GLY 258 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b3b n THR 259 N 0.00 1.31 1.19 2.61 -2.24 -1.08 -4.61 114.28 111.46 2b3b n THR 259 Ca 0.00 -0.25 0.14 0.00 -2.27 0.00 0.00 64.05 61.67 2b3b n THR 259 Cb 0.00 -1.88 0.56 0.00 -2.10 0.00 0.00 70.33 66.91 2b3b n THR 259 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2b3b n ASP 260 N -4.09 0.26 -3.56 3.42 8.00 0.41 -4.59 116.55 116.40 2b3b n ASP 260 Ca -0.41 -0.09 -0.07 0.00 0.71 0.00 0.00 54.79 54.92 2b3b n ASP 260 Cb 0.77 -0.18 -0.03 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 -2.77 -0.26 0.32 1.24 -0.12 -1.23 -4.80 117.98 110.36 2b3b s PHE 261 Ca 0.20 0.25 0.05 0.00 -0.05 0.00 0.00 56.93 57.38 2b3b s PHE 261 Cb 0.19 0.51 -0.03 0.00 -0.63 0.00 0.00 43.02 43.06 2b3b s PHE 261 CO 0.54 -0.35 0.29 0.00 -0.05 0.00 0.00 175.22 175.65 2b3b s ALA 262 N -2.30 1.62 -0.01 1.99 0.00 0.72 -1.27 121.76 122.50 2b3b s ALA 262 Ca 0.05 -1.95 -0.15 0.00 0.00 0.00 0.00 51.96 49.91 2b3b s ALA 262 Cb -0.01 1.42 0.02 0.00 0.00 0.00 0.00 23.12 24.56 2b3b s ALA 262 CO -0.05 -0.68 0.31 1.67 0.00 0.00 0.00 175.76 177.02 2b3b s TRP 263 N -3.47 -0.18 0.10 0.00 -2.14 -1.26 -2.23 118.94 109.76 2b3b s TRP 263 Ca 0.39 0.27 -0.06 0.00 2.66 0.00 0.00 56.10 59.36 2b3b s TRP 263 Cb 0.02 0.10 -0.02 0.00 -3.10 0.00 0.00 33.47 30.48 2b3b s TRP 263 CO 0.25 -0.40 0.13 0.00 -2.66 0.00 0.00 176.95 174.27 2b3b s ALA 264 N -1.37 0.14 0.61 2.67 0.00 -0.35 -4.99 121.76 118.47 2b3b s ALA 264 Ca -0.13 -0.92 -0.20 0.00 0.00 0.00 0.00 51.96 50.71 2b3b s ALA 264 Cb -0.05 0.55 -0.03 0.00 0.00 0.00 0.00 23.12 23.59 2b3b s ALA 264 CO 0.04 -0.50 1.33 -2.14 0.00 0.00 0.00 175.76 174.49 2b3b s PRO 265 N -3.92 2.77 0.23 0.00 0.02 -1.26 -0.37 135.00 132.47 2b3b s PRO 265 Ca 0.10 2.15 -0.30 0.00 0.02 0.00 0.00 61.00 62.97 2b3b s PRO 265 Cb 0.06 -2.01 -0.15 0.00 0.02 0.00 0.00 34.50 32.42 2b3b s PRO 265 CO -0.07 -1.45 1.04 0.43 -0.33 0.00 0.00 177.00 176.61 2b3b n SER 266 N -1.56 1.10 -4.55 2.53 7.64 -0.55 -4.45 113.62 113.77 2b3b n SER 266 Ca 0.14 1.16 -0.54 0.00 1.01 0.00 0.00 58.87 60.64 2b3b n SER 266 Cb 0.47 -1.23 -0.06 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 1.20 0.73 -0.77 1.43 -0.02 -1.26 -1.71 135.00 134.60 2b3b n PRO 267 Ca 0.13 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 2b3b n PRO 267 Cb 0.28 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 2b3b n PRO 267 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b3b n GLY 268 N 2.12 0.69 0.00 -1.23 0.00 -0.04 -4.56 105.19 102.17 2b3b n GLY 268 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.56 0.71 -1.61 2.61 -2.24 -0.70 -4.39 114.28 106.10 2b3b n THR 269 Ca 0.00 -0.73 -0.46 0.00 -2.27 0.00 0.00 64.05 60.59 2b3b n THR 269 Cb 0.00 0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 68.86 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 -0.36 1.47 -0.21 -0.78 3.00 -1.26 -1.40 117.38 117.84 2b3b n GLN 270 Ca 0.00 0.52 0.00 0.00 -0.01 0.00 0.00 57.00 57.51 2b3b n GLN 270 Cb 0.30 -2.02 0.00 0.00 0.00 0.00 0.00 30.24 28.52 2b3b n GLN 270 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2b3b n GLY 271 N 1.77 1.13 3.12 1.08 0.00 -1.26 -5.03 105.19 106.00 2b3b n GLY 271 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.69 1.49 -0.34 1.61 1.01 -0.49 -1.90 120.40 119.08 2b3b s VAL 272 Ca 0.00 -0.72 -0.07 0.00 0.00 0.00 0.00 61.98 61.19 2b3b s VAL 272 Cb 0.00 -1.31 0.04 0.00 0.00 0.00 0.00 36.38 35.11 2b3b s VAL 272 CO 0.00 0.43 0.13 0.12 0.00 0.00 0.00 175.10 175.78 2b3b s PHE 273 N 0.31 3.25 -0.57 5.22 5.99 0.22 -4.96 117.98 127.44 2b3b s PHE 273 Ca -0.11 -1.30 -0.21 0.00 0.00 0.00 0.00 56.93 55.31 2b3b s PHE 273 Cb -0.14 -2.31 0.07 0.00 0.00 0.00 0.00 43.02 40.63 2b3b s PHE 273 CO 0.04 -0.70 0.79 1.41 -0.00 0.00 0.00 175.22 176.75 2b3b s MET 274 N 1.44 3.15 0.32 10.12 -2.45 -1.26 -1.59 119.30 129.03 2b3b s MET 274 Ca -0.01 -0.82 0.04 0.00 -1.25 0.00 0.00 55.69 53.65 2b3b s MET 274 Cb -0.19 -4.15 -0.02 0.00 1.25 0.00 0.00 34.83 31.72 2b3b s MET 274 CO 0.04 -1.47 0.47 0.00 1.05 0.00 0.00 175.02 175.10 2b3b s MET 275 N 3.25 3.31 0.17 4.11 0.23 0.35 -0.53 119.30 130.20 2b3b s MET 275 Ca 0.19 -0.72 -0.09 0.00 -1.03 0.00 0.00 55.69 54.05 2b3b s MET 275 Cb -0.18 -2.78 -0.01 0.00 -1.53 0.00 0.00 34.83 30.32 2b3b s MET 275 CO 0.12 0.18 0.29 -0.48 -2.03 0.00 0.00 175.02 173.10 2b3b s LEU 276 N -4.18 0.93 -0.09 0.18 2.34 -0.52 -0.70 118.68 116.64 2b3b s LEU 276 Ca 0.40 -0.91 -0.04 0.00 0.06 0.00 0.00 54.13 53.64 2b3b s LEU 276 Cb -0.09 1.18 0.04 0.00 -0.56 0.00 0.00 46.19 46.76 2b3b s LEU 276 CO 0.32 -0.91 0.21 -0.55 -1.06 0.00 0.00 176.35 174.37 2b3b s SER 277 N -2.98 -0.16 0.17 1.48 0.15 -1.26 -1.05 113.70 110.04 2b3b s SER 277 Ca 0.19 0.46 -0.28 0.00 0.70 0.00 0.00 55.95 57.01 2b3b s SER 277 Cb 0.03 0.35 -0.08 0.00 -1.71 0.00 0.00 66.02 64.62 2b3b s SER 277 CO 0.02 -0.17 0.89 -1.81 1.20 0.00 0.00 173.24 173.37 2b3b s ASP 278 N 1.32 7.51 0.12 5.45 1.01 -1.26 -1.38 116.67 129.44 2b3b s ASP 278 Ca -0.08 1.79 -0.06 0.00 0.71 0.00 0.00 52.55 54.90 2b3b s ASP 278 Cb -0.11 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.24 2b3b s ASP 278 CO -0.08 0.10 0.16 -0.94 0.21 0.00 0.00 175.17 174.63 2b3b s SER 279 N -0.77 0.18 -0.00 0.27 1.04 0.15 -0.99 113.70 113.58 2b3b s SER 279 Ca 0.41 -0.89 0.05 0.00 0.48 0.00 0.00 55.95 56.00 2b3b s SER 279 Cb -0.24 0.34 -0.01 0.00 0.10 0.00 0.00 66.02 66.21 2b3b s SER 279 CO 0.29 -0.77 -0.16 -0.36 0.98 0.00 0.00 173.24 173.22 2b3b s PHE 280 N -3.95 1.45 0.00 5.02 0.08 -0.57 -0.53 117.98 119.48 2b3b s PHE 280 Ca 0.13 -0.29 0.00 0.00 0.12 0.00 0.00 56.93 56.90 2b3b s PHE 280 Cb 0.05 -0.92 -0.00 0.00 -0.57 0.00 0.00 43.02 41.59 2b3b s PHE 280 CO -0.04 -0.01 0.00 0.41 -0.10 0.00 0.00 175.22 175.48 2b3b n GLY 281 N 2.54 4.18 2.91 4.36 0.00 -1.26 -0.07 105.19 117.86 2b3b n GLY 281 Ca -0.15 -2.17 -0.30 0.00 0.00 0.00 0.00 46.02 43.40 2b3b n GLY 281 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2b3b s LEU 282 N 0.00 3.93 0.31 0.99 2.96 -1.26 -4.43 118.68 121.18 2b3b s LEU 282 Ca 0.00 -2.32 -0.29 0.00 -0.22 0.00 0.00 54.13 51.31 2b3b s LEU 282 Cb 0.00 -1.41 -0.10 0.00 0.50 0.00 0.00 46.19 45.17 2b3b s LEU 282 CO 0.00 -0.34 1.35 -2.16 -1.32 0.00 0.00 176.35 173.88 2b3b s PRO 283 N 0.69 4.32 0.30 0.98 0.04 -1.26 -0.76 135.00 139.31 2b3b s PRO 283 Ca 0.13 2.26 -0.29 0.00 0.04 0.00 0.00 61.00 63.14 2b3b s PRO 283 Cb -0.21 -3.07 -0.13 0.00 0.04 0.00 0.00 34.50 31.13 2b3b s PRO 283 CO -0.08 -0.27 1.32 1.63 0.04 0.00 0.00 177.00 179.63 2b3b n LYS 284 N 1.14 2.04 -0.69 4.56 5.02 -0.22 -2.60 118.16 127.41 2b3b n LYS 284 Ca 0.02 0.72 0.00 0.00 -2.02 0.00 0.00 58.31 57.02 2b3b n LYS 284 Cb 0.41 -2.31 0.00 0.00 -0.02 0.00 0.00 35.03 33.11 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 1.35 0.84 3.57 0.72 0.00 -1.26 -4.84 105.19 105.57 2b3b n GLY 285 Ca 0.08 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.57 2b3b n GLY 285 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b3b n ALA 286 N 0.06 -1.48 0.03 4.61 0.00 -1.07 -4.80 120.51 117.87 2b3b n ALA 286 Ca 0.00 0.53 -0.03 0.00 0.00 0.00 0.00 53.44 53.94 2b3b n ALA 286 Cb 0.00 -2.01 0.20 0.00 0.00 0.00 0.00 19.45 17.64 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 4.20 0.43 -2.22 0.00 1.57 -1.87 -3.34 116.57 115.35 2b3b h LYS 287 Ca -0.48 -0.18 -0.60 0.00 -1.87 0.00 0.00 60.65 57.52 2b3b h LYS 287 Cb 1.35 -0.02 -0.42 0.00 0.08 0.00 0.00 32.23 33.23 2b3b h LYS 287 CO 0.75 0.70 -0.58 0.09 -0.57 0.00 0.00 179.45 179.84 2b3b n ASN 288 N -4.09 3.99 -0.10 0.86 3.02 -1.26 -4.94 115.26 112.73 2b3b n ASN 288 Ca -0.01 -3.51 -0.08 0.00 -0.03 0.00 0.00 54.58 50.96 2b3b n ASN 288 Cb 0.43 -0.65 -0.00 0.00 -0.61 0.00 0.00 39.78 38.95 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 3.91 0.41 -0.49 3.52 2.43 -1.94 -1.00 114.38 121.21 2b3b h ARG 289 Ca 0.19 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.28 2b3b h ARG 289 Cb 0.62 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 2b3b h ARG 289 CO 0.84 0.27 0.10 0.37 -1.51 0.00 0.00 179.97 180.05 2b3b h GLN 290 N 0.42 0.80 -0.43 0.20 4.15 -1.95 0.51 115.11 118.82 2b3b h GLN 290 Ca 0.14 -0.20 -0.08 0.00 0.77 0.00 0.00 58.65 59.27 2b3b h GLN 290 Cb -0.00 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.57 2b3b h GLN 290 CO -0.06 0.79 -0.06 -0.91 -1.93 0.00 0.00 178.83 176.66 2b3b h ASN 291 N 0.68 0.72 -0.18 -0.69 2.35 -1.83 -1.74 115.58 114.88 2b3b h ASN 291 Ca 0.15 -0.19 -0.00 0.00 -0.55 0.00 0.00 56.30 55.71 2b3b h ASN 291 Cb 0.36 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 2b3b h ASN 291 CO 0.01 0.82 0.10 0.00 -1.65 0.00 0.00 177.43 176.71 2b3b h ALA 292 N 1.25 0.23 -1.00 -0.83 0.00 -0.60 -1.88 119.26 116.42 2b3b h ALA 292 Ca 0.13 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.03 2b3b h ALA 292 Cb 0.51 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 2b3b h ALA 292 CO 0.03 -0.24 0.66 0.82 0.00 0.00 0.00 179.25 180.51 2b3b h ILE 293 N 0.19 1.15 -0.02 0.00 2.04 -0.67 -0.94 117.51 119.26 2b3b h ILE 293 Ca 0.06 -0.43 -0.07 0.00 1.00 0.00 0.00 64.86 65.42 2b3b h ILE 293 Cb 0.06 -0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 35.93 2b3b h ILE 293 CO -0.01 0.23 -0.34 0.78 0.00 0.00 0.00 178.15 178.81 2b3b h ASN 294 N 1.24 0.03 -0.11 1.72 2.35 -1.08 -1.42 115.58 118.31 2b3b h ASN 294 Ca 0.41 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 56.14 2b3b h ASN 294 Cb 0.05 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.41 2b3b h ASN 294 CO -0.14 0.37 0.03 -0.25 -1.65 0.00 0.00 177.43 175.79 2b3b h TRP 295 N 0.03 0.19 -0.77 1.19 2.91 -0.39 -1.74 115.95 117.37 2b3b h TRP 295 Ca 0.00 -0.02 0.08 0.00 1.13 0.00 0.00 58.89 60.08 2b3b h TRP 295 Cb 0.62 -0.05 -0.07 0.00 -0.51 0.00 0.00 29.16 29.15 2b3b h TRP 295 CO 0.00 0.33 0.43 -0.07 -1.03 0.00 0.00 178.44 178.11 2b3b h LEU 296 N -0.01 0.63 -1.04 0.65 3.38 -0.92 0.32 115.31 118.31 2b3b h LEU 296 Ca 0.04 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2b3b h LEU 296 Cb 0.24 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2b3b h LEU 296 CO -0.00 0.38 0.45 0.03 0.09 0.00 0.00 178.44 179.39 2b3b h ARG 297 N 0.75 1.12 -0.18 1.13 3.08 -1.12 0.35 114.38 119.51 2b3b h ARG 297 Ca 0.36 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 60.25 2b3b h ARG 297 Cb 0.29 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 2b3b h ARG 297 CO -0.22 0.81 -0.03 1.25 -1.07 0.00 0.00 179.97 180.71 2b3b h LEU 298 N 1.13 0.34 -1.14 3.04 5.85 -0.29 -3.12 115.31 121.11 2b3b h LEU 298 Ca 0.29 -0.35 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 2b3b h LEU 298 Cb 0.01 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 2b3b h LEU 298 CO -0.05 0.61 0.26 0.58 -0.34 0.00 0.00 178.44 179.50 2b3b h VAL 299 N 0.07 1.21 -0.00 1.05 2.07 0.08 -2.24 116.25 118.48 2b3b h VAL 299 Ca 0.05 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2b3b h VAL 299 Cb 0.45 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2b3b h VAL 299 CO 0.01 0.25 -0.02 0.61 0.02 0.00 0.00 177.57 178.45 2b3b n GLY 300 N -1.09 -0.92 3.90 2.17 0.00 0.07 -4.52 105.19 104.80 2b3b n GLY 300 Ca 0.05 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 2b3b n GLY 300 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b3b s SER 301 N -2.19 6.50 0.37 1.61 1.04 -0.84 -4.97 113.70 115.21 2b3b s SER 301 Ca 0.40 0.76 0.04 0.00 0.48 0.00 0.00 55.95 57.62 2b3b s SER 301 Cb 0.21 -2.16 0.70 0.00 0.10 0.00 0.00 66.02 64.87 2b3b s SER 301 CO 0.40 -0.14 2.02 0.50 0.98 0.00 0.00 173.24 177.00 2b3b h LYS 302 N 2.00 0.75 0.11 4.02 3.64 -1.91 -1.50 116.57 123.68 2b3b h LYS 302 Ca -0.47 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 58.86 2b3b h LYS 302 Cb 1.18 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 2b3b h LYS 302 CO 0.67 0.49 -0.05 1.49 -2.27 0.00 0.00 179.45 179.78 2b3b h GLU 303 N 0.77 -0.15 0.10 1.90 4.81 -1.94 -0.91 114.58 119.16 2b3b h GLU 303 Ca 0.21 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 2b3b h GLU 303 Cb -0.08 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.33 2b3b h GLU 303 CO -0.05 0.02 -0.05 0.78 -0.73 0.00 0.00 179.01 178.99 2b3b h GLY 304 N -0.29 -0.14 1.60 1.92 0.00 -1.67 -2.73 103.07 101.77 2b3b h GLY 304 Ca -0.02 0.05 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 2b3b h GLY 304 CO 0.03 -0.05 -0.09 1.46 0.00 0.00 0.00 176.54 177.89 2b3b h GLN 305 N -0.26 0.49 0.00 4.80 4.20 -1.25 -0.88 115.11 122.22 2b3b h GLN 305 Ca -0.01 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.57 2b3b h GLN 305 Cb 0.21 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.93 2b3b h GLN 305 CO 0.02 0.58 -0.38 -0.25 -0.67 0.00 0.00 178.83 178.14 2b3b n ASP 306 N -4.23 0.39 -0.05 1.46 9.92 -0.35 -1.60 116.55 122.08 2b3b n ASP 306 Ca 0.01 -0.03 -0.19 0.00 -0.53 0.00 0.00 54.79 54.05 2b3b n ASP 306 Cb 0.30 0.05 -0.13 0.00 -0.64 0.00 0.00 41.12 40.69 2b3b n ASP 306 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2b3b h THR 307 N 0.00 1.34 0.02 -3.53 2.02 -1.12 -3.41 112.91 108.22 2b3b h THR 307 Ca 0.00 -2.33 -0.04 0.00 0.77 0.00 0.00 66.41 64.81 2b3b h THR 307 Cb 0.51 2.87 0.00 0.00 -1.74 0.00 0.00 68.15 69.80 2b3b h THR 307 CO 0.00 0.55 -0.18 0.77 0.37 0.00 0.00 175.52 177.03 2b3b h SER 308 N -0.79 0.12 -0.58 4.18 4.64 -1.21 -3.39 113.55 116.53 2b3b h SER 308 Ca -0.18 -0.90 -0.01 0.00 -0.47 0.00 0.00 61.79 60.23 2b3b h SER 308 Cb 1.32 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 63.34 2b3b h SER 308 CO -0.04 1.01 0.35 0.78 -0.87 0.00 0.00 176.83 178.06 2b3b h ASN 309 N -0.74 0.71 -0.75 4.97 2.35 -1.52 -2.54 115.58 118.06 2b3b h ASN 309 Ca -0.03 -0.04 0.15 0.00 -0.55 0.00 0.00 56.30 55.83 2b3b h ASN 309 Cb 1.05 -0.18 -0.05 0.00 0.05 0.00 0.00 38.32 39.19 2b3b h ASN 309 CO 0.03 0.56 0.50 -0.65 -1.65 0.00 0.00 177.43 176.22 2b3b h PRO 310 N 0.82 0.41 0.00 0.81 0.11 -1.79 -2.05 132.00 130.32 2b3b h PRO 310 Ca 0.21 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 66.17 2b3b h PRO 310 Cb -0.01 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 30.99 2b3b h PRO 310 CO -0.04 0.27 -0.60 -0.07 -0.21 0.00 0.00 178.00 177.35 2b3b h LEU 311 N 0.42 0.00 0.04 2.35 3.38 -1.67 -3.37 115.31 116.46 2b3b h LEU 311 Ca 0.37 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.05 2b3b h LEU 311 Cb 0.83 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.55 2b3b h LEU 311 CO -0.12 0.60 -1.55 0.50 0.09 0.00 0.00 178.44 177.97 2b3b h LYS 312 N 0.00 0.08 0.00 1.13 1.63 -1.31 -3.42 116.57 114.68 2b3b h LYS 312 Ca -0.01 -0.14 0.00 0.00 -0.85 0.00 0.00 60.65 59.65 2b3b h LYS 312 Cb 1.18 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.86 2b3b h LYS 312 CO 0.08 0.81 0.00 0.41 -3.45 0.00 0.00 179.45 177.29 2b3b n GLY 313 N 1.58 1.98 3.82 5.01 0.00 -1.03 -3.43 105.19 113.12 2b3b n GLY 313 Ca -0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.44 4.63 0.35 1.61 1.04 -1.25 -4.62 113.70 114.03 2b3b s SER 314 Ca 0.00 1.24 0.05 0.00 0.48 0.00 0.00 55.95 57.72 2b3b s SER 314 Cb 0.00 -1.98 -0.01 0.00 0.10 0.00 0.00 66.02 64.13 2b3b s SER 314 CO 0.00 -1.87 0.50 0.27 0.98 0.00 0.00 173.24 173.12 2b3b s ILE 315 N -3.21 4.21 0.59 -1.02 -4.36 -0.24 -4.51 121.20 112.67 2b3b s ILE 315 Ca 0.60 -0.87 -0.19 0.00 -0.26 0.00 0.00 60.65 59.93 2b3b s ILE 315 Cb -0.14 -3.49 -0.03 0.00 1.25 0.00 0.00 42.46 40.05 2b3b s ILE 315 CO 0.54 -0.22 1.22 0.00 0.24 0.00 0.00 174.94 176.72 2b3b s ALA 316 N -2.24 2.55 0.23 2.27 0.00 -1.26 -0.35 121.76 122.96 2b3b s ALA 316 Ca 0.44 1.05 0.08 0.00 0.00 0.00 0.00 51.96 53.53 2b3b s ALA 316 Cb -0.10 -3.47 0.20 0.00 0.00 0.00 0.00 23.12 19.76 2b3b s ALA 316 CO 0.32 -1.21 1.52 0.00 0.00 0.00 0.00 175.76 176.39 2b3b h ALA 317 N 0.91 0.80 -2.70 0.00 0.00 -1.76 -3.38 119.26 113.14 2b3b h ALA 317 Ca -0.51 -0.63 -0.52 0.00 0.00 0.00 0.00 54.91 53.25 2b3b h ALA 317 Cb 1.30 -0.10 0.04 0.00 0.00 0.00 0.00 17.79 19.03 2b3b h ALA 317 CO 0.55 0.85 0.68 1.03 0.00 0.00 0.00 179.25 182.36 2b3b s ARG 318 N -3.45 4.36 0.47 0.00 0.52 -1.26 -4.37 118.95 115.23 2b3b s ARG 318 Ca -0.02 2.11 0.14 0.00 -0.52 0.00 0.00 55.73 57.44 2b3b s ARG 318 Cb 0.12 -3.17 1.10 0.00 0.52 0.00 0.00 34.95 33.51 2b3b s ARG 318 CO 0.79 -0.29 2.07 -0.07 0.02 0.00 0.00 175.30 177.82 2b3b h LEU 319 N 5.27 0.08 -1.90 2.53 3.38 -1.48 -2.72 115.31 120.47 2b3b h LEU 319 Ca -0.45 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2b3b h LEU 319 Cb 1.22 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2b3b h LEU 319 CO 0.77 0.13 0.00 -0.90 0.09 0.00 0.00 178.44 178.53 2b3b n ASP 320 N -4.45 2.81 -4.63 -0.43 5.75 -1.26 -4.96 116.55 109.38 2b3b n ASP 320 Ca -0.02 -2.17 -0.44 0.00 -0.01 0.00 0.00 54.79 52.16 2b3b n ASP 320 Cb 0.15 -0.39 -0.01 0.00 -1.03 0.00 0.00 41.12 39.83 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 0.68 1.90 -4.53 -1.12 2.88 -1.03 -4.93 113.62 107.46 2b3b n SER 321 Ca 0.15 1.19 -0.43 0.00 -1.33 0.00 0.00 58.87 58.45 2b3b n SER 321 Cb 0.51 -1.36 -0.04 0.00 -0.75 0.00 0.00 64.21 62.56 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 -0.42 6.38 0.52 -3.46 -1.08 -1.26 -4.93 116.67 112.43 2b3b s ASP 322 Ca 0.58 -0.22 0.35 0.00 -0.52 0.00 0.00 52.55 52.74 2b3b s ASP 322 Cb -0.65 -2.42 1.64 0.00 -1.46 0.00 0.00 42.92 40.02 2b3b s ASP 322 CO 0.60 -1.11 2.04 1.55 0.52 0.00 0.00 175.17 178.77 2b3b h PRO 323 N 9.18 0.00 0.00 4.34 0.13 -1.97 -1.95 132.00 141.73 2b3b h PRO 323 Ca -0.25 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.87 2b3b h PRO 323 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 2b3b h PRO 323 CO 1.04 0.00 -0.04 0.66 -0.23 0.00 0.00 178.00 179.43 2b3b h SER 324 N 0.00 0.00 0.50 1.44 4.64 -2.00 -2.30 113.55 115.83 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 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2b3b h SER 324 CO 0.00 0.04 0.00 0.29 -0.87 0.00 0.00 176.83 176.29 2b3b n LYS 325 N -3.22 0.29 -4.26 4.77 4.76 -0.73 -4.86 118.16 114.90 2b3b n LYS 325 Ca -0.01 0.07 -0.30 0.00 -2.87 0.00 0.00 58.31 55.20 2b3b n LYS 325 Cb 0.24 -1.50 -0.10 0.00 -1.84 0.00 0.00 35.03 31.83 2b3b n LYS 325 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2b3b s TYR 326 N -2.63 2.77 0.39 2.13 2.02 -0.87 -4.75 117.35 116.41 2b3b s TYR 326 Ca 0.21 -0.14 -0.06 0.00 -0.37 0.00 0.00 57.07 56.71 2b3b s TYR 326 Cb 0.16 -1.46 0.09 0.00 -0.40 0.00 0.00 41.96 40.35 2b3b s TYR 326 CO 0.37 0.42 0.53 0.27 -1.57 0.00 0.00 175.55 175.57 2b3b n ASN 327 N 0.81 0.13 -0.28 2.29 0.23 -1.26 -4.69 115.26 112.50 2b3b n ASN 327 Ca -0.13 -1.25 0.12 0.00 -0.53 0.00 0.00 54.58 52.78 2b3b n ASN 327 Cb 0.52 -0.40 0.36 0.00 -2.08 0.00 0.00 39.78 38.19 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 -1.67 1.80 0.40 -2.53 0.00 -1.98 -1.51 119.26 113.77 2b3b h ALA 328 Ca -0.17 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2b3b h ALA 328 Cb 0.50 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2b3b h ALA 328 CO 0.13 -0.05 -0.19 -0.92 0.00 0.00 0.00 179.25 178.22 2b3b h TYR 329 N 0.72 -0.50 -0.84 0.00 3.20 -1.93 -2.58 116.97 115.04 2b3b h TYR 329 Ca 0.46 -0.01 0.19 0.00 3.14 0.00 0.00 58.73 62.51 2b3b h TYR 329 Cb 0.71 0.17 -0.12 0.00 1.54 0.00 0.00 36.73 39.03 2b3b h TYR 329 CO -0.00 -0.18 0.33 0.78 -1.64 0.00 0.00 178.16 177.45 2b3b h GLY 330 N -0.97 1.35 1.27 1.82 0.00 -1.79 0.61 103.07 105.36 2b3b h GLY 330 Ca -0.06 -0.14 -0.15 0.00 0.00 0.00 0.00 47.33 46.98 2b3b h GLY 330 CO 0.09 -0.21 -0.42 1.46 0.00 0.00 0.00 176.54 177.46 2b3b h GLN 331 N 0.40 0.79 -0.60 4.80 4.20 -1.35 0.84 115.11 124.18 2b3b h GLN 331 Ca 0.50 -0.43 0.00 0.00 0.06 0.00 0.00 58.65 58.79 2b3b h GLN 331 Cb 0.89 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.66 2b3b h GLN 331 CO -0.50 1.06 0.39 1.03 -0.67 0.00 0.00 178.83 180.14 2b3b h SER 332 N 0.64 0.70 -0.58 1.46 0.87 -0.72 -2.12 113.55 113.80 2b3b h SER 332 Ca 0.05 -0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.52 2b3b h SER 332 Cb 0.99 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.75 2b3b h SER 332 CO 0.09 0.52 0.14 0.00 -0.53 0.00 0.00 176.83 177.06 2b3b h ALA 333 N 1.21 0.77 -0.98 6.23 0.00 -0.46 -2.39 119.26 123.64 2b3b h ALA 333 Ca 0.22 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2b3b h ALA 333 Cb -0.08 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.44 2b3b h ALA 333 CO -0.05 0.47 0.64 0.52 0.00 0.00 0.00 179.25 180.84 2b3b h MET 334 N 0.84 1.24 -0.49 0.00 2.07 -0.68 -0.18 114.93 117.73 2b3b h MET 334 Ca 0.18 -0.07 -0.06 0.00 -2.07 0.00 0.00 59.70 57.68 2b3b h MET 334 Cb 0.35 -0.28 -0.02 0.00 -1.87 0.00 0.00 31.60 29.78 2b3b h MET 334 CO 0.00 0.82 0.07 0.00 1.07 0.00 0.00 176.91 178.87 2b3b h ARG 335 N 1.27 0.83 -0.08 1.72 3.08 -1.20 -2.71 114.38 117.29 2b3b h ARG 335 Ca 0.38 -0.23 -0.14 0.00 0.07 0.00 0.00 59.98 60.06 2b3b h ARG 335 Cb -0.06 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 2b3b h ARG 335 CO -0.10 0.83 -0.57 -0.44 -1.07 0.00 0.00 179.97 178.61 2b3b h ASP 336 N 0.70 0.27 -0.78 7.04 5.19 -1.12 -2.32 116.42 125.40 2b3b h ASP 336 Ca 0.15 -0.15 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 2b3b h ASP 336 Cb 0.41 -0.08 -0.04 0.00 0.18 0.00 0.00 39.33 39.81 2b3b h ASP 336 CO 0.01 0.78 0.42 -0.25 -3.12 0.00 0.00 179.24 177.09 2b3b h TRP 337 N 0.18 1.08 0.00 4.55 -0.00 -0.90 0.15 115.95 121.01 2b3b h TRP 337 Ca -0.00 -0.03 -0.07 0.00 -0.00 0.00 0.00 58.89 58.79 2b3b h TRP 337 Cb 1.06 -0.34 -0.01 0.00 -0.00 0.00 0.00 29.16 29.87 2b3b h TRP 337 CO 0.02 0.75 -0.35 0.00 -0.00 0.00 0.00 178.44 178.86 2b3b h ARG 338 N 1.10 0.00 0.00 2.65 3.08 -1.35 -3.38 114.38 116.49 2b3b h ARG 338 Ca 0.28 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.11 2b3b h ARG 338 Cb 0.04 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.05 2b3b h ARG 338 CO -0.04 0.35 -1.86 -1.13 -1.07 0.00 0.00 179.97 176.22 2b3b n SER 339 N -3.19 1.86 -4.86 7.04 3.41 -0.89 -5.04 113.62 111.95 2b3b n SER 339 Ca 0.03 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.32 2b3b n SER 339 Cb 0.67 0.87 0.01 0.00 -0.26 0.00 0.00 64.21 65.50 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 -4.49 6.19 0.21 4.04 -0.87 0.49 -5.02 114.94 115.48 2b3b s ASN 340 Ca -0.06 1.47 -0.31 0.00 -1.57 0.00 0.00 52.86 52.39 2b3b s ASN 340 Cb 0.04 -2.48 -0.10 0.00 -0.02 0.00 0.00 41.25 38.70 2b3b s ASN 340 CO 0.53 -0.90 1.45 -0.60 -2.57 0.00 0.00 177.10 175.01 2b3b s ARG 341 N -5.00 4.27 -0.17 -0.60 3.52 -0.80 -4.84 118.95 115.33 2b3b s ARG 341 Ca 0.56 2.26 -0.06 0.00 -0.13 0.00 0.00 55.73 58.36 2b3b s ARG 341 Cb -0.11 -3.14 -0.04 0.00 -1.56 0.00 0.00 34.95 30.10 2b3b s ARG 341 CO 0.51 -0.45 0.03 0.42 -0.81 0.00 0.00 175.30 175.00 2b3b s ILE 342 N 0.41 4.52 0.24 4.11 -1.09 -1.26 -0.61 121.20 127.52 2b3b s ILE 342 Ca 0.62 -0.13 0.04 0.00 -2.23 0.00 0.00 60.65 58.95 2b3b s ILE 342 Cb -0.41 -3.01 -0.05 0.00 -1.58 0.00 0.00 42.46 37.40 2b3b s ILE 342 CO 0.38 0.48 -0.01 0.68 -1.23 0.00 0.00 174.94 175.24 2b3b s VAL 343 N 0.27 1.12 0.11 2.92 -7.23 -0.62 -4.97 120.40 111.99 2b3b s VAL 343 Ca 0.02 -2.04 0.02 0.00 -1.81 0.00 0.00 61.98 58.16 2b3b s VAL 343 Cb -0.13 -2.36 -0.04 0.00 0.56 0.00 0.00 36.38 34.41 2b3b s VAL 343 CO 0.01 -0.32 0.23 -0.83 -0.31 0.00 0.00 175.10 173.88 2b3b s GLY 344 N -3.33 1.93 0.32 2.32 0.00 -1.26 -0.49 107.32 106.80 2b3b s GLY 344 Ca 0.29 -0.96 -0.27 0.00 0.00 0.00 0.00 44.72 43.77 2b3b s GLY 344 CO 0.09 -0.95 1.01 -0.45 0.00 0.00 0.00 173.10 172.80 2b3b s SER 345 N -2.87 7.23 -0.12 1.64 0.15 0.12 -4.76 113.70 115.09 2b3b s SER 345 Ca 0.34 2.02 -0.11 0.00 0.70 0.00 0.00 55.95 58.90 2b3b s SER 345 Cb -0.12 -2.60 -0.09 0.00 -1.71 0.00 0.00 66.02 61.50 2b3b s SER 345 CO 0.28 -0.15 0.24 0.25 1.20 0.00 0.00 173.24 175.06 2b3b h LEU 346 N 3.35 0.00 -1.98 3.45 5.85 -1.96 -1.27 115.31 122.74 2b3b h LEU 346 Ca -0.47 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 57.91 2b3b h LEU 346 Cb 1.20 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.23 2b3b h LEU 346 CO 0.65 0.71 -0.03 0.58 -0.34 0.00 0.00 178.44 180.01 2b3b h VAL 347 N -1.00 0.97 -0.57 1.05 2.07 -1.95 -2.47 116.25 114.35 2b3b h VAL 347 Ca -0.01 -0.11 -0.34 0.00 0.82 0.00 0.00 66.70 67.06 2b3b h VAL 347 Cb 0.40 1.06 -0.20 0.00 -1.52 0.00 0.00 31.29 31.03 2b3b h VAL 347 CO -0.01 0.03 0.01 1.41 0.02 0.00 0.00 177.57 179.04 2b3b n HIS 348 N -4.42 1.84 -0.39 1.57 8.25 -1.26 -4.98 115.22 115.82 2b3b n HIS 348 Ca -0.03 -1.91 0.00 0.00 -0.26 0.00 0.00 57.72 55.52 2b3b n HIS 348 Cb 0.12 -0.65 0.00 0.00 1.12 0.00 0.00 29.99 30.58 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 -1.05 0.91 0.11 -1.41 0.00 -0.93 -4.66 105.19 98.16 2b3b n GLY 349 Ca 0.42 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.25 2b3b n GLY 349 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b3b h ALA 350 N 0.00 -0.07 0.00 4.61 0.00 -1.34 -0.45 119.26 122.02 2b3b h ALA 350 Ca 0.00 -0.66 -0.00 0.00 0.00 0.00 0.00 54.91 54.25 2b3b h ALA 350 Cb 0.00 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2b3b h ALA 350 CO 0.00 0.31 -1.87 1.33 0.00 0.00 0.00 179.25 179.03 2b3b n VAL 351 N -4.21 0.01 -4.15 0.00 0.24 -1.00 -1.63 118.33 107.59 2b3b n VAL 351 Ca -0.13 -0.43 -0.16 0.00 -2.04 0.00 0.00 64.34 61.57 2b3b n VAL 351 Cb 0.76 0.06 -0.12 0.00 -1.47 0.00 0.00 33.84 33.07 2b3b n VAL 351 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2b3b s ALA 352 N -3.30 0.89 0.68 2.33 0.00 -1.26 -4.86 121.76 116.24 2b3b s ALA 352 Ca -0.07 -0.84 -0.13 0.00 0.00 0.00 0.00 51.96 50.92 2b3b s ALA 352 Cb 0.12 -0.05 0.01 0.00 0.00 0.00 0.00 23.12 23.19 2b3b s ALA 352 CO 0.78 0.10 1.08 -1.25 0.00 0.00 0.00 175.76 176.47 2b3b s PRO 353 N -1.49 2.80 0.55 0.00 0.04 -1.26 -3.81 135.00 131.83 2b3b s PRO 353 Ca -0.04 1.20 0.27 0.00 0.04 0.00 0.00 61.00 62.47 2b3b s PRO 353 Cb -0.09 -1.96 1.44 0.00 0.04 0.00 0.00 34.50 33.93 2b3b s PRO 353 CO 0.01 -1.22 1.97 0.93 0.04 0.00 0.00 177.00 178.73 2b3b h GLU 354 N -0.33 0.00 -0.79 4.56 5.08 -1.85 0.78 114.58 122.03 2b3b h GLU 354 Ca -0.45 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 57.93 2b3b h GLU 354 Cb 1.23 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.44 2b3b h GLU 354 CO 0.55 0.00 0.52 0.66 -1.00 0.00 0.00 179.01 179.74 2b3b h SER 355 N 0.00 0.86 0.03 1.42 4.64 -1.91 -0.02 113.55 118.56 2b3b h SER 355 Ca 0.26 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.49 2b3b h SER 355 Cb 1.10 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.98 2b3b h SER 355 CO -0.00 0.60 -0.36 0.15 -0.87 0.00 0.00 176.83 176.35 2b3b h PHE 356 N 1.00 0.11 -0.54 4.77 3.57 -1.28 -3.35 116.94 121.21 2b3b h PHE 356 Ca 0.31 -0.08 0.09 0.00 3.53 0.00 0.00 57.97 61.82 2b3b h PHE 356 Cb -0.00 -0.00 -0.07 0.00 2.79 0.00 0.00 35.95 38.66 2b3b h PHE 356 CO -0.00 1.14 0.12 0.52 -2.23 0.00 0.00 178.31 177.86 2b3b h MET 357 N -0.87 0.25 -0.47 1.11 2.86 -0.87 -1.77 114.93 115.16 2b3b h MET 357 Ca -0.08 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 2b3b h MET 357 Cb 1.18 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.76 2b3b h MET 357 CO -0.00 0.16 0.16 0.66 1.06 0.00 0.00 176.91 178.95 2b3b h SER 358 N 0.26 0.63 1.03 1.22 4.64 -1.19 -2.60 113.55 117.53 2b3b h SER 358 Ca 0.27 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2b3b h SER 358 Cb 0.38 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2b3b h SER 358 CO -0.35 0.60 -0.41 0.00 -0.87 0.00 0.00 176.83 175.79 2b3b n GLN 359 N -4.33 0.26 0.16 4.77 6.02 -0.81 -3.60 117.38 119.84 2b3b n GLN 359 Ca 0.03 0.12 0.01 0.00 -0.01 0.00 0.00 57.00 57.15 2b3b n GLN 359 Cb 0.18 -1.70 0.25 0.00 1.02 0.00 0.00 30.24 29.98 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 -0.87 1.08 3.57 -0.93 -1.83 116.94 117.96 2b3b h PHE 360 Ca 0.00 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.55 2b3b h PHE 360 Cb 0.72 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.41 2b3b h PHE 360 CO 0.00 0.51 0.57 0.78 -2.23 0.00 0.00 178.31 177.94 2b3b h GLY 361 N 1.66 1.25 1.01 2.40 0.00 -1.62 -0.36 103.07 107.41 2b3b h GLY 361 Ca -0.01 -0.41 -0.12 0.00 0.00 0.00 0.00 47.33 46.79 2b3b h GLY 361 CO 0.07 0.34 -0.23 -0.84 0.00 0.00 0.00 176.54 175.87 2b3b h THR 362 N 1.04 1.29 -0.56 4.70 2.02 -1.54 -0.72 112.91 119.13 2b3b h THR 362 Ca 0.36 -1.38 0.07 0.00 0.77 0.00 0.00 66.41 66.23 2b3b h THR 362 Cb 0.09 1.39 -0.06 0.00 -1.74 0.00 0.00 68.15 67.83 2b3b h THR 362 CO -0.12 0.46 0.24 0.58 0.37 0.00 0.00 175.52 177.05 2b3b h VAL 363 N 0.58 0.85 -0.39 3.16 2.07 -0.83 -1.12 116.25 120.58 2b3b h VAL 363 Ca 0.07 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.36 2b3b h VAL 363 Cb 0.80 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 2b3b h VAL 363 CO 0.06 0.08 -0.08 -0.03 0.02 0.00 0.00 177.57 177.63 2b3b h MET 364 N 0.44 0.74 -0.88 1.57 4.05 -0.97 -1.59 114.93 118.29 2b3b h MET 364 Ca 0.27 -0.27 0.02 0.00 -0.28 0.00 0.00 59.70 59.44 2b3b h MET 364 Cb 0.27 -0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 30.98 2b3b h MET 364 CO -0.24 0.87 0.58 1.49 0.23 0.00 0.00 176.91 179.84 2b3b h GLU 365 N 0.55 1.12 -0.42 0.39 4.81 -0.77 -0.40 114.58 119.86 2b3b h GLU 365 Ca 0.10 -0.07 -0.10 0.00 -0.13 0.00 0.00 59.36 59.16 2b3b h GLU 365 Cb 0.59 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 2b3b h GLU 365 CO 0.04 0.74 -0.13 0.82 -0.73 0.00 0.00 179.01 179.75 2b3b h ILE 366 N 1.15 1.28 -0.60 2.32 2.04 -1.03 -2.54 117.51 120.12 2b3b h ILE 366 Ca 0.34 -1.24 -0.03 0.00 1.00 0.00 0.00 64.86 64.93 2b3b h ILE 366 Cb -0.06 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 2b3b h ILE 366 CO -0.10 0.42 0.28 0.15 0.00 0.00 0.00 178.15 178.90 2b3b h PHE 367 N 0.65 0.88 -0.86 1.37 3.57 -0.68 0.25 116.94 122.12 2b3b h PHE 367 Ca 0.10 -0.05 0.14 0.00 3.53 0.00 0.00 57.97 61.69 2b3b h PHE 367 Cb 0.67 -0.27 -0.07 0.00 2.79 0.00 0.00 35.95 39.07 2b3b h PHE 367 CO 0.05 0.68 0.56 -0.07 -2.23 0.00 0.00 178.31 177.30 2b3b h LEU 368 N 0.83 0.61 0.00 0.59 -0.00 -1.01 0.85 115.31 117.18 2b3b h LEU 368 Ca 0.21 0.03 -0.00 0.00 -0.00 0.00 0.00 57.88 58.12 2b3b h LEU 368 Cb 0.14 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 40.71 2b3b h LEU 368 CO -0.02 0.32 -0.00 1.56 -0.00 0.00 0.00 178.44 180.29 2b3b h GLN 369 N 0.65 -0.00 0.00 1.13 1.08 -0.89 -3.38 115.11 113.70 2b3b h GLN 369 Ca 0.43 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.51 2b3b h GLN 369 Cb 0.71 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.12 2b3b h GLN 369 CO -0.18 0.88 -0.83 1.79 -0.95 0.00 0.00 178.83 179.53 2b3b h THR 370 N -0.98 0.67 -7.02 -0.54 1.35 -0.44 -3.48 112.91 102.48 2b3b h THR 370 Ca -0.00 -2.04 -0.60 0.00 -0.55 0.00 0.00 66.41 63.22 2b3b h THR 370 Cb 0.88 2.23 -0.30 0.00 -1.73 0.00 0.00 68.15 69.23 2b3b h THR 370 CO 0.00 0.38 -0.89 0.54 -0.25 0.00 0.00 175.52 175.30 2b3b n ARG 371 N -3.08 -1.64 -3.68 4.72 5.12 0.30 -4.93 116.66 113.47 2b3b n ARG 371 Ca -0.02 0.22 -0.38 0.00 -1.93 0.00 0.00 57.85 55.74 2b3b n ARG 371 Cb 0.76 -4.72 -0.10 0.00 -1.16 0.00 0.00 32.46 27.23 2b3b n ARG 371 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 2b3b s ASN 372 N -3.42 5.45 0.29 0.55 3.84 -1.26 -4.98 114.94 115.41 2b3b s ASN 372 Ca 0.69 -1.95 0.01 0.00 0.21 0.00 0.00 52.86 51.82 2b3b s ASN 372 Cb -0.39 -1.91 0.53 0.00 -0.55 0.00 0.00 41.25 38.92 2b3b s ASN 372 CO 0.99 -0.60 1.88 -0.65 -2.79 0.00 0.00 177.10 175.93 2b3b h PRO 373 N 8.23 1.01 -0.34 0.43 0.11 -1.91 -2.30 132.00 137.22 2b3b h PRO 373 Ca -0.17 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 65.73 2b3b h PRO 373 Cb 1.06 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.93 2b3b h PRO 373 CO 0.76 0.67 -0.38 0.37 -0.21 0.00 0.00 178.00 179.21 2b3b h GLN 374 N 1.04 0.80 -0.72 1.05 5.75 -1.93 -2.17 115.11 118.92 2b3b h GLN 374 Ca 0.43 -0.41 -0.06 0.00 -0.15 0.00 0.00 58.65 58.46 2b3b h GLN 374 Cb 0.29 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.82 2b3b h GLN 374 CO -0.18 1.04 0.21 0.00 -2.65 0.00 0.00 178.83 177.24 2b3b h ALA 375 N 0.91 0.94 0.14 3.38 0.00 -1.93 -0.99 119.26 121.71 2b3b h ALA 375 Ca 0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2b3b h ALA 375 Cb 0.93 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2b3b h ALA 375 CO 0.09 0.64 -0.07 0.00 0.00 0.00 0.00 179.25 179.91 2b3b h ALA 376 N 1.10 -0.19 -0.57 0.00 0.00 -1.27 0.10 119.26 118.44 2b3b h ALA 376 Ca 0.23 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.10 2b3b h ALA 376 Cb 0.33 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 2b3b h ALA 376 CO -0.00 -0.51 0.23 0.00 0.00 0.00 0.00 179.25 178.97 2b3b h ALA 377 N 0.45 0.73 -0.34 0.00 0.00 -1.38 0.45 119.26 119.18 2b3b h ALA 377 Ca -0.02 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2b3b h ALA 377 Cb 0.30 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2b3b h ALA 377 CO 0.03 -0.16 -0.07 -0.91 0.00 0.00 0.00 179.25 178.14 2b3b h ASN 378 N 0.43 0.53 -0.25 0.00 2.35 -1.00 -0.99 115.58 116.64 2b3b h ASN 378 Ca 0.28 -0.12 -0.07 0.00 -0.55 0.00 0.00 56.30 55.84 2b3b h ASN 378 Cb 0.30 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 2b3b h ASN 378 CO -0.26 0.64 -0.11 0.00 -1.65 0.00 0.00 177.43 176.06 2b3b h ALA 379 N 1.42 0.36 -0.74 -0.83 0.00 0.11 -1.04 119.26 118.53 2b3b h ALA 379 Ca 0.10 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2b3b h ALA 379 Cb 0.43 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 2b3b h ALA 379 CO 0.02 0.21 0.42 0.00 0.00 0.00 0.00 179.25 179.90 2b3b h ALA 380 N 0.74 0.95 -0.83 0.00 0.00 -0.73 -1.85 119.26 117.54 2b3b h ALA 380 Ca 0.06 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2b3b h ALA 380 Cb 0.61 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 2b3b h ALA 380 CO 0.03 0.45 0.44 0.37 0.00 0.00 0.00 179.25 180.54 2b3b h GLN 381 N 1.02 1.17 -0.33 0.00 5.75 -1.11 -1.29 115.11 120.32 2b3b h GLN 381 Ca 0.26 -0.15 0.02 0.00 -0.15 0.00 0.00 58.65 58.63 2b3b h GLN 381 Cb 0.01 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.32 2b3b h GLN 381 CO -0.04 0.87 0.19 0.00 -2.65 0.00 0.00 178.83 177.19 2b3b h ALA 382 N 1.23 0.41 -0.36 3.38 0.00 -0.76 -1.08 119.26 122.08 2b3b h ALA 382 Ca 0.29 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2b3b h ALA 382 Cb 0.06 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2b3b h ALA 382 CO -0.04 -0.17 0.20 0.82 0.00 0.00 0.00 179.25 180.06 2b3b h ILE 383 N 0.39 1.14 -0.34 0.00 1.08 -1.22 0.02 117.51 118.58 2b3b h ILE 383 Ca 0.13 -0.34 0.07 0.00 -0.39 0.00 0.00 64.86 64.32 2b3b h ILE 383 Cb 0.01 0.71 -0.06 0.00 -3.07 0.00 0.00 36.82 34.41 2b3b h ILE 383 CO -0.07 0.14 -0.05 0.00 -0.69 0.00 0.00 178.15 177.48 2b3b h ALA 384 N 1.07 0.26 -0.67 1.87 0.00 -1.04 -1.11 119.26 119.64 2b3b h ALA 384 Ca 0.13 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.16 2b3b h ALA 384 Cb 0.04 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2b3b h ALA 384 CO -0.02 -0.44 0.44 -0.44 0.00 0.00 0.00 179.25 178.79 2b3b h ASP 385 N 0.04 0.77 -0.58 0.00 3.32 -0.91 0.12 116.42 119.18 2b3b h ASP 385 Ca 0.16 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.15 2b3b h ASP 385 Cb 0.24 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 2b3b h ASP 385 CO -0.32 0.56 0.19 1.56 -1.72 0.00 0.00 179.24 179.51 2b3b h GLN 386 N 0.91 0.90 -0.00 3.56 4.20 -0.61 -3.04 115.11 121.02 2b3b h GLN 386 Ca 0.24 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2b3b h GLN 386 Cb -0.10 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.55 2b3b h GLN 386 CO -0.05 0.80 -0.22 1.33 -0.67 0.00 0.00 178.83 180.02 2b3b n VAL 387 N -4.43 0.00 -3.20 -0.54 0.24 -0.45 -4.94 118.33 105.00 2b3b n VAL 387 Ca 0.03 -0.01 -0.15 0.00 -2.04 0.00 0.00 64.34 62.16 2b3b n VAL 387 Cb 0.20 -0.11 0.06 0.00 -1.47 0.00 0.00 33.84 32.52 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 1.46 -0.18 3.64 7.63 0.00 -0.17 -4.91 105.19 112.66 2b3b n GLY 388 Ca 0.08 -0.01 -0.50 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.63 2.44 0.00 0.99 7.94 0.26 -1.02 117.00 123.98 2b3b n LEU 389 Ca -0.12 1.09 0.00 0.00 -1.11 0.00 0.00 56.01 55.87 2b3b n LEU 389 Cb 0.59 -1.29 0.00 0.00 0.53 0.00 0.00 43.42 43.25 2b3b n LEU 389 CO 0.48 -0.60 0.00 0.61 -1.11 0.00 0.00 177.39 176.77 2b3b n GLY 390 N 3.23 2.91 0.25 -3.96 0.00 -1.26 -4.60 105.19 101.77 2b3b n GLY 390 Ca 0.19 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.32 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 1.47 0.00 -0.01 1.61 0.11 -1.43 -3.49 114.38 112.65 2b3b h ARG 391 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2b3b h ARG 391 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2b3b h ARG 391 CO 0.00 0.12 0.00 1.28 0.10 0.00 0.00 179.97 181.47