#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2afa s LYS 4 N 0.00 2.61 -0.06 1.96 -0.14 -1.26 -4.87 119.74 117.98 2afa s LYS 4 Ca 0.00 -1.62 -0.03 0.00 -1.36 0.00 0.00 55.97 52.95 2afa s LYS 4 Cb 0.00 -3.94 -0.03 0.00 -1.68 0.00 0.00 37.83 32.19 2afa s LYS 4 CO 0.00 -1.12 -0.08 0.91 -0.76 0.00 0.00 175.35 174.30 2afa n TRP 5 N 4.97 0.00 -1.56 3.18 7.02 -1.26 -4.90 117.44 124.89 2afa n TRP 5 Ca -0.10 0.00 -0.47 0.00 -1.02 0.00 0.00 57.50 55.91 2afa n TRP 5 Cb 0.42 -0.22 -0.03 0.00 -2.42 0.00 0.00 31.31 29.06 2afa n TRP 5 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 2afa n PHE 6 N -3.29 1.05 -2.37 -5.99 3.72 -1.26 -1.70 117.46 107.62 2afa n PHE 6 Ca -0.12 0.73 -0.20 0.00 -0.05 0.00 0.00 57.45 57.82 2afa n PHE 6 Cb 0.58 -2.22 -0.01 0.00 -0.94 0.00 0.00 39.48 36.88 2afa n PHE 6 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2afa n ASN 7 N 1.64 -5.64 -4.39 4.37 5.03 -1.26 -4.99 115.26 110.03 2afa n ASN 7 Ca 0.13 0.03 -0.33 0.00 0.87 0.00 0.00 54.58 55.29 2afa n ASN 7 Cb 0.28 -4.71 -0.14 0.00 -1.02 0.00 0.00 39.78 34.18 2afa n ASN 7 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2afa s THR 8 N -2.97 2.89 0.33 3.41 -4.23 -0.69 -4.28 115.64 110.10 2afa s THR 8 Ca 0.00 -0.75 0.00 0.00 -1.18 0.00 0.00 61.69 59.77 2afa s THR 8 Cb 0.00 -2.16 0.26 0.00 1.34 0.00 0.00 72.50 71.94 2afa s THR 8 CO 0.00 0.55 1.99 -0.07 -0.54 0.00 0.00 174.62 176.56 2afa h LEU 9 N 6.18 0.82 -0.27 4.79 3.38 -1.94 -1.33 115.31 126.95 2afa h LEU 9 Ca -0.33 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.63 2afa h LEU 9 Cb 1.19 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 2afa h LEU 9 CO 0.52 0.59 0.15 0.77 0.09 0.00 0.00 178.44 180.57 2afa h SER 10 N 0.97 0.25 -0.15 -0.43 4.64 -1.95 0.12 113.55 117.00 2afa h SER 10 Ca 0.26 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.56 2afa h SER 10 Cb -0.11 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 61.92 2afa h SER 10 CO -0.06 0.19 0.02 -0.74 -0.87 0.00 0.00 176.83 175.37 2afa h HIS 11 N 0.32 0.26 -0.18 4.77 -0.00 -1.74 -2.77 115.15 115.81 2afa h HIS 11 Ca 0.10 -0.04 0.01 0.00 -0.00 0.00 0.00 60.37 60.44 2afa h HIS 11 Cb -0.01 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.32 2afa h HIS 11 CO -0.08 0.42 0.12 -0.91 -0.00 0.00 0.00 177.93 177.48 2afa h ASN 12 N 0.03 0.19 -0.39 3.26 4.21 -1.00 0.32 115.58 122.19 2afa h ASN 12 Ca 0.05 -0.00 -0.11 0.00 1.21 0.00 0.00 56.30 57.44 2afa h ASN 12 Cb 0.30 -0.05 -0.02 0.00 -1.12 0.00 0.00 38.32 37.44 2afa h ASN 12 CO 0.00 0.13 -0.17 0.03 -1.29 0.00 0.00 177.43 176.14 2afa h ARG 13 N 0.22 0.87 -0.24 0.81 3.08 -0.61 -0.06 114.38 118.46 2afa h ARG 13 Ca 0.07 -0.33 -0.01 0.00 0.07 0.00 0.00 59.98 59.78 2afa h ARG 13 Cb 0.00 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 2afa h ARG 13 CO -0.01 0.97 0.13 2.35 -1.07 0.00 0.00 179.97 182.34 2afa h TRP 14 N 0.77 0.33 -0.75 3.04 7.01 -0.72 -1.92 115.95 123.71 2afa h TRP 14 Ca 0.11 -0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.15 2afa h TRP 14 Cb 0.70 -0.10 -0.05 0.00 -2.10 0.00 0.00 29.16 27.60 2afa h TRP 14 CO 0.04 0.30 0.46 -0.07 -2.79 0.00 0.00 178.44 176.38 2afa h LEU 15 N 0.27 0.74 -0.71 0.65 3.38 -0.86 -2.43 115.31 116.34 2afa h LEU 15 Ca 0.08 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2afa h LEU 15 Cb 0.08 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2afa h LEU 15 CO -0.01 0.50 0.24 -0.08 0.09 0.00 0.00 178.44 179.18 2afa h GLU 16 N 0.88 1.09 -0.53 1.13 4.81 -0.57 -1.03 114.58 120.36 2afa h GLU 16 Ca 0.31 -0.22 -0.05 0.00 -0.13 0.00 0.00 59.36 59.27 2afa h GLU 16 Cb 0.08 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 2afa h GLU 16 CO -0.14 0.93 0.12 1.96 -0.73 0.00 0.00 179.01 181.15 2afa h GLN 17 N 1.04 0.82 -0.02 1.92 4.20 -0.98 -1.54 115.11 120.55 2afa h GLN 17 Ca 0.23 -0.17 -0.16 0.00 0.06 0.00 0.00 58.65 58.62 2afa h GLN 17 Cb 0.27 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 2afa h GLN 17 CO -0.01 0.75 -0.70 1.49 -0.67 0.00 0.00 178.83 179.68 2afa h GLU 18 N 0.79 0.12 -0.53 1.46 4.57 -1.20 -2.65 114.58 117.14 2afa h GLU 18 Ca 0.17 -0.10 0.01 0.00 -1.18 0.00 0.00 59.36 58.26 2afa h GLU 18 Cb 0.30 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.89 2afa h GLU 18 CO 0.00 0.77 0.35 1.15 -1.18 0.00 0.00 179.01 180.10 2afa h THR 19 N 0.08 1.13 -0.66 0.32 2.02 -0.35 -1.15 112.91 114.30 2afa h THR 19 Ca -0.01 -0.24 -0.06 0.00 0.77 0.00 0.00 66.41 66.86 2afa h THR 19 Cb 1.24 0.35 -0.03 0.00 -1.74 0.00 0.00 68.15 67.98 2afa h THR 19 CO 0.10 0.13 0.16 0.44 0.37 0.00 0.00 175.52 176.72 2afa h ASP 20 N 0.71 0.98 -1.00 4.18 3.32 -1.20 0.32 116.42 123.73 2afa h ASP 20 Ca 0.20 -0.20 0.03 0.00 0.02 0.00 0.00 57.03 57.07 2afa h ASP 20 Cb -0.07 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 39.16 2afa h ASP 20 CO -0.05 0.95 0.66 -0.09 -1.72 0.00 0.00 179.24 178.99 2afa h ARG 21 N 0.99 1.26 0.06 3.56 2.43 -1.03 0.49 114.38 122.15 2afa h ARG 21 Ca 0.21 -0.08 -0.28 0.00 -0.81 0.00 0.00 59.98 59.03 2afa h ARG 21 Cb 0.35 -0.28 0.02 0.00 -0.42 0.00 0.00 29.97 29.64 2afa h ARG 21 CO 0.00 0.83 -1.13 0.82 -1.51 0.00 0.00 179.97 178.98 2afa h ILE 22 N 1.30 1.32 -0.76 1.20 2.04 -0.65 -1.85 117.51 120.10 2afa h ILE 22 Ca 0.39 -2.44 0.03 0.00 1.00 0.00 0.00 64.86 63.84 2afa h ILE 22 Cb -0.05 2.57 -0.05 0.00 -0.74 0.00 0.00 36.82 38.55 2afa h ILE 22 CO -0.11 0.74 0.48 -0.26 0.00 0.00 0.00 178.15 179.00 2afa h PHE 23 N 0.29 0.91 -0.43 1.37 0.04 -0.05 -1.81 116.94 117.26 2afa h PHE 23 Ca -0.15 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.64 2afa h PHE 23 Cb 1.80 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 39.63 2afa h PHE 23 CO 0.10 0.52 0.23 -0.91 -0.60 0.00 0.00 178.31 177.65 2afa h ASN 24 N 0.94 0.55 -0.31 2.17 2.35 -0.84 -2.77 115.58 117.67 2afa h ASN 24 Ca 0.31 -0.10 0.05 0.00 -0.55 0.00 0.00 56.30 56.01 2afa h ASN 24 Cb 0.02 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 38.20 2afa h ASN 24 CO -0.11 0.49 0.02 0.15 -1.65 0.00 0.00 177.43 176.32 2afa h PHE 25 N 0.56 0.01 0.00 1.19 3.57 -0.73 -2.78 116.94 118.77 2afa h PHE 25 Ca 0.15 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 2afa h PHE 25 Cb 0.06 0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.84 2afa h PHE 25 CO -0.02 -0.03 -0.11 0.78 -2.23 0.00 0.00 178.31 176.70 2afa h GLY 26 N 0.11 0.00 1.75 2.40 0.00 -1.13 -3.13 103.07 103.07 2afa h GLY 26 Ca 0.15 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.49 2afa h GLY 26 CO -0.23 0.00 0.11 0.07 0.00 0.00 0.00 176.54 176.49 2afa h LYS 27 N 0.00 0.00 0.00 4.80 2.10 -1.22 -1.61 116.57 120.64 2afa h LYS 27 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2afa h LYS 27 Cb 0.30 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.63 2afa h LYS 27 CO 0.01 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.55 2afa n ASN 28 N -3.46 0.00 0.05 7.07 4.13 -1.18 -3.13 115.26 118.74 2afa n ASN 28 Ca -0.01 0.17 0.13 0.00 1.68 0.00 0.00 54.58 56.55 2afa n ASN 28 Cb 0.20 -0.37 0.50 0.00 -1.54 0.00 0.00 39.78 38.57 2afa n ASN 28 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2afa n ALA 29 N -1.37 2.23 -1.63 5.41 0.00 -0.60 -4.73 120.51 119.82 2afa n ALA 29 Ca 0.08 -0.05 -0.52 0.00 0.00 0.00 0.00 53.44 52.95 2afa n ALA 29 Cb 0.20 -1.45 -0.06 0.00 0.00 0.00 0.00 19.45 18.14 2afa n ALA 29 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2afa n VAL 30 N -1.87 0.38 -4.25 0.00 0.31 -1.18 0.91 118.33 112.63 2afa n VAL 30 Ca 0.06 -0.14 -0.16 0.00 -0.01 0.00 0.00 64.34 64.09 2afa n VAL 30 Cb 0.36 -1.62 -0.10 0.00 -0.91 0.00 0.00 33.84 31.57 2afa n VAL 30 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2afa s VAL 31 N 4.90 1.24 0.33 2.52 -7.23 0.32 -4.84 120.40 117.64 2afa s VAL 31 Ca 0.99 -1.91 0.12 0.00 -1.81 0.00 0.00 61.98 59.38 2afa s VAL 31 Cb -0.86 -1.70 0.32 0.00 0.56 0.00 0.00 36.38 34.71 2afa s VAL 31 CO 0.55 -0.60 1.68 -0.65 -0.31 0.00 0.00 175.10 175.77 2afa h PRO 32 N 3.10 0.38 -0.06 4.82 0.11 -2.01 -0.34 132.00 138.00 2afa h PRO 32 Ca -0.38 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2afa h PRO 32 Cb 1.19 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2afa h PRO 32 CO 0.58 0.25 0.00 0.25 -0.21 0.00 0.00 178.00 178.87 2afa n THR 33 N -5.01 0.07 0.00 -1.15 -2.24 -1.26 -4.92 114.28 99.76 2afa n THR 33 Ca 0.29 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2afa n THR 33 Cb 0.88 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.67 2afa n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2afa n GLY 34 N 1.19 0.20 3.16 3.38 0.00 -0.14 -4.66 105.19 108.31 2afa n GLY 34 Ca 0.18 -0.48 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 2afa n GLY 34 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2afa s PHE 35 N 0.00 2.61 0.19 1.61 0.08 -1.26 -0.52 117.98 120.68 2afa s PHE 35 Ca 0.00 -1.32 -0.03 0.00 0.12 0.00 0.00 56.93 55.70 2afa s PHE 35 Cb 0.00 -1.78 0.05 0.00 -0.57 0.00 0.00 43.02 40.71 2afa s PHE 35 CO 0.00 -0.61 0.21 0.41 -0.10 0.00 0.00 175.22 175.13 2afa n GLY 36 N 4.10 -1.80 3.34 4.36 0.00 0.26 -4.25 105.19 111.21 2afa n GLY 36 Ca -0.20 -1.58 -0.40 0.00 0.00 0.00 0.00 46.02 43.85 2afa n GLY 36 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2afa s TRP 37 N -1.43 3.26 0.21 1.61 -0.11 -1.26 -4.89 118.94 116.32 2afa s TRP 37 Ca 0.13 -1.13 -0.29 0.00 1.22 0.00 0.00 56.10 56.04 2afa s TRP 37 Cb -0.01 -2.48 -0.08 0.00 -1.50 0.00 0.00 33.47 29.39 2afa s TRP 37 CO 0.09 -0.69 0.89 -0.51 -4.62 0.00 0.00 176.95 172.11 2afa s LEU 38 N 1.51 4.62 0.00 5.86 1.43 -1.26 0.35 118.68 131.18 2afa s LEU 38 Ca 0.01 1.84 0.00 0.00 -1.03 0.00 0.00 54.13 54.95 2afa s LEU 38 Cb -0.20 -3.51 0.00 0.00 0.03 0.00 0.00 46.19 42.51 2afa s LEU 38 CO 0.05 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.40 2afa n GLY 39 N 1.59 0.54 0.04 -3.19 0.00 0.29 -1.54 105.19 102.91 2afa n GLY 39 Ca -0.03 -1.90 0.07 0.00 0.00 0.00 0.00 46.02 44.16 2afa n GLY 39 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2afa n ASN 40 N -2.35 0.17 -0.07 1.61 5.03 -1.26 -2.38 115.26 116.00 2afa n ASN 40 Ca 0.00 0.55 0.05 0.00 0.87 0.00 0.00 54.58 56.05 2afa n ASN 40 Cb 0.00 -0.58 0.07 0.00 -1.02 0.00 0.00 39.78 38.25 2afa n ASN 40 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2afa n LYS 41 N -1.70 1.77 -0.86 3.52 5.02 -1.26 -4.71 118.16 119.94 2afa n LYS 41 Ca 0.02 -1.99 0.00 0.00 -2.02 0.00 0.00 58.31 54.33 2afa n LYS 41 Cb 0.14 -1.21 0.00 0.00 -0.02 0.00 0.00 35.03 33.94 2afa n LYS 41 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2afa n GLY 42 N -0.94 0.60 3.91 0.72 0.00 -1.00 -4.96 105.19 103.52 2afa n GLY 42 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 2afa n GLY 42 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2afa s GLN 43 N -0.14 3.54 0.19 1.61 -0.44 -1.26 -4.73 119.66 118.43 2afa s GLN 43 Ca 0.00 -0.26 -0.30 0.00 -2.50 0.00 0.00 55.36 52.30 2afa s GLN 43 Cb 0.00 -2.93 -0.08 0.00 -1.64 0.00 0.00 33.01 28.36 2afa s GLN 43 CO 0.00 0.52 1.08 0.42 0.50 0.00 0.00 175.29 177.81 2afa s ILE 44 N -1.61 3.86 -0.75 -2.34 1.01 -1.26 0.10 121.20 120.21 2afa s ILE 44 Ca 0.38 1.66 -0.15 0.00 0.00 0.00 0.00 60.65 62.54 2afa s ILE 44 Cb -0.12 -4.06 0.19 0.00 0.01 0.00 0.00 42.46 38.47 2afa s ILE 44 CO 0.26 0.31 0.72 -0.54 0.00 0.00 0.00 174.94 175.70 2afa s LYS 45 N -0.56 3.42 0.27 2.79 1.02 0.15 -4.88 119.74 121.96 2afa s LYS 45 Ca 0.48 -2.17 -0.00 0.00 0.02 0.00 0.00 55.97 54.30 2afa s LYS 45 Cb -0.29 -4.42 0.55 0.00 -0.52 0.00 0.00 37.83 33.15 2afa s LYS 45 CO 0.35 -1.35 1.75 0.93 -0.92 0.00 0.00 175.35 176.12 2afa h GLU 46 N 8.20 0.58 -1.82 1.68 5.08 -1.94 -3.31 114.58 123.04 2afa h GLU 46 Ca -0.01 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2afa h GLU 46 Cb 1.06 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2afa h GLU 46 CO 0.87 0.38 0.00 0.39 -1.00 0.00 0.00 179.01 179.65 2afa n GLU 47 N -4.89 0.00 -3.35 2.33 4.71 -1.26 -4.86 120.64 113.32 2afa n GLU 47 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.33 2afa n GLU 47 Cb 0.46 -1.14 0.00 0.00 -1.01 0.00 0.00 31.44 29.75 2afa n GLU 47 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2afa n GLY 49 N 1.24 -1.00 3.44 0.62 0.00 -1.25 -5.18 105.19 103.06 2afa n GLY 49 Ca 0.00 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.72 2afa n GLY 49 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2afa s THR 50 N -3.00 4.96 0.12 2.61 2.01 -0.11 -4.07 115.64 118.16 2afa s THR 50 Ca 0.00 -0.64 -0.14 0.00 0.31 0.00 0.00 61.69 61.22 2afa s THR 50 Cb 0.00 -3.71 -0.07 0.00 0.01 0.00 0.00 72.50 68.73 2afa s THR 50 CO 0.00 -0.20 0.52 -1.00 -0.69 0.00 0.00 174.62 173.24 2afa s HIS 51 N 1.64 3.63 0.16 4.92 3.76 -1.26 -1.14 115.29 126.99 2afa s HIS 51 Ca 0.04 1.03 -0.13 0.00 -0.15 0.00 0.00 55.06 55.85 2afa s HIS 51 Cb -0.19 -2.34 0.05 0.00 1.11 0.00 0.00 32.58 31.21 2afa s HIS 51 CO 0.09 0.47 1.70 1.25 -0.85 0.00 0.00 174.74 177.40 2afa h LEU 52 N 3.75 0.75 -1.16 0.89 5.85 -0.96 -1.89 115.31 122.54 2afa h LEU 52 Ca -0.49 -0.18 -0.08 0.00 0.84 0.00 0.00 57.88 57.97 2afa h LEU 52 Cb 1.20 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 2afa h LEU 52 CO 0.65 0.73 -0.27 4.11 -0.34 0.00 0.00 178.44 183.33 2afa h TRP 53 N 0.72 0.28 -0.05 1.25 5.08 -1.83 -0.79 115.95 120.60 2afa h TRP 53 Ca 0.17 -0.05 -0.19 0.00 1.08 0.00 0.00 58.89 59.90 2afa h TRP 53 Cb 0.23 -0.07 0.01 0.00 -3.00 0.00 0.00 29.16 26.33 2afa h TRP 53 CO 0.01 0.50 -0.71 0.82 -1.28 0.00 0.00 178.44 177.78 2afa h ILE 54 N 0.23 1.35 -0.64 0.12 2.04 -1.87 -2.26 117.51 116.48 2afa h ILE 54 Ca 0.04 -2.04 -0.03 0.00 1.00 0.00 0.00 64.86 63.83 2afa h ILE 54 Cb 0.60 2.35 -0.03 0.00 -0.74 0.00 0.00 36.82 39.00 2afa h ILE 54 CO 0.04 0.62 0.30 0.74 0.00 0.00 0.00 178.15 179.85 2afa h THR 55 N 0.17 1.22 -0.29 -0.27 2.02 -1.17 -2.75 112.91 111.85 2afa h THR 55 Ca -0.07 -0.64 -0.10 0.00 0.77 0.00 0.00 66.41 66.37 2afa h THR 55 Cb 1.38 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 68.23 2afa h THR 55 CO 0.14 0.26 -0.24 0.00 0.37 0.00 0.00 175.52 176.06 2afa h ALA 56 N 1.13 1.06 0.00 6.16 0.00 -1.19 -1.76 119.26 124.66 2afa h ALA 56 Ca 0.22 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2afa h ALA 56 Cb 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2afa h ALA 56 CO -0.03 0.57 0.00 0.54 0.00 0.00 0.00 179.25 180.34 2afa n ARG 57 N -4.12 0.51 0.00 0.00 1.74 -0.85 -2.39 116.66 111.55 2afa n ARG 57 Ca -0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2afa n ARG 57 Cb 0.41 -1.25 0.00 0.00 -1.02 0.00 0.00 32.46 30.60 2afa n ARG 57 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2afa n LEU 59 N 0.61 0.00 -0.02 0.55 7.94 -0.66 -0.41 117.00 125.00 2afa n LEU 59 Ca 0.00 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.80 2afa n LEU 59 Cb 0.22 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.14 2afa n LEU 59 CO 0.00 0.00 0.88 -0.74 -1.11 0.00 0.00 177.39 176.42 2afa h HIS 60 N 0.00 0.05 -0.11 1.96 2.76 -1.67 -1.98 115.15 116.16 2afa h HIS 60 Ca 0.00 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.20 2afa h HIS 60 Cb 0.00 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 28.94 2afa h HIS 60 CO 0.00 0.02 -0.01 0.28 -1.30 0.00 0.00 177.93 176.92 2afa h VAL 61 N 0.09 0.92 0.00 5.26 2.07 -1.02 -2.59 116.25 120.98 2afa h VAL 61 Ca 0.07 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.58 2afa h VAL 61 Cb 0.06 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2afa h VAL 61 CO -0.09 0.01 0.00 1.88 0.02 0.00 0.00 177.57 179.39 2afa h TYR 62 N 0.03 0.00 -0.41 1.57 0.05 -1.81 -2.01 116.97 114.39 2afa h TYR 62 Ca 0.05 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.75 2afa h TYR 62 Cb 0.06 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 2afa h TYR 62 CO -0.14 0.00 -0.05 0.77 -1.05 0.00 0.00 178.16 177.70 2afa h SER 63 N 0.00 0.74 -0.39 3.88 0.02 -0.98 0.30 113.55 117.13 2afa h SER 63 Ca 0.00 -0.34 -0.03 0.00 -0.84 0.00 0.00 61.79 60.58 2afa h SER 63 Cb 0.59 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.91 2afa h SER 63 CO 0.00 0.90 0.11 0.58 -1.14 0.00 0.00 176.83 177.29 2afa h VAL 64 N 0.57 1.22 -0.78 2.27 2.07 -1.18 -2.14 116.25 118.28 2afa h VAL 64 Ca 0.11 -0.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.88 2afa h VAL 64 Cb 0.55 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.24 2afa h VAL 64 CO 0.03 0.25 0.36 0.00 0.02 0.00 0.00 177.57 178.23 2afa h ALA 65 N 0.96 1.16 -0.19 1.67 0.00 -1.15 -2.81 119.26 118.90 2afa h ALA 65 Ca 0.12 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2afa h ALA 65 Cb 0.27 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2afa h ALA 65 CO -0.00 0.63 0.09 0.00 0.00 0.00 0.00 179.25 179.96 2afa h ALA 66 N 1.28 0.22 0.00 0.00 0.00 -0.10 -2.75 119.26 117.92 2afa h ALA 66 Ca 0.27 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 2afa h ALA 66 Cb 0.14 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2afa h ALA 66 CO -0.03 -0.33 0.18 0.43 0.00 0.00 0.00 179.25 179.50 2afa n SER 67 N -5.01 1.60 -1.14 0.00 7.64 -0.83 -4.08 113.62 111.80 2afa n SER 67 Ca -0.03 -1.72 -0.02 0.00 1.01 0.00 0.00 58.87 58.11 2afa n SER 67 Cb 0.06 -0.41 -0.03 0.00 -1.01 0.00 0.00 64.21 62.82 2afa n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2afa n GLY 69 N 2.65 0.73 3.58 0.23 0.00 -1.06 -4.80 105.19 106.52 2afa n GLY 69 Ca 0.10 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 2afa n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2afa s ARG 70 N 0.00 3.76 0.41 1.61 3.00 -1.07 -5.04 118.95 121.63 2afa s ARG 70 Ca 0.14 0.08 -0.25 0.00 0.00 0.00 0.00 55.73 55.70 2afa s ARG 70 Cb 0.16 -3.77 -0.11 0.00 0.00 0.00 0.00 34.95 31.23 2afa s ARG 70 CO -0.07 -0.62 1.11 -2.30 0.00 0.00 0.00 175.30 173.42 2afa n PRO 71 N 5.85 1.57 0.00 3.54 -0.02 -1.26 -1.92 135.00 142.76 2afa n PRO 71 Ca -0.03 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 2afa n PRO 71 Cb 0.49 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 2afa n PRO 71 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2afa n GLY 72 N 1.05 2.58 0.40 -1.23 0.00 -1.26 -4.88 105.19 101.85 2afa n GLY 72 Ca 0.08 -0.65 -0.11 0.00 0.00 0.00 0.00 46.02 45.34 2afa n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2afa h ALA 73 N 0.00 -0.53 -0.86 4.61 0.00 -1.72 -1.53 119.26 119.23 2afa h ALA 73 Ca 0.00 0.02 0.16 0.00 0.00 0.00 0.00 54.91 55.09 2afa h ALA 73 Cb 0.00 0.86 -0.07 0.00 0.00 0.00 0.00 17.79 18.58 2afa h ALA 73 CO 0.00 -0.91 0.56 -0.92 0.00 0.00 0.00 179.25 177.99 2afa h TYR 74 N -0.41 0.69 -0.46 0.00 3.20 -1.79 0.64 116.97 118.83 2afa h TYR 74 Ca 0.10 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.96 2afa h TYR 74 Cb 0.61 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 2afa h TYR 74 CO -0.56 0.24 0.17 0.22 -1.64 0.00 0.00 178.16 176.58 2afa h ASP 75 N 0.56 0.66 0.28 -2.11 3.58 -1.69 -0.22 116.42 117.48 2afa h ASP 75 Ca 0.44 -0.19 -0.06 0.00 0.42 0.00 0.00 57.03 57.64 2afa h ASP 75 Cb 0.86 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.73 2afa h ASP 75 CO -0.18 0.67 -0.29 -0.07 -2.88 0.00 0.00 179.24 176.48 2afa h LEU 76 N 0.61 0.02 -0.05 2.28 3.38 -0.21 0.36 115.31 121.70 2afa h LEU 76 Ca 0.15 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2afa h LEU 76 Cb 0.23 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 2afa h LEU 76 CO -0.01 0.32 0.00 0.58 0.09 0.00 0.00 178.44 179.42 2afa h VAL 77 N 0.02 1.24 -0.50 1.22 2.07 -0.47 0.67 116.25 120.50 2afa h VAL 77 Ca 0.00 -0.73 0.07 0.00 0.82 0.00 0.00 66.70 66.86 2afa h VAL 77 Cb 0.53 1.64 -0.06 0.00 -1.52 0.00 0.00 31.29 31.88 2afa h VAL 77 CO 0.04 0.20 0.17 -0.78 0.02 0.00 0.00 177.57 177.21 2afa h ASP 78 N -0.20 0.15 -0.94 0.57 3.58 -0.42 -0.36 116.42 118.80 2afa h ASP 78 Ca 0.01 0.06 0.03 0.00 0.42 0.00 0.00 57.03 57.56 2afa h ASP 78 Cb 0.32 0.05 -0.05 0.00 1.72 0.00 0.00 39.33 41.37 2afa h ASP 78 CO 0.00 0.11 0.62 -0.74 -2.88 0.00 0.00 179.24 176.36 2afa h HIS 79 N 0.34 1.16 -0.57 0.28 2.76 -0.73 -0.25 115.15 118.14 2afa h HIS 79 Ca 0.24 0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.35 2afa h HIS 79 Cb 0.27 -0.39 -0.02 0.00 1.55 0.00 0.00 27.41 28.82 2afa h HIS 79 CO -0.17 0.69 0.02 0.78 -1.30 0.00 0.00 177.93 177.94 2afa h GLY 80 N 1.21 1.05 1.35 5.26 0.00 0.70 -1.16 103.07 111.48 2afa h GLY 80 Ca 0.36 -0.73 -0.15 0.00 0.00 0.00 0.00 47.33 46.81 2afa h GLY 80 CO -0.10 0.68 -0.44 -2.22 0.00 0.00 0.00 176.54 174.45 2afa h ILE 81 N 0.90 1.29 -0.57 2.60 2.04 -0.50 -2.88 117.51 120.39 2afa h ILE 81 Ca 0.17 -1.63 -0.02 0.00 1.00 0.00 0.00 64.86 64.38 2afa h ILE 81 Cb 0.50 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 38.11 2afa h ILE 81 CO 0.02 0.52 0.28 0.11 0.00 0.00 0.00 178.15 179.09 2afa h LYS 82 N 0.56 0.82 -1.91 2.37 6.56 -0.84 -2.34 116.57 121.79 2afa h LYS 82 Ca 0.04 -0.12 0.00 0.00 -1.06 0.00 0.00 60.65 59.51 2afa h LYS 82 Cb 0.99 -0.15 0.00 0.00 -0.57 0.00 0.00 32.23 32.50 2afa h LYS 82 CO 0.09 0.66 0.00 0.00 -2.06 0.00 0.00 179.45 178.14 2afa n ALA 83 N -2.33 1.67 0.00 3.86 0.00 -0.46 -0.92 120.51 122.34 2afa n ALA 83 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2afa n ALA 83 Cb 0.12 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.33 2afa n ALA 83 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2afa n ASN 85 N 1.20 0.00 0.00 0.00 5.03 -0.88 -3.83 115.26 116.78 2afa n ASN 85 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 2afa n ASN 85 Cb 0.06 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.82 2afa n ASN 85 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2afa n GLY 86 N 0.00 1.10 0.35 7.41 0.00 -0.10 -4.77 105.19 109.18 2afa n GLY 86 Ca 0.00 -0.25 0.14 0.00 0.00 0.00 0.00 46.02 45.91 2afa n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2afa n ALA 87 N -3.00 0.47 0.28 4.61 0.00 -1.26 -0.07 120.51 121.54 2afa n ALA 87 Ca 0.00 1.07 0.13 0.00 0.00 0.00 0.00 53.44 54.64 2afa n ALA 87 Cb 0.00 -0.76 0.81 0.00 0.00 0.00 0.00 19.45 19.50 2afa n ALA 87 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2afa h LEU 88 N 0.00 0.00 -9.70 0.00 3.38 -1.83 -3.44 115.31 103.73 2afa h LEU 88 Ca 0.58 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 58.04 2afa h LEU 88 Cb 1.17 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.89 2afa h LEU 88 CO -0.95 0.05 0.25 -0.60 0.09 0.00 0.00 178.44 177.29 2afa s ARG 89 N -4.52 4.67 -0.80 1.13 3.52 0.90 0.05 118.95 123.91 2afa s ARG 89 Ca -0.04 1.29 -0.20 0.00 -0.13 0.00 0.00 55.73 56.64 2afa s ARG 89 Cb 0.15 -3.29 0.10 0.00 -1.56 0.00 0.00 34.95 30.35 2afa s ARG 89 CO 0.58 0.48 1.04 0.34 -0.81 0.00 0.00 175.30 176.93 2afa s ASP 90 N -0.91 6.40 0.00 -2.12 -1.08 -0.00 -4.84 116.67 114.12 2afa s ASP 90 Ca 0.39 -1.55 0.00 0.00 -0.52 0.00 0.00 52.55 50.87 2afa s ASP 90 Cb -0.24 -2.40 0.00 0.00 -1.46 0.00 0.00 42.92 38.82 2afa s ASP 90 CO 0.28 -1.24 0.52 0.29 0.52 0.00 0.00 175.17 175.54 2afa n LYS 91 N 7.07 0.81 0.03 4.34 4.01 -1.26 -1.93 118.16 131.23 2afa n LYS 91 Ca 0.10 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.90 2afa n LYS 91 Cb 0.47 -1.32 0.00 0.00 -0.51 0.00 0.00 35.03 33.67 2afa n LYS 91 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 2afa n LYS 92 N 0.23 0.00 -0.00 1.97 4.81 -1.26 -4.89 118.16 119.02 2afa n LYS 92 Ca 0.00 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.53 2afa n LYS 92 Cb 0.26 -0.31 -0.12 0.00 0.02 0.00 0.00 35.03 34.88 2afa n LYS 92 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2afa n TYR 93 N -3.05 0.00 0.00 5.64 4.01 -1.24 -5.10 117.16 117.42 2afa n TYR 93 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2afa n TYR 93 Cb 0.20 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 2afa n TYR 93 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2afa n GLY 94 N 1.43 2.20 7.00 2.72 0.00 -0.81 -4.94 105.19 112.79 2afa n GLY 94 Ca 0.02 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.13 2afa n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2afa n GLY 95 N 2.00 -1.23 3.15 -0.02 0.00 -1.26 -4.55 105.19 103.27 2afa n GLY 95 Ca 0.00 -1.26 -0.20 0.00 0.00 0.00 0.00 46.02 44.56 2afa n GLY 95 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2afa s TRP 96 N 0.00 1.24 0.40 1.61 0.51 -1.26 -0.82 118.94 120.62 2afa s TRP 96 Ca 0.00 -0.37 -0.24 0.00 -2.12 0.00 0.00 56.10 53.37 2afa s TRP 96 Cb 0.00 -0.73 -0.09 0.00 -0.81 0.00 0.00 33.47 31.84 2afa s TRP 96 CO 0.00 0.04 1.10 0.71 -0.51 0.00 0.00 176.95 178.29 2afa s TYR 97 N -0.90 3.17 0.24 -1.98 2.02 0.11 -4.65 117.35 115.36 2afa s TYR 97 Ca 0.01 1.61 -0.07 0.00 -0.37 0.00 0.00 57.07 58.25 2afa s TYR 97 Cb -0.08 -3.24 0.25 0.00 -0.40 0.00 0.00 41.96 38.48 2afa s TYR 97 CO 0.01 -0.94 1.90 0.00 -1.57 0.00 0.00 175.55 174.96 2afa h ALA 98 N 2.51 1.18 -2.56 3.71 0.00 -0.03 -3.40 119.26 120.67 2afa h ALA 98 Ca -0.48 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.26 2afa h ALA 98 Cb 1.23 -0.35 -0.22 0.00 0.00 0.00 0.00 17.79 18.44 2afa h ALA 98 CO 0.62 0.52 -0.18 0.00 0.00 0.00 0.00 179.25 180.22 2afa s VAL 100 N -0.23 0.00 0.04 0.00 -7.23 -0.29 -0.50 120.40 112.19 2afa s VAL 100 Ca -0.04 -1.80 -0.01 0.00 -1.81 0.00 0.00 61.98 58.32 2afa s VAL 100 Cb -0.03 -2.54 0.00 0.00 0.56 0.00 0.00 36.38 34.37 2afa s VAL 100 CO 0.02 0.00 0.07 -0.46 -0.31 0.00 0.00 175.10 174.42 2afa n ASN 101 N -1.24 -0.20 0.23 4.85 0.23 0.04 -0.93 115.26 118.24 2afa n ASN 101 Ca 0.04 -1.22 0.07 0.00 -0.53 0.00 0.00 54.58 52.93 2afa n ASN 101 Cb 0.63 0.36 0.54 0.00 -2.08 0.00 0.00 39.78 39.23 2afa n ASN 101 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2afa h ASP 102 N 0.24 0.00 0.66 0.53 3.32 -2.01 -3.13 116.42 116.03 2afa h ASP 102 Ca -0.04 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.86 2afa h ASP 102 Cb 0.15 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.67 2afa h ASP 102 CO 0.05 0.18 -1.45 0.00 -1.72 0.00 0.00 179.24 176.29 2afa n GLN 103 N -4.19 0.62 -1.69 3.56 3.00 -1.26 -5.08 117.38 112.35 2afa n GLN 103 Ca -0.02 0.18 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 2afa n GLN 103 Cb 0.25 -1.78 0.00 0.00 0.00 0.00 0.00 30.24 28.71 2afa n GLN 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2afa n GLY 104 N 1.39 -0.59 3.81 1.08 0.00 -1.18 -5.13 105.19 104.56 2afa n GLY 104 Ca -0.10 -0.69 -0.37 0.00 0.00 0.00 0.00 46.02 44.87 2afa n GLY 104 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2afa s VAL 105 N -3.52 4.57 -0.14 1.61 1.01 -1.26 -0.78 120.40 121.89 2afa s VAL 105 Ca 0.00 1.29 0.01 0.00 0.00 0.00 0.00 61.98 63.28 2afa s VAL 105 Cb 0.00 -3.88 -0.09 0.00 0.00 0.00 0.00 36.38 32.41 2afa s VAL 105 CO 0.00 0.26 -0.13 0.52 0.00 0.00 0.00 175.10 175.75 2afa n VAL 106 N 0.86 0.79 -3.48 2.92 0.31 0.34 -4.87 118.33 115.21 2afa n VAL 106 Ca -0.03 -0.30 -0.24 0.00 -0.01 0.00 0.00 64.34 63.76 2afa n VAL 106 Cb 0.51 -1.03 -0.13 0.00 -0.91 0.00 0.00 33.84 32.28 2afa n VAL 106 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2afa s ASP 107 N -5.40 2.77 0.00 4.52 2.15 0.28 -4.93 116.67 116.05 2afa s ASP 107 Ca -0.19 -1.12 0.26 0.00 0.43 0.00 0.00 52.55 51.94 2afa s ASP 107 Cb 0.05 -0.01 1.44 0.00 -0.30 0.00 0.00 42.92 44.10 2afa s ASP 107 CO 0.32 -0.41 1.90 0.00 -0.17 0.00 0.00 175.17 176.80 2afa n ALA 108 N 5.22 2.39 -1.26 3.66 0.00 -1.26 -0.09 120.51 129.16 2afa n ALA 108 Ca -0.04 -0.14 -0.34 0.00 0.00 0.00 0.00 53.44 52.92 2afa n ALA 108 Cb 0.44 -1.42 0.11 0.00 0.00 0.00 0.00 19.45 18.57 2afa n ALA 108 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2afa s SER 109 N -2.30 3.94 -0.36 0.00 1.04 -1.26 -3.79 113.70 110.97 2afa s SER 109 Ca 0.32 2.37 -0.00 0.00 0.48 0.00 0.00 55.95 59.11 2afa s SER 109 Cb 0.18 -2.59 0.09 0.00 0.10 0.00 0.00 66.02 63.80 2afa s SER 109 CO 0.35 -2.43 0.11 -0.54 0.98 0.00 0.00 173.24 171.71 2afa s LYS 110 N -4.00 1.94 -0.08 4.02 -0.14 -0.67 -2.23 119.74 118.58 2afa s LYS 110 Ca 0.74 -1.72 -0.13 0.00 -1.36 0.00 0.00 55.97 53.51 2afa s LYS 110 Cb -0.29 -3.38 -0.05 0.00 -1.68 0.00 0.00 37.83 32.43 2afa s LYS 110 CO 0.48 -0.93 0.31 -0.65 -0.76 0.00 0.00 175.35 173.79 2afa s GLN 111 N 1.09 3.93 0.09 1.68 -0.21 -1.26 -1.07 119.66 123.91 2afa s GLN 111 Ca 0.06 0.18 -0.35 0.00 0.02 0.00 0.00 55.36 55.27 2afa s GLN 111 Cb -0.21 -3.29 -0.16 0.00 1.00 0.00 0.00 33.01 30.35 2afa s GLN 111 CO -0.05 0.55 1.55 0.78 -2.12 0.00 0.00 175.29 175.99 2afa h GLY 112 N 5.48 -1.23 0.80 3.09 0.00 0.04 -1.22 103.07 110.03 2afa h GLY 112 Ca -0.49 0.61 0.12 0.00 0.00 0.00 0.00 47.33 47.57 2afa h GLY 112 CO 0.66 -0.33 0.50 0.10 0.00 0.00 0.00 176.54 177.47 2afa h TYR 113 N -0.89 0.64 -0.16 5.60 -0.00 -1.81 0.18 116.97 120.53 2afa h TYR 113 Ca -0.04 0.02 -0.15 0.00 0.00 0.00 0.00 58.73 58.56 2afa h TYR 113 Cb 0.81 -0.20 -0.01 0.00 0.00 0.00 0.00 36.73 37.33 2afa h TYR 113 CO -0.34 0.28 -0.52 1.96 -0.00 0.00 0.00 178.16 179.53 2afa h GLN 114 N 0.58 0.45 0.00 0.10 4.20 -1.86 -2.03 115.11 116.54 2afa h GLN 114 Ca 0.36 -0.27 -0.10 0.00 0.06 0.00 0.00 58.65 58.69 2afa h GLN 114 Cb 0.61 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 2afa h GLN 114 CO -0.13 0.86 -0.49 0.45 -0.67 0.00 0.00 178.83 178.85 2afa h HIS 115 N 0.35 0.00 -0.02 2.96 3.86 0.16 -2.28 115.15 120.18 2afa h HIS 115 Ca 0.01 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.06 2afa h HIS 115 Cb 1.04 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.49 2afa h HIS 115 CO 0.04 0.49 -0.74 0.74 0.86 0.00 0.00 177.93 179.32 2afa h PHE 116 N 0.00 0.20 0.00 2.45 0.04 -0.52 -1.50 116.94 117.62 2afa h PHE 116 Ca -0.00 -0.10 -0.10 0.00 2.80 0.00 0.00 57.97 60.57 2afa h PHE 116 Cb 1.22 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 39.33 2afa h PHE 116 CO 0.00 0.83 -0.47 0.74 -0.60 0.00 0.00 178.31 178.80 2afa h PHE 117 N 0.09 0.00 -0.65 -0.55 0.04 -1.20 -1.06 116.94 113.61 2afa h PHE 117 Ca -0.02 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.67 2afa h PHE 117 Cb 1.30 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.43 2afa h PHE 117 CO 0.02 0.47 0.09 0.00 -0.60 0.00 0.00 178.31 178.29 2afa h ALA 118 N 1.53 0.86 -0.60 2.45 0.00 -0.92 0.84 119.26 123.42 2afa h ALA 118 Ca -0.00 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 2afa h ALA 118 Cb 0.94 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2afa h ALA 118 CO 0.06 0.64 -0.01 1.25 0.00 0.00 0.00 179.25 181.19 2afa h LEU 119 N 1.00 1.03 -0.30 0.00 5.85 -0.55 -1.62 115.31 120.72 2afa h LEU 119 Ca 0.20 -0.29 -0.08 0.00 0.84 0.00 0.00 57.88 58.54 2afa h LEU 119 Cb 0.45 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 2afa h LEU 119 CO 0.02 1.08 -0.11 0.25 -0.34 0.00 0.00 178.44 179.33 2afa h LEU 120 N 0.96 0.62 -0.76 2.25 5.85 -0.94 -1.77 115.31 121.52 2afa h LEU 120 Ca 0.17 -0.39 0.02 0.00 0.84 0.00 0.00 57.88 58.52 2afa h LEU 120 Cb 0.56 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 2afa h LEU 120 CO 0.03 0.87 0.49 1.23 -0.34 0.00 0.00 178.44 180.72 2afa h GLY 121 N 0.36 1.09 1.09 3.75 0.00 -0.66 0.12 103.07 108.84 2afa h GLY 121 Ca 0.07 -0.38 -0.16 0.00 0.00 0.00 0.00 47.33 46.86 2afa h GLY 121 CO 0.04 0.34 -0.43 0.00 0.00 0.00 0.00 176.54 176.48 2afa h ALA 122 N 1.31 0.48 -0.61 3.60 0.00 -1.27 -0.62 119.26 122.15 2afa h ALA 122 Ca 0.30 -0.47 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 2afa h ALA 122 Cb -0.03 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 2afa h ALA 122 CO -0.09 0.62 0.19 0.00 0.00 0.00 0.00 179.25 179.96 2afa h ALA 123 N 0.71 0.80 -0.49 0.00 0.00 -0.99 -1.27 119.26 118.02 2afa h ALA 123 Ca 0.04 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 2afa h ALA 123 Cb 1.03 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2afa h ALA 123 CO 0.10 0.47 0.04 0.77 0.00 0.00 0.00 179.25 180.63 2afa h SER 124 N 0.87 0.81 -0.12 0.00 0.02 -0.93 -2.56 113.55 111.64 2afa h SER 124 Ca 0.20 -0.28 -0.00 0.00 -0.84 0.00 0.00 61.79 60.86 2afa h SER 124 Cb 0.30 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 2afa h SER 124 CO -0.01 0.89 0.07 0.00 -1.14 0.00 0.00 176.83 176.65 2afa h ALA 125 N 0.95 1.87 0.00 3.77 0.00 -0.76 -0.70 119.26 124.38 2afa h ALA 125 Ca 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2afa h ALA 125 Cb 0.45 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2afa h ALA 125 CO 0.02 0.12 -0.12 0.28 0.00 0.00 0.00 179.25 179.54 2afa h VAL 126 N 0.19 1.07 0.00 0.00 2.07 -0.81 -1.96 116.25 116.82 2afa h VAL 126 Ca 0.05 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.16 2afa h VAL 126 Cb 0.01 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 2afa h VAL 126 CO -0.01 0.12 0.00 0.71 0.02 0.00 0.00 177.57 178.41 2afa h THR 127 N 0.00 0.00 0.00 2.57 1.35 -1.10 -2.25 112.91 113.48 2afa h THR 127 Ca -0.00 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 2afa h THR 127 Cb 0.21 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 2afa h THR 127 CO 0.02 0.00 -0.26 0.35 -0.25 0.00 0.00 175.52 175.37 2afa n THR 128 N -2.60 0.28 -0.98 6.82 -2.24 -0.73 -4.87 114.28 109.95 2afa n THR 128 Ca 0.01 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2afa n THR 128 Cb 0.26 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.20 2afa n THR 128 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2afa n GLY 129 N 1.40 0.84 3.62 3.38 0.00 -0.85 -4.97 105.19 108.61 2afa n GLY 129 Ca 0.05 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.55 2afa n GLY 129 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2afa n HIS 130 N -2.31 1.74 -0.14 1.61 -0.00 -1.26 -4.82 115.22 110.03 2afa n HIS 130 Ca 0.00 0.54 0.23 0.00 -0.00 0.00 0.00 57.72 58.49 2afa n HIS 130 Cb 0.00 -2.40 0.64 0.00 -0.00 0.00 0.00 29.99 28.24 2afa n HIS 130 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2afa h PRO 131 N 5.35 0.14 -0.01 1.57 0.13 -1.96 -1.48 132.00 135.74 2afa h PRO 131 Ca -0.47 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2afa h PRO 131 Cb 1.32 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2afa h PRO 131 CO 0.83 0.09 -0.23 0.39 -0.23 0.00 0.00 178.00 178.85 2afa n GLU 132 N -4.38 1.14 0.20 0.86 -0.58 -1.26 -4.51 120.64 112.11 2afa n GLU 132 Ca 0.16 -0.75 -0.14 0.00 -0.42 0.00 0.00 57.16 56.01 2afa n GLU 132 Cb 0.76 -1.48 -0.08 0.00 -0.57 0.00 0.00 31.44 30.06 2afa n GLU 132 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2afa h ALA 133 N 3.90 -0.50 -0.99 0.62 0.00 -1.60 -2.84 119.26 117.85 2afa h ALA 133 Ca 0.00 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 54.84 2afa h ALA 133 Cb 0.58 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.48 2afa h ALA 133 CO 0.00 -0.64 0.63 -0.09 0.00 0.00 0.00 179.25 179.14 2afa h ARG 134 N -0.78 0.98 -0.60 0.00 9.65 -1.79 -0.82 114.38 121.02 2afa h ARG 134 Ca -0.05 -0.06 -0.04 0.00 -1.10 0.00 0.00 59.98 58.72 2afa h ARG 134 Cb 0.52 -0.22 -0.03 0.00 -1.39 0.00 0.00 29.97 28.86 2afa h ARG 134 CO 0.08 0.65 0.20 -0.22 2.80 0.00 0.00 179.97 183.49 2afa h LYS 135 N 1.01 0.92 -0.75 0.20 3.64 -1.83 -1.55 116.57 118.21 2afa h LYS 135 Ca 0.47 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 2afa h LYS 135 Cb 0.41 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 2afa h LYS 135 CO -0.23 0.81 0.49 1.25 -2.27 0.00 0.00 179.45 179.50 2afa h LEU 136 N 0.84 0.87 -0.25 5.20 5.85 -0.98 -2.41 115.31 124.42 2afa h LEU 136 Ca 0.19 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 2afa h LEU 136 Cb 0.27 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 2afa h LEU 136 CO -0.01 0.64 0.10 0.25 -0.34 0.00 0.00 178.44 179.08 2afa h LEU 137 N 1.01 0.35 -0.61 2.25 5.85 -0.78 -1.76 115.31 121.62 2afa h LEU 137 Ca 0.27 -0.17 0.07 0.00 0.84 0.00 0.00 57.88 58.90 2afa h LEU 137 Cb -0.10 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 40.78 2afa h LEU 137 CO -0.06 0.42 0.29 0.44 -0.34 0.00 0.00 178.44 179.19 2afa h ASP 138 N 0.25 0.39 0.12 1.25 3.32 -1.11 0.24 116.42 120.88 2afa h ASP 138 Ca 0.08 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 2afa h ASP 138 Cb 0.18 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.71 2afa h ASP 138 CO -0.01 0.25 -0.06 0.22 -1.72 0.00 0.00 179.24 177.92 2afa h TYR 139 N 0.54 -0.15 -0.97 4.55 3.20 -1.28 -1.57 116.97 121.28 2afa h TYR 139 Ca 0.29 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.26 2afa h TYR 139 Cb 0.26 0.05 -0.08 0.00 1.54 0.00 0.00 36.73 38.50 2afa h TYR 139 CO -0.12 -0.08 0.62 1.15 -1.64 0.00 0.00 178.16 178.09 2afa h THR 140 N -0.18 0.95 -0.95 1.81 2.02 -0.72 0.18 112.91 116.02 2afa h THR 140 Ca -0.02 -0.33 0.02 0.00 0.77 0.00 0.00 66.41 66.85 2afa h THR 140 Cb 0.14 -0.11 -0.05 0.00 -1.74 0.00 0.00 68.15 66.39 2afa h THR 140 CO 0.03 0.18 0.63 0.40 0.37 0.00 0.00 175.52 177.13 2afa h ILE 141 N 0.97 1.21 0.45 3.11 1.08 0.08 -0.83 117.51 123.58 2afa h ILE 141 Ca 0.46 -0.43 -0.02 0.00 -0.39 0.00 0.00 64.86 64.48 2afa h ILE 141 Cb 0.44 -0.15 0.00 0.00 -3.07 0.00 0.00 36.82 34.04 2afa h ILE 141 CO -0.22 0.23 -0.22 -0.33 -0.69 0.00 0.00 178.15 176.92 2afa h GLU 142 N 1.26 -0.58 -0.57 2.37 5.08 0.29 -1.60 114.58 120.82 2afa h GLU 142 Ca 0.36 0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.85 2afa h GLU 142 Cb -0.09 0.13 -0.07 0.00 0.50 0.00 0.00 28.75 29.23 2afa h GLU 142 CO -0.09 -0.33 0.18 0.28 -1.00 0.00 0.00 179.01 178.04 2afa h VAL 143 N -0.71 0.75 -0.03 3.13 2.07 -1.00 -1.62 116.25 118.85 2afa h VAL 143 Ca -0.06 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 2afa h VAL 143 Cb 0.52 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.67 2afa h VAL 143 CO 0.10 0.06 0.01 0.40 0.02 0.00 0.00 177.57 178.17 2afa h ILE 144 N 0.34 1.08 0.00 4.57 1.08 -1.07 -1.04 117.51 122.46 2afa h ILE 144 Ca 0.29 -0.22 -0.02 0.00 -0.39 0.00 0.00 64.86 64.51 2afa h ILE 144 Cb 0.37 1.18 -0.00 0.00 -3.07 0.00 0.00 36.82 35.30 2afa h ILE 144 CO -0.32 0.06 -0.09 -0.33 -0.69 0.00 0.00 178.15 176.78 2afa h GLU 145 N -0.05 0.00 0.04 2.37 5.08 -1.03 0.24 114.58 121.23 2afa h GLU 145 Ca 0.01 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.17 2afa h GLU 145 Cb 0.09 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2afa h GLU 145 CO -0.00 0.09 -1.04 -0.22 -1.00 0.00 0.00 179.01 176.84 2afa h LYS 146 N 0.00 0.08 0.00 2.33 3.64 -1.17 -3.42 116.57 118.04 2afa h LYS 146 Ca -0.00 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2afa h LYS 146 Cb 0.59 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 2afa h LYS 146 CO 0.01 1.07 -1.16 0.66 -2.27 0.00 0.00 179.45 177.76 2afa n TYR 147 N -4.29 0.00 -0.00 1.91 4.01 -0.41 -4.84 117.16 113.55 2afa n TYR 147 Ca -0.25 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.49 2afa n TYR 147 Cb 0.71 -0.17 -0.00 0.00 -0.31 0.00 0.00 39.34 39.57 2afa n TYR 147 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2afa n PHE 148 N -1.67 0.00 -3.56 -0.72 3.72 0.20 -4.76 117.46 110.67 2afa n PHE 148 Ca -0.00 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.02 2afa n PHE 148 Cb 0.27 -0.02 -0.11 0.00 -0.94 0.00 0.00 39.48 38.68 2afa n PHE 148 CO 0.00 0.00 0.00 -0.46 -0.05 0.00 0.00 176.76 176.25 2afa s TRP 149 N -2.03 3.23 -0.37 1.38 -0.11 0.59 -0.41 118.94 121.22 2afa s TRP 149 Ca -0.00 0.16 -0.18 0.00 1.22 0.00 0.00 56.10 57.30 2afa s TRP 149 Cb 0.00 -2.40 0.00 0.00 -1.50 0.00 0.00 33.47 29.57 2afa s TRP 149 CO 0.02 -0.16 0.52 0.45 -4.62 0.00 0.00 176.95 173.16 2afa s SER 150 N 1.72 6.30 0.22 5.86 0.15 -1.26 -4.70 113.70 121.99 2afa s SER 150 Ca 0.08 -0.13 -0.03 0.00 0.70 0.00 0.00 55.95 56.57 2afa s SER 150 Cb -0.16 -2.27 0.21 0.00 -1.71 0.00 0.00 66.02 62.09 2afa s SER 150 CO 0.11 -0.52 1.63 -0.08 1.20 0.00 0.00 173.24 175.57 2afa h GLU 151 N 8.53 0.71 0.02 5.44 4.57 -1.96 0.81 114.58 132.70 2afa h GLU 151 Ca -0.27 -0.30 -0.00 0.00 -1.18 0.00 0.00 59.36 57.60 2afa h GLU 151 Cb 1.12 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.68 2afa h GLU 151 CO 0.79 0.90 -0.01 1.05 -1.18 0.00 0.00 179.01 180.56 2afa h GLU 152 N 0.62 -0.03 0.00 1.92 9.09 -2.03 -3.18 114.58 120.98 2afa h GLU 152 Ca 0.08 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.38 2afa h GLU 152 Cb 0.77 0.01 -0.02 0.00 -1.65 0.00 0.00 28.75 27.86 2afa h GLU 152 CO 0.06 0.40 -0.52 0.93 0.05 0.00 0.00 179.01 179.93 2afa h GLU 153 N -0.46 0.00 -5.57 1.06 5.08 -1.96 -3.54 114.58 109.18 2afa h GLU 153 Ca -0.00 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.07 2afa h GLU 153 Cb 0.44 0.00 0.18 0.00 0.50 0.00 0.00 28.75 29.87 2afa h GLU 153 CO 0.00 0.52 -0.85 1.04 -1.00 0.00 0.00 179.01 178.72 2afa n GLN 154 N -3.63 -2.83 -4.29 2.33 1.13 0.28 -5.04 117.38 105.34 2afa n GLN 154 Ca -0.01 0.82 -0.30 0.00 -1.94 0.00 0.00 57.00 55.57 2afa n GLN 154 Cb 0.59 -5.66 -0.10 0.00 0.11 0.00 0.00 30.24 25.18 2afa n GLN 154 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2afa n LEU 157 N 0.92 0.00 -0.06 0.00 4.77 0.45 -4.82 117.00 118.25 2afa n LEU 157 Ca -0.14 -1.16 -0.13 0.00 -0.03 0.00 0.00 56.01 54.55 2afa n LEU 157 Cb 0.52 -0.76 -0.04 0.00 -2.33 0.00 0.00 43.42 40.81 2afa n LEU 157 CO 0.33 -1.20 -0.82 1.21 -1.33 0.00 0.00 177.39 175.58 2afa n GLU 158 N -3.10 0.33 -3.48 3.23 4.07 -1.26 -4.74 120.64 115.68 2afa n GLU 158 Ca 0.13 0.14 -0.10 0.00 -0.06 0.00 0.00 57.16 57.27 2afa n GLU 158 Cb 0.44 -1.07 -0.02 0.00 -0.06 0.00 0.00 31.44 30.73 2afa n GLU 158 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 2afa s SER 159 N -6.28 -0.46 0.09 4.31 1.04 -1.26 0.75 113.70 111.88 2afa s SER 159 Ca -0.21 -0.04 0.01 0.00 0.48 0.00 0.00 55.95 56.20 2afa s SER 159 Cb 0.06 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.65 2afa s SER 159 CO 0.28 -0.84 -0.06 0.26 0.98 0.00 0.00 173.24 173.86 2afa s TRP 160 N -3.48 0.82 1.08 5.02 0.52 -0.23 -0.80 118.94 121.87 2afa s TRP 160 Ca 0.03 -0.94 -0.18 0.00 0.02 0.00 0.00 56.10 55.04 2afa s TRP 160 Cb -0.01 -0.49 0.25 0.00 -1.15 0.00 0.00 33.47 32.06 2afa s TRP 160 CO -0.10 -0.19 1.23 0.16 0.02 0.00 0.00 176.95 178.07 2afa s ASP 161 N -3.00 2.00 0.12 2.95 -4.77 -1.23 -1.67 116.67 111.08 2afa s ASP 161 Ca 0.11 0.39 -0.32 0.00 -3.30 0.00 0.00 52.55 49.43 2afa s ASP 161 Cb 0.06 -0.48 -0.10 0.00 -1.09 0.00 0.00 42.92 41.31 2afa s ASP 161 CO -0.06 -3.43 1.57 -0.08 0.70 0.00 0.00 175.17 173.87 2afa h GLU 162 N -2.12 -0.57 0.00 2.11 4.81 -1.90 -2.28 114.58 114.63 2afa h GLU 162 Ca -0.44 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 2afa h GLU 162 Cb 1.25 0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.76 2afa h GLU 162 CO 0.34 -0.38 0.00 0.00 -0.73 0.00 0.00 179.01 178.24 2afa n ALA 163 N -2.93 2.34 -3.11 2.92 0.00 -1.26 -4.86 120.51 113.60 2afa n ALA 163 Ca -0.06 -0.08 -0.23 0.00 0.00 0.00 0.00 53.44 53.07 2afa n ALA 163 Cb 0.38 -1.21 0.04 0.00 0.00 0.00 0.00 19.45 18.66 2afa n ALA 163 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2afa n PHE 164 N -0.76 -2.10 0.02 0.00 3.72 -0.86 -4.90 117.46 112.58 2afa n PHE 164 Ca 0.10 0.59 -0.18 0.00 -0.05 0.00 0.00 57.45 57.91 2afa n PHE 164 Cb 0.04 -4.57 -0.08 0.00 -0.94 0.00 0.00 39.48 33.94 2afa n PHE 164 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2afa h SER 165 N -1.57 0.87 -3.95 4.37 4.64 -1.89 -3.47 113.55 112.55 2afa h SER 165 Ca -0.54 -0.64 -0.12 0.00 -0.47 0.00 0.00 61.79 60.03 2afa h SER 165 Cb 1.37 -0.26 -0.24 0.00 -0.31 0.00 0.00 62.40 62.96 2afa h SER 165 CO 0.57 1.44 -0.22 -1.58 -0.87 0.00 0.00 176.83 176.17 2afa s GLN 166 N -3.51 0.50 0.25 4.77 0.74 -1.26 -5.07 119.66 116.08 2afa s GLN 166 Ca -0.09 0.54 -0.04 0.00 0.05 0.00 0.00 55.36 55.82 2afa s GLN 166 Cb 0.08 0.24 -0.05 0.00 1.10 0.00 0.00 33.01 34.38 2afa s GLN 166 CO 0.91 -0.07 0.50 -0.08 -0.55 0.00 0.00 175.29 176.00 2afa s THR 167 N 0.13 5.07 0.21 -0.34 -1.32 -1.26 -3.50 115.64 114.63 2afa s THR 167 Ca -0.01 -0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.16 2afa s THR 167 Cb -0.03 -3.71 -0.09 0.00 -1.51 0.00 0.00 72.50 67.16 2afa s THR 167 CO 0.01 -0.23 1.37 -0.70 -2.21 0.00 0.00 174.62 172.87 2afa s GLU 168 N -3.34 4.33 -0.73 7.08 2.12 0.02 -4.88 118.70 123.31 2afa s GLU 168 Ca 0.43 2.16 -0.07 0.00 0.36 0.00 0.00 54.97 57.85 2afa s GLU 168 Cb -0.11 -3.17 -0.14 0.00 0.26 0.00 0.00 34.13 30.97 2afa s GLU 168 CO 0.28 -0.35 2.82 -3.47 -0.54 0.00 0.00 175.26 174.01 2afa n ASP 169 N 2.73 5.88 -3.70 -1.70 2.03 -1.26 -4.72 116.55 115.81 2afa n ASP 169 Ca 0.07 -2.39 -0.14 0.00 0.52 0.00 0.00 54.79 52.85 2afa n ASP 169 Cb 0.42 -1.28 -0.08 0.00 -0.72 0.00 0.00 41.12 39.46 2afa n ASP 169 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 2afa s TYR 170 N 2.08 -0.29 -0.05 -0.67 5.04 -1.26 -4.41 117.35 117.79 2afa s TYR 170 Ca 0.56 0.43 -0.02 0.00 -2.44 0.00 0.00 57.07 55.61 2afa s TYR 170 Cb 0.20 0.18 0.03 0.00 0.35 0.00 0.00 41.96 42.72 2afa s TYR 170 CO -0.03 -0.46 0.08 1.03 -1.34 0.00 0.00 175.55 174.83 2afa s ARG 171 N -1.48 -0.04 0.10 4.97 1.81 -1.01 -4.16 118.95 119.14 2afa s ARG 171 Ca -0.12 0.39 0.09 0.00 -1.72 0.00 0.00 55.73 54.37 2afa s ARG 171 Cb -0.03 -0.41 -0.04 0.00 -0.45 0.00 0.00 34.95 34.02 2afa s ARG 171 CO 0.04 -0.29 -0.22 0.20 -0.68 0.00 0.00 175.30 174.35 2afa s GLY 172 N 1.99 1.61 0.42 -3.53 0.00 -1.26 -0.48 107.32 106.06 2afa s GLY 172 Ca 0.02 -1.36 0.19 0.00 0.00 0.00 0.00 44.72 43.57 2afa s GLY 172 CO -0.04 -1.32 1.87 -1.33 0.00 0.00 0.00 173.10 172.28 2afa h GLY 173 N 3.99 0.00 0.63 0.20 0.00 -1.39 -3.04 103.07 103.46 2afa h GLY 173 Ca -0.50 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.82 2afa h GLY 173 CO 0.44 0.00 -0.16 -0.57 0.00 0.00 0.00 176.54 176.25 2afa h ASN 174 N 0.00 -0.38 -0.80 0.19 -0.73 -1.95 -3.18 115.58 108.74 2afa h ASN 174 Ca -0.00 -0.17 0.09 0.00 1.87 0.00 0.00 56.30 58.09 2afa h ASN 174 Cb 0.64 0.10 -0.07 0.00 0.27 0.00 0.00 38.32 39.26 2afa h ASN 174 CO 0.04 0.01 0.44 0.00 -0.37 0.00 0.00 177.43 177.55 2afa h ALA 175 N -0.35 1.13 0.00 1.57 0.00 -1.93 -0.83 119.26 118.84 2afa h ALA 175 Ca -0.05 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2afa h ALA 175 Cb 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2afa h ALA 175 CO 0.08 0.07 0.00 0.09 0.00 0.00 0.00 179.25 179.48 2afa n ASN 176 N -4.77 2.75 0.00 0.00 4.13 -1.15 -2.26 115.26 113.96 2afa n ASN 176 Ca 0.13 -1.63 0.00 0.00 1.68 0.00 0.00 54.58 54.76 2afa n ASN 176 Cb 0.27 -0.54 0.00 0.00 -1.54 0.00 0.00 39.78 37.97 2afa n ASN 176 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2afa n HIS 178 N 1.25 0.00 0.01 3.10 8.25 -0.32 -2.16 115.22 125.36 2afa n HIS 178 Ca 0.00 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.26 2afa n HIS 178 Cb 0.32 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.29 2afa n HIS 178 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2afa h ALA 179 N 0.00 0.04 -0.51 -1.41 0.00 -1.70 -2.40 119.26 113.27 2afa h ALA 179 Ca 0.00 -0.86 0.01 0.00 0.00 0.00 0.00 54.91 54.06 2afa h ALA 179 Cb 0.00 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2afa h ALA 179 CO 0.00 0.53 0.33 0.28 0.00 0.00 0.00 179.25 180.40 2afa h VAL 180 N -0.44 1.11 0.26 0.00 2.07 -1.73 0.59 116.25 118.11 2afa h VAL 180 Ca -0.20 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2afa h VAL 180 Cb 1.61 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 2afa h VAL 180 CO 0.08 0.12 -0.25 -0.08 0.02 0.00 0.00 177.57 177.46 2afa h GLU 181 N 0.67 -0.52 -0.56 1.57 4.81 -1.85 -1.93 114.58 116.77 2afa h GLU 181 Ca 0.19 0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.40 2afa h GLU 181 Cb -0.05 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2afa h GLU 181 CO -0.06 -0.35 0.12 0.00 -0.73 0.00 0.00 179.01 178.00 2afa h ALA 182 N 0.11 0.74 -0.96 2.92 0.00 -1.14 -3.07 119.26 117.87 2afa h ALA 182 Ca -0.01 -0.23 0.10 0.00 0.00 0.00 0.00 54.91 54.77 2afa h ALA 182 Cb 0.50 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.00 2afa h ALA 182 CO -0.05 0.46 0.62 0.74 0.00 0.00 0.00 179.25 181.02 2afa h PHE 183 N 0.81 1.09 -0.88 0.00 -1.00 0.36 -1.14 116.94 116.18 2afa h PHE 183 Ca 0.17 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.99 2afa h PHE 183 Cb 0.37 -0.35 -0.04 0.00 3.61 0.00 0.00 35.95 39.53 2afa h PHE 183 CO 0.03 0.50 0.56 -0.07 -1.61 0.00 0.00 178.31 177.71 2afa h LEU 184 N 1.00 1.04 -0.15 1.54 3.38 -1.25 -1.12 115.31 119.75 2afa h LEU 184 Ca 0.45 -0.05 -0.22 0.00 0.09 0.00 0.00 57.88 58.15 2afa h LEU 184 Cb 0.37 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.86 2afa h LEU 184 CO -0.20 0.78 -0.77 0.40 0.09 0.00 0.00 178.44 178.73 2afa h ILE 185 N 1.21 1.28 -0.97 1.22 1.08 -1.40 -1.97 117.51 117.95 2afa h ILE 185 Ca 0.32 -1.96 0.05 0.00 -0.39 0.00 0.00 64.86 62.88 2afa h ILE 185 Cb -0.09 1.98 -0.06 0.00 -3.07 0.00 0.00 36.82 35.58 2afa h ILE 185 CO -0.06 0.62 0.62 0.58 -0.69 0.00 0.00 178.15 179.22 2afa h VAL 186 N 0.53 1.11 -0.81 1.67 2.07 -1.02 0.14 116.25 119.95 2afa h VAL 186 Ca -0.05 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.02 2afa h VAL 186 Cb 1.40 -0.15 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 2afa h VAL 186 CO 0.16 0.21 0.34 0.22 0.02 0.00 0.00 177.57 178.52 2afa h TYR 187 N 1.16 1.23 0.00 1.57 3.20 -1.06 -1.70 116.97 121.37 2afa h TYR 187 Ca 0.40 -0.09 -0.05 0.00 3.14 0.00 0.00 58.73 62.14 2afa h TYR 187 Cb 0.10 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 37.99 2afa h TYR 187 CO -0.01 0.92 -0.24 -0.44 -1.64 0.00 0.00 178.16 176.75 2afa h ASP 188 N 1.18 0.00 -0.42 -2.11 3.32 -0.23 0.49 116.42 118.66 2afa h ASP 188 Ca 0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.32 2afa h ASP 188 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2afa h ASP 188 CO -0.02 0.24 0.00 1.33 -1.72 0.00 0.00 179.24 179.06 2afa n VAL 189 N -3.87 1.85 0.00 -1.35 0.24 -0.51 -4.45 118.33 110.23 2afa n VAL 189 Ca -0.02 -1.42 0.00 0.00 -2.04 0.00 0.00 64.34 60.86 2afa n VAL 189 Cb 0.33 0.05 0.00 0.00 -1.47 0.00 0.00 33.84 32.75 2afa n VAL 189 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2afa n THR 190 N 0.31 0.00 -3.37 3.34 -2.24 -0.68 -5.03 114.28 106.61 2afa n THR 190 Ca 0.20 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.76 2afa n THR 190 Cb 0.79 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 69.00 2afa n THR 190 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2afa n HIS 191 N -0.02 -1.70 -3.52 4.78 8.25 0.17 -4.93 115.22 118.25 2afa n HIS 191 Ca 0.00 0.40 -0.37 0.00 -0.26 0.00 0.00 57.72 57.50 2afa n HIS 191 Cb 0.00 -2.45 -0.07 0.00 1.12 0.00 0.00 29.99 28.59 2afa n HIS 191 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2afa s ASP 192 N -2.65 6.48 0.33 0.41 -1.08 -1.26 -5.00 116.67 113.89 2afa s ASP 192 Ca 0.38 0.56 0.03 0.00 -0.52 0.00 0.00 52.55 53.01 2afa s ASP 192 Cb -0.21 -2.19 0.62 0.00 -1.46 0.00 0.00 42.92 39.68 2afa s ASP 192 CO 0.47 0.11 1.94 0.50 0.52 0.00 0.00 175.17 178.71 2afa h LYS 193 N 6.53 0.88 -0.34 4.34 3.64 -1.95 -3.27 116.57 126.39 2afa h LYS 193 Ca -0.42 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 58.97 2afa h LYS 193 Cb 1.17 -0.20 -0.06 0.00 -0.41 0.00 0.00 32.23 32.74 2afa h LYS 193 CO 0.74 0.58 -0.01 1.57 -2.27 0.00 0.00 179.45 180.07 2afa h LYS 194 N 0.91 0.09 -0.39 1.90 2.10 -1.98 -1.20 116.57 118.00 2afa h LYS 194 Ca 0.34 -0.01 0.11 0.00 -2.00 0.00 0.00 60.65 59.10 2afa h LYS 194 Cb 0.19 -0.02 -0.02 0.00 -0.90 0.00 0.00 32.23 31.48 2afa h LYS 194 CO -0.12 0.06 0.30 -1.49 -2.00 0.00 0.00 179.45 176.20 2afa h TRP 195 N 0.09 0.00 0.00 0.07 4.06 -1.90 0.43 115.95 118.70 2afa h TRP 195 Ca 0.17 0.00 -0.25 0.00 2.06 0.00 0.00 58.89 60.87 2afa h TRP 195 Cb 0.23 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.35 2afa h TRP 195 CO -0.25 0.00 -1.42 1.25 -3.56 0.00 0.00 178.44 174.47 2afa h LEU 196 N 0.00 0.00 -0.57 -4.49 5.85 -1.57 -2.67 115.31 111.86 2afa h LEU 196 Ca 0.19 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.76 2afa h LEU 196 Cb 0.79 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 2afa h LEU 196 CO -0.00 0.94 -0.42 0.44 -0.34 0.00 0.00 178.44 179.06 2afa h ASP 197 N 0.00 0.73 0.22 1.25 3.32 0.32 -2.08 116.42 120.18 2afa h ASP 197 Ca -0.18 -0.33 -0.11 0.00 0.02 0.00 0.00 57.03 56.43 2afa h ASP 197 Cb 1.88 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 41.21 2afa h ASP 197 CO 0.09 1.05 -0.41 0.03 -1.72 0.00 0.00 179.24 178.29 2afa h ARG 198 N 0.55 0.25 0.49 3.56 3.08 -0.34 -2.17 114.38 119.80 2afa h ARG 198 Ca 0.04 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 2afa h ARG 198 Cb 0.95 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.01 2afa h ARG 198 CO 0.09 0.62 -0.23 0.00 -1.07 0.00 0.00 179.97 179.37 2afa h ALA 199 N 1.37 -0.65 -0.74 0.04 0.00 -1.10 -1.87 119.26 116.31 2afa h ALA 199 Ca 0.02 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 54.86 2afa h ALA 199 Cb 0.81 0.25 -0.08 0.00 0.00 0.00 0.00 17.79 18.77 2afa h ALA 199 CO 0.06 -0.75 0.35 -0.07 0.00 0.00 0.00 179.25 178.84 2afa h LEU 200 N -0.88 0.42 0.31 0.00 3.38 -1.36 -1.74 115.31 115.43 2afa h LEU 200 Ca -0.07 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2afa h LEU 200 Cb 0.59 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 2afa h LEU 200 CO 0.11 0.22 -0.26 -0.09 0.09 0.00 0.00 178.44 178.50 2afa h ARG 201 N 0.56 -0.57 -0.59 1.13 9.65 -1.34 0.40 114.38 123.62 2afa h ARG 201 Ca 0.38 0.04 0.12 0.00 -1.10 0.00 0.00 59.98 59.42 2afa h ARG 201 Cb 0.47 0.13 -0.09 0.00 -1.39 0.00 0.00 29.97 29.09 2afa h ARG 201 CO -0.32 -0.38 0.06 0.82 2.80 0.00 0.00 179.97 182.95 2afa h ILE 202 N -0.59 0.57 -0.51 1.20 1.08 -0.87 -2.49 117.51 115.90 2afa h ILE 202 Ca -0.02 -0.06 -0.11 0.00 -0.39 0.00 0.00 64.86 64.28 2afa h ILE 202 Cb 0.52 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 34.64 2afa h ILE 202 CO -0.03 0.03 -0.10 0.00 -0.69 0.00 0.00 178.15 177.36 2afa h ALA 203 N 1.51 0.70 -0.25 1.87 0.00 -0.88 -2.25 119.26 119.96 2afa h ALA 203 Ca 0.31 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.91 2afa h ALA 203 Cb 0.48 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2afa h ALA 203 CO -0.46 0.61 0.17 0.66 0.00 0.00 0.00 179.25 180.24 2afa h SER 204 N 0.84 0.16 0.00 0.00 4.64 0.23 -0.68 113.55 118.75 2afa h SER 204 Ca 0.13 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2afa h SER 204 Cb 0.66 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 2afa h SER 204 CO 0.05 0.11 0.00 0.52 -0.87 0.00 0.00 176.83 176.64 2afa n VAL 205 N -4.49 0.00 0.08 0.95 0.31 -1.09 -0.49 118.33 113.59 2afa n VAL 205 Ca 0.02 0.48 0.12 0.00 -0.01 0.00 0.00 64.34 64.95 2afa n VAL 205 Cb 0.20 -1.45 0.60 0.00 -0.91 0.00 0.00 33.84 32.28 2afa n VAL 205 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2afa h ILE 206 N 0.00 0.91 0.00 2.52 2.04 -1.49 -2.00 117.51 119.49 2afa h ILE 206 Ca 0.00 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.80 2afa h ILE 206 Cb 0.00 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2afa h ILE 206 CO 0.00 0.03 -0.37 -0.38 0.00 0.00 0.00 178.15 177.43 2afa n ILE 207 N -4.47 0.73 0.05 -0.67 2.08 -0.32 -2.30 119.36 114.45 2afa n ILE 207 Ca 0.04 0.29 0.05 0.00 0.56 0.00 0.00 62.75 63.68 2afa n ILE 207 Cb 0.29 -1.76 0.46 0.00 -0.75 0.00 0.00 39.64 37.88 2afa n ILE 207 CO 0.00 0.00 0.00 -0.74 0.56 0.00 0.00 176.55 176.37 2afa h HIS 208 N -0.37 0.42 0.00 1.39 2.76 -1.19 0.84 115.15 119.01 2afa h HIS 208 Ca 0.00 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 2afa h HIS 208 Cb 0.37 -0.14 0.00 0.00 1.55 0.00 0.00 27.41 29.19 2afa h HIS 208 CO -0.16 0.27 0.00 -0.25 -1.30 0.00 0.00 177.93 176.50 2afa n ASP 209 N -4.48 0.00 0.12 3.26 8.00 0.36 -4.31 116.55 119.51 2afa n ASP 209 Ca 0.02 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.44 2afa n ASP 209 Cb 0.07 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.13 2afa n ASP 209 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2afa h VAL 210 N 0.00 0.00 -0.34 2.53 2.07 -1.52 -2.94 116.25 116.05 2afa h VAL 210 Ca 0.00 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.59 2afa h VAL 210 Cb 0.00 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.69 2afa h VAL 210 CO 0.00 0.00 -0.33 0.00 0.02 0.00 0.00 177.57 177.26 2afa h ALA 211 N -1.39 -0.24 -0.43 1.67 0.00 -1.26 -1.53 119.26 116.09 2afa h ALA 211 Ca -0.03 0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.08 2afa h ALA 211 Cb 0.37 0.69 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2afa h ALA 211 CO -0.03 -0.75 0.31 -0.09 0.00 0.00 0.00 179.25 178.69 2afa h ARG 212 N -0.29 0.05 -0.00 0.00 2.43 -0.90 0.13 114.38 115.80 2afa h ARG 212 Ca 0.15 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2afa h ARG 212 Cb 0.54 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 2afa h ARG 212 CO -0.50 0.03 -0.28 0.09 -1.51 0.00 0.00 179.97 177.81 2afa n ASN 213 N -4.42 0.68 -2.22 -3.80 3.02 -0.64 -3.97 115.26 103.90 2afa n ASN 213 Ca 0.07 -0.54 -0.29 0.00 -0.03 0.00 0.00 54.58 53.80 2afa n ASN 213 Cb 0.47 0.08 0.04 0.00 -0.61 0.00 0.00 39.78 39.76 2afa n ASN 213 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2afa n GLY 214 N 1.39 6.15 2.53 7.41 0.00 0.26 -4.89 105.19 118.03 2afa n GLY 214 Ca 0.10 -2.57 -0.20 0.00 0.00 0.00 0.00 46.02 43.35 2afa n GLY 214 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2afa n ASP 215 N -0.73 -5.44 -1.16 1.61 8.00 -1.23 -1.46 116.55 116.13 2afa n ASP 215 Ca 0.49 0.41 -0.11 0.00 0.71 0.00 0.00 54.79 56.30 2afa n ASP 215 Cb 0.80 -4.76 -0.01 0.00 -0.02 0.00 0.00 41.12 37.12 2afa n ASP 215 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2afa n TYR 216 N -2.65 -0.44 -3.56 1.24 4.02 -0.08 -4.84 117.16 110.86 2afa n TYR 216 Ca -0.21 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.28 2afa n TYR 216 Cb 0.67 -2.46 -0.11 0.00 -0.02 0.00 0.00 39.34 37.43 2afa n TYR 216 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2afa s ARG 217 N -4.31 3.62 -0.00 -0.72 0.52 -0.54 -4.76 118.95 112.77 2afa s ARG 217 Ca 0.00 -0.55 -0.30 0.00 -0.52 0.00 0.00 55.73 54.36 2afa s ARG 217 Cb 0.00 -3.74 -0.05 0.00 0.52 0.00 0.00 34.95 31.67 2afa s ARG 217 CO 0.00 -0.36 1.36 0.08 0.02 0.00 0.00 175.30 176.40 2afa s VAL 218 N 1.73 3.79 -0.13 3.52 1.01 -1.26 -4.59 120.40 124.45 2afa s VAL 218 Ca 0.06 1.17 -0.28 0.00 0.00 0.00 0.00 61.98 62.94 2afa s VAL 218 Cb -0.17 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 2afa s VAL 218 CO 0.10 0.01 0.93 0.21 0.00 0.00 0.00 175.10 176.35 2afa s ASN 219 N 1.75 7.12 -0.18 3.32 3.84 -1.26 -4.69 114.94 124.84 2afa s ASN 219 Ca 0.62 1.37 -0.17 0.00 0.21 0.00 0.00 52.86 54.90 2afa s ASN 219 Cb -0.31 -2.51 -0.22 0.00 -0.55 0.00 0.00 41.25 37.67 2afa s ASN 219 CO 0.26 -0.42 0.28 -0.33 -2.79 0.00 0.00 177.10 174.10 2afa h GLU 220 N 7.19 0.10 -5.48 0.43 4.39 -1.94 -3.42 114.58 115.84 2afa h GLU 220 Ca -0.30 -0.16 -0.59 0.00 0.34 0.00 0.00 59.36 58.64 2afa h GLU 220 Cb 1.14 0.06 -0.10 0.00 -0.10 0.00 0.00 28.75 29.75 2afa h GLU 220 CO 0.85 1.08 -0.32 -1.01 -1.16 0.00 0.00 179.01 178.44 2afa s HIS 221 N -2.43 3.45 0.32 4.33 0.09 -1.26 -1.13 115.29 118.66 2afa s HIS 221 Ca -0.26 0.58 0.03 0.00 -0.00 0.00 0.00 55.06 55.41 2afa s HIS 221 Cb 0.06 -2.35 -0.06 0.00 -0.00 0.00 0.00 32.58 30.23 2afa s HIS 221 CO 0.66 0.22 0.07 -0.06 -0.00 0.00 0.00 174.74 175.63 2afa s PHE 222 N 0.53 1.85 0.48 1.40 0.40 0.36 -0.93 117.98 122.07 2afa s PHE 222 Ca 0.16 -1.04 0.08 0.00 -0.60 0.00 0.00 56.93 55.53 2afa s PHE 222 Cb -0.13 -1.18 0.02 0.00 0.51 0.00 0.00 43.02 42.24 2afa s PHE 222 CO 0.04 -0.10 0.52 0.16 0.70 0.00 0.00 175.22 176.54 2afa s ASP 223 N -3.45 5.11 0.00 1.36 -4.77 -0.91 -2.39 116.67 111.62 2afa s ASP 223 Ca 0.36 -0.80 0.00 0.00 -3.30 0.00 0.00 52.55 48.81 2afa s ASP 223 Cb 0.08 -0.20 0.00 0.00 -1.09 0.00 0.00 42.92 41.71 2afa s ASP 223 CO 0.15 -0.93 0.88 -1.20 0.70 0.00 0.00 175.17 174.77 2afa n SER 224 N -1.82 0.00 -0.69 2.11 7.64 -1.26 -0.06 113.62 119.54 2afa n SER 224 Ca 0.06 0.38 0.09 0.00 1.01 0.00 0.00 58.87 60.41 2afa n SER 224 Cb 0.62 -0.38 0.23 0.00 -1.01 0.00 0.00 64.21 63.66 2afa n SER 224 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2afa n GLN 225 N -1.38 2.54 -3.44 1.43 1.13 -1.26 -4.97 117.38 111.43 2afa n GLN 225 Ca 0.00 -2.75 -0.25 0.00 -1.94 0.00 0.00 57.00 52.06 2afa n GLN 225 Cb 0.09 -1.74 0.03 0.00 0.11 0.00 0.00 30.24 28.73 2afa n GLN 225 CO 0.00 0.00 0.00 0.91 -1.44 0.00 0.00 177.06 176.53 2afa n TRP 226 N -0.70 -2.11 -3.68 1.08 7.02 0.91 -4.99 117.44 114.98 2afa n TRP 226 Ca 0.20 0.67 -0.37 0.00 -1.02 0.00 0.00 57.50 56.98 2afa n TRP 226 Cb 0.82 -3.94 -0.07 0.00 -2.42 0.00 0.00 31.31 25.70 2afa n TRP 226 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 2afa s ASN 227 N -2.94 6.43 0.12 -0.99 0.01 -1.26 -4.85 114.94 111.47 2afa s ASN 227 Ca 0.47 0.51 -0.31 0.00 -0.71 0.00 0.00 52.86 52.82 2afa s ASN 227 Cb -0.23 -2.14 -0.10 0.00 0.41 0.00 0.00 41.25 39.19 2afa s ASN 227 CO 0.58 0.25 1.79 -2.84 -1.51 0.00 0.00 177.10 175.36 2afa s PRO 228 N -0.26 4.15 -0.94 -0.60 0.02 -1.26 -2.15 135.00 133.97 2afa s PRO 228 Ca 0.15 2.54 -0.01 0.00 0.02 0.00 0.00 61.00 63.71 2afa s PRO 228 Cb -0.13 -3.55 0.30 0.00 0.02 0.00 0.00 34.50 31.14 2afa s PRO 228 CO 0.04 -0.81 1.34 -0.89 -0.33 0.00 0.00 177.00 176.35 2afa n ILE 229 N 4.67 4.66 -0.35 2.83 2.08 -0.11 -4.88 119.36 128.26 2afa n ILE 229 Ca 0.17 -5.77 0.25 0.00 0.56 0.00 0.00 62.75 57.96 2afa n ILE 229 Cb 0.38 -1.94 0.52 0.00 -0.75 0.00 0.00 39.64 37.86 2afa n ILE 229 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 2afa h ARG 230 N 4.75 0.33 0.00 0.38 2.47 -1.92 0.27 114.38 120.66 2afa h ARG 230 Ca 0.25 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.95 2afa h ARG 230 Cb 0.56 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.81 2afa h ARG 230 CO 1.16 0.22 0.00 -3.47 0.56 0.00 0.00 179.97 178.44 2afa n ASP 231 N -4.69 0.00 -4.67 7.04 -0.08 -1.26 -4.58 116.55 108.30 2afa n ASP 231 Ca 0.28 -1.23 -0.46 0.00 -1.51 0.00 0.00 54.79 51.87 2afa n ASP 231 Cb 0.98 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 44.40 2afa n ASP 231 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2afa n TYR 232 N -0.88 2.30 -1.26 -0.67 9.36 0.08 -1.48 117.16 124.62 2afa n TYR 232 Ca 0.18 0.19 -0.09 0.00 3.32 0.00 0.00 57.90 61.50 2afa n TYR 232 Cb 0.08 -2.58 -0.04 0.00 -0.63 0.00 0.00 39.34 36.17 2afa n TYR 232 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 2afa n ASN 233 N 4.22 -5.42 0.31 2.98 3.02 -1.26 -4.33 115.26 114.78 2afa n ASN 233 Ca 0.18 0.22 0.19 0.00 -0.03 0.00 0.00 54.58 55.14 2afa n ASN 233 Cb 0.29 -3.71 1.05 0.00 -0.61 0.00 0.00 39.78 36.80 2afa n ASN 233 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2afa h LYS 234 N 0.07 0.00 0.00 3.52 3.64 -1.60 -3.00 116.57 119.19 2afa h LYS 234 Ca -0.18 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 2afa h LYS 234 Cb 1.03 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 2afa h LYS 234 CO 0.27 0.00 -0.02 -0.44 -2.27 0.00 0.00 179.45 176.99 2afa h ASP 235 N 0.00 0.00 -2.71 4.20 3.32 -1.88 -3.47 116.42 115.87 2afa h ASP 235 Ca 0.01 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 2afa h ASP 235 Cb 0.07 0.00 0.18 0.00 0.22 0.00 0.00 39.33 39.80 2afa h ASP 235 CO -0.00 0.27 -0.62 0.59 -1.72 0.00 0.00 179.24 177.76 2afa n ASN 236 N -3.42 -1.82 -3.59 6.45 5.03 -1.14 -4.98 115.26 111.79 2afa n ASN 236 Ca -0.00 0.69 0.00 0.00 0.87 0.00 0.00 54.58 56.14 2afa n ASN 236 Cb 0.01 -1.08 0.00 0.00 -1.02 0.00 0.00 39.78 37.69 2afa n ASN 236 CO 0.00 0.00 0.00 -2.65 -1.83 0.00 0.00 177.26 172.78 2afa n PRO 237 N 0.34 -0.21 -0.01 3.52 -0.02 -1.26 -4.68 135.00 132.67 2afa n PRO 237 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 2afa n PRO 237 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.96 2afa n PRO 237 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2afa n ALA 238 N -3.00 1.81 -1.58 3.55 0.00 -1.26 -4.79 120.51 115.24 2afa n ALA 238 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 53.44 52.86 2afa n ALA 238 Cb 0.00 -1.06 -0.09 0.00 0.00 0.00 0.00 19.45 18.30 2afa n ALA 238 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2afa n HIS 239 N 0.95 1.74 -0.28 0.00 8.25 -1.26 -4.83 115.22 119.80 2afa n HIS 239 Ca 0.00 0.63 -0.05 0.00 -0.26 0.00 0.00 57.72 58.04 2afa n HIS 239 Cb 0.14 -2.40 0.06 0.00 1.12 0.00 0.00 29.99 28.90 2afa n HIS 239 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2afa h ARG 240 N 8.26 1.06 -6.07 -0.41 3.08 -1.98 -3.10 114.38 115.23 2afa h ARG 240 Ca -0.35 -0.13 -0.57 0.00 0.07 0.00 0.00 59.98 59.00 2afa h ARG 240 Cb 1.35 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 2afa h ARG 240 CO 1.00 0.80 1.41 0.12 -1.07 0.00 0.00 179.97 182.23 2afa s PHE 241 N -5.81 1.43 -1.30 3.04 5.36 -1.26 -1.97 117.98 117.47 2afa s PHE 241 Ca -0.13 0.67 -0.04 0.00 -0.96 0.00 0.00 56.93 56.47 2afa s PHE 241 Cb 0.15 -3.99 0.01 0.00 -0.34 0.00 0.00 43.02 38.86 2afa s PHE 241 CO 0.80 -3.43 1.01 0.54 -1.46 0.00 0.00 175.22 172.69 2afa n ARG 242 N 8.67 -6.71 -1.64 10.12 1.74 -1.26 -4.89 116.66 122.69 2afa n ARG 242 Ca 0.27 0.79 -0.44 0.00 -0.77 0.00 0.00 57.85 57.70 2afa n ARG 242 Cb 0.47 -5.74 -0.01 0.00 -1.02 0.00 0.00 32.46 26.16 2afa n ARG 242 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2afa n ALA 243 N -4.49 0.50 -1.75 7.54 0.00 -0.83 -4.79 120.51 116.70 2afa n ALA 243 Ca -0.16 0.38 -0.39 0.00 0.00 0.00 0.00 53.44 53.26 2afa n ALA 243 Cb 0.62 -2.14 0.04 0.00 0.00 0.00 0.00 19.45 17.97 2afa n ALA 243 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2afa n TYR 244 N 0.37 2.39 -3.16 0.00 9.36 -1.26 -4.74 117.16 120.12 2afa n TYR 244 Ca 0.08 0.44 0.00 0.00 3.32 0.00 0.00 57.90 61.73 2afa n TYR 244 Cb 0.34 -2.39 0.00 0.00 -0.63 0.00 0.00 39.34 36.66 2afa n TYR 244 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2afa n GLY 245 N 0.71 -0.44 3.44 2.98 0.00 -1.26 -4.74 105.19 105.88 2afa n GLY 245 Ca 0.09 -1.28 -0.33 0.00 0.00 0.00 0.00 46.02 44.50 2afa n GLY 245 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2afa s GLY 246 N 0.00 1.50 -0.47 -0.02 0.00 0.16 -4.63 107.32 103.86 2afa s GLY 246 Ca 0.00 -0.98 -0.05 0.00 0.00 0.00 0.00 44.72 43.69 2afa s GLY 246 CO 0.00 -0.70 0.29 -1.08 0.00 0.00 0.00 173.10 171.61 2afa s THR 247 N -0.55 3.63 0.33 0.90 -1.32 -1.26 0.47 115.64 117.84 2afa s THR 247 Ca 0.08 -2.16 0.12 0.00 -1.21 0.00 0.00 61.69 58.52 2afa s THR 247 Cb -0.11 -3.44 0.34 0.00 -1.51 0.00 0.00 72.50 67.78 2afa s THR 247 CO 0.01 -0.75 1.62 -0.65 -2.21 0.00 0.00 174.62 172.64 2afa h PRO 248 N 7.96 0.16 -0.91 7.08 0.11 -1.86 -1.64 132.00 142.91 2afa h PRO 248 Ca -0.13 -0.01 0.20 0.00 0.11 0.00 0.00 66.00 66.18 2afa h PRO 248 Cb 1.04 -0.04 -0.11 0.00 0.11 0.00 0.00 31.00 32.00 2afa h PRO 248 CO 0.74 0.11 0.45 0.78 -0.21 0.00 0.00 178.00 179.87 2afa h GLY 249 N 0.17 1.57 1.36 -0.55 0.00 -1.86 0.27 103.07 104.02 2afa h GLY 249 Ca 0.71 -0.23 -0.08 0.00 0.00 0.00 0.00 47.33 47.74 2afa h GLY 249 CO -0.70 -0.18 -0.05 0.45 0.00 0.00 0.00 176.54 176.06 2afa h HIS 250 N 0.52 0.84 -0.04 5.60 3.86 -1.68 -2.38 115.15 121.86 2afa h HIS 250 Ca 0.55 -0.13 0.00 0.00 -1.16 0.00 0.00 60.37 59.63 2afa h HIS 250 Cb 0.96 -0.22 -0.00 0.00 1.06 0.00 0.00 27.41 29.21 2afa h HIS 250 CO -0.09 0.80 0.01 -1.49 0.86 0.00 0.00 177.93 178.02 2afa h TRP 251 N 0.72 0.02 -0.13 2.45 6.55 -0.55 -0.69 115.95 124.32 2afa h TRP 251 Ca 0.13 0.00 -0.07 0.00 0.95 0.00 0.00 58.89 59.90 2afa h TRP 251 Cb 0.50 -0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.79 2afa h TRP 251 CO 0.03 0.01 -0.26 0.97 -1.05 0.00 0.00 178.44 178.14 2afa h ILE 252 N 0.03 1.24 -0.32 1.49 2.10 -1.31 -2.45 117.51 118.29 2afa h ILE 252 Ca 0.02 -1.12 -0.03 0.00 1.08 0.00 0.00 64.86 64.81 2afa h ILE 252 Cb 0.01 1.43 -0.01 0.00 -1.09 0.00 0.00 36.82 37.16 2afa h ILE 252 CO -0.02 0.34 0.09 -0.08 -1.08 0.00 0.00 178.15 177.40 2afa h GLU 253 N 0.20 0.51 -0.87 2.19 4.81 -0.89 -2.21 114.58 118.32 2afa h GLU 253 Ca 0.03 -0.12 0.08 0.00 -0.13 0.00 0.00 59.36 59.23 2afa h GLU 253 Cb 0.57 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.82 2afa h GLU 253 CO 0.04 0.56 0.57 -1.49 -0.73 0.00 0.00 179.01 177.96 2afa h TRP 254 N 0.36 0.95 -0.22 0.92 4.06 -0.74 -1.75 115.95 119.54 2afa h TRP 254 Ca 0.10 0.03 0.05 0.00 2.06 0.00 0.00 58.89 61.13 2afa h TRP 254 Cb 0.27 -0.31 -0.05 0.00 -1.00 0.00 0.00 29.16 28.08 2afa h TRP 254 CO 0.01 0.46 -0.09 0.78 -3.56 0.00 0.00 178.44 176.04 2afa h GLY 255 N 0.90 0.10 0.90 1.49 0.00 -0.95 -2.75 103.07 102.76 2afa h GLY 255 Ca 0.39 0.12 -0.03 0.00 0.00 0.00 0.00 47.33 47.82 2afa h GLY 255 CO -0.16 -0.12 0.08 -0.09 0.00 0.00 0.00 176.54 176.25 2afa h ARG 256 N -0.06 0.47 -1.14 4.80 2.43 -1.13 -2.81 114.38 116.94 2afa h ARG 256 Ca 0.12 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2afa h ARG 256 Cb 0.24 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 2afa h ARG 256 CO -0.26 0.53 0.00 1.28 -1.51 0.00 0.00 179.97 180.01 2afa n LEU 257 N -4.68 0.00 0.00 3.80 4.77 -0.74 -1.40 117.00 118.75 2afa n LEU 257 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 2afa n LEU 257 Cb 0.18 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2afa n LEU 257 CO 0.37 0.00 0.00 0.18 -1.33 0.00 0.00 177.39 176.61 2afa n LEU 259 N 0.65 0.00 -0.10 2.23 4.77 -1.06 -1.95 117.00 121.55 2afa n LEU 259 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 2afa n LEU 259 Cb 0.00 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 2afa n LEU 259 CO 0.00 0.00 0.59 0.45 -1.33 0.00 0.00 177.39 177.10 2afa h HIS 260 N 0.00 1.01 -0.64 -1.77 3.86 -1.51 -0.14 115.15 115.96 2afa h HIS 260 Ca 0.00 -0.29 -0.07 0.00 -1.16 0.00 0.00 60.37 58.85 2afa h HIS 260 Cb 0.00 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.23 2afa h HIS 260 CO 0.00 1.08 0.12 1.25 0.86 0.00 0.00 177.93 181.23 2afa h LEU 261 N 0.71 1.00 -0.00 2.43 6.46 -1.66 -0.72 115.31 123.53 2afa h LEU 261 Ca 0.07 -0.25 0.01 0.00 -0.12 0.00 0.00 57.88 57.58 2afa h LEU 261 Cb 0.92 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.57 2afa h LEU 261 CO 0.08 1.00 -0.06 -0.74 -0.62 0.00 0.00 178.44 178.10 2afa h HIS 262 N 0.96 -0.16 -0.65 1.25 2.76 -1.75 -2.43 115.15 115.14 2afa h HIS 262 Ca 0.20 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.39 2afa h HIS 262 Cb 0.42 0.07 -0.04 0.00 1.55 0.00 0.00 27.41 29.41 2afa h HIS 262 CO 0.03 -0.10 0.42 0.00 -1.30 0.00 0.00 177.93 176.98 2afa h ALA 263 N 0.88 0.84 -0.28 5.26 0.00 -0.73 -1.52 119.26 123.71 2afa h ALA 263 Ca 0.03 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2afa h ALA 263 Cb 0.14 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2afa h ALA 263 CO -0.07 0.22 0.07 0.00 0.00 0.00 0.00 179.25 179.48 2afa h ALA 264 N 1.25 0.30 -0.52 0.00 0.00 -0.92 0.12 119.26 119.50 2afa h ALA 264 Ca 0.25 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 2afa h ALA 264 Cb -0.06 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2afa h ALA 264 CO -0.07 -0.34 0.25 -0.07 0.00 0.00 0.00 179.25 179.02 2afa h LEU 265 N 0.19 0.68 -0.94 0.00 3.38 -1.18 -2.38 115.31 115.06 2afa h LEU 265 Ca 0.13 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.98 2afa h LEU 265 Cb 0.11 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 2afa h LEU 265 CO -0.15 0.62 0.62 -0.33 0.09 0.00 0.00 178.44 179.29 2afa h GLU 266 N 0.69 1.22 -0.89 1.13 5.08 -0.82 -1.17 114.58 119.82 2afa h GLU 266 Ca 0.18 -0.07 0.09 0.00 -1.00 0.00 0.00 59.36 58.56 2afa h GLU 266 Cb 0.12 -0.28 -0.06 0.00 0.50 0.00 0.00 28.75 29.03 2afa h GLU 266 CO -0.02 0.81 0.57 0.00 -1.00 0.00 0.00 179.01 179.37 2afa h ALA 267 N 1.35 1.63 -0.69 3.43 0.00 -0.25 -0.75 119.26 123.98 2afa h ALA 267 Ca 0.35 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.89 2afa h ALA 267 Cb -0.12 -0.21 -0.21 0.00 0.00 0.00 0.00 17.79 17.24 2afa h ALA 267 CO -0.08 0.20 0.45 2.89 0.00 0.00 0.00 179.25 182.71 2afa n ARG 268 N -4.52 1.86 -2.98 0.00 1.85 -1.00 -4.87 116.66 106.99 2afa n ARG 268 Ca 0.15 -2.07 -0.21 0.00 -1.00 0.00 0.00 57.85 54.72 2afa n ARG 268 Cb 0.29 -1.81 0.02 0.00 -1.05 0.00 0.00 32.46 29.91 2afa n ARG 268 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2afa n PHE 269 N -0.63 -1.77 -3.97 2.89 3.01 -0.29 -4.99 117.46 111.72 2afa n PHE 269 Ca 0.41 0.40 -0.35 0.00 1.01 0.00 0.00 57.45 58.92 2afa n PHE 269 Cb 1.31 -3.88 -0.14 0.00 -0.01 0.00 0.00 39.48 36.76 2afa n PHE 269 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 2afa s GLU 270 N -5.64 3.37 -0.19 -1.08 2.12 -0.48 -5.02 118.70 111.79 2afa s GLU 270 Ca 0.26 -0.63 -0.29 0.00 0.36 0.00 0.00 54.97 54.68 2afa s GLU 270 Cb -0.13 -2.98 -0.05 0.00 0.26 0.00 0.00 34.13 31.24 2afa s GLU 270 CO 0.33 -0.17 1.98 0.99 -0.54 0.00 0.00 175.26 177.85 2afa s THR 271 N 1.39 3.23 0.54 -1.70 2.01 -1.26 -3.22 115.64 116.62 2afa s THR 271 Ca 0.05 0.24 -0.19 0.00 0.31 0.00 0.00 61.69 62.10 2afa s THR 271 Cb -0.14 -3.26 -0.06 0.00 0.01 0.00 0.00 72.50 69.05 2afa s THR 271 CO -0.03 -0.13 1.10 -2.16 -0.69 0.00 0.00 174.62 172.71 2afa s PRO 272 N 5.54 3.44 0.24 4.92 0.04 -1.26 -4.97 135.00 142.95 2afa s PRO 272 Ca 0.89 1.50 -0.31 0.00 0.04 0.00 0.00 61.00 63.11 2afa s PRO 272 Cb -0.31 -2.03 -0.13 0.00 0.04 0.00 0.00 34.50 32.06 2afa s PRO 272 CO 0.35 -0.76 1.45 -2.30 0.04 0.00 0.00 177.00 175.78 2afa n PRO 273 N -1.33 2.13 0.32 0.56 -0.02 -1.26 -4.86 135.00 130.53 2afa n PRO 273 Ca 0.11 0.76 0.21 0.00 -2.02 0.00 0.00 63.50 62.55 2afa n PRO 273 Cb 0.52 -2.44 1.07 0.00 -0.02 0.00 0.00 33.50 32.62 2afa n PRO 273 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2afa h ALA 274 N 4.47 1.06 0.00 3.55 0.00 -2.03 -2.91 119.26 123.40 2afa h ALA 274 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2afa h ALA 274 Cb 1.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2afa h ALA 274 CO 0.78 0.01 0.00 0.11 0.00 0.00 0.00 179.25 180.15 2afa h TRP 275 N 0.00 0.00 -0.13 0.00 5.08 -1.98 -2.61 115.95 116.31 2afa h TRP 275 Ca -0.00 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.97 2afa h TRP 275 Cb 0.12 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.28 2afa h TRP 275 CO 0.00 0.00 0.07 -0.07 -1.28 0.00 0.00 178.44 177.16 2afa h LEU 276 N 0.00 0.17 -0.30 0.11 3.38 -1.90 0.74 115.31 117.51 2afa h LEU 276 Ca 0.00 -0.09 -0.19 0.00 0.09 0.00 0.00 57.88 57.69 2afa h LEU 276 Cb 0.74 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2afa h LEU 276 CO 0.00 0.21 -0.62 0.25 0.09 0.00 0.00 178.44 178.37 2afa h LEU 277 N 0.11 0.89 0.23 1.67 5.85 -1.76 -1.99 115.31 120.31 2afa h LEU 277 Ca 0.05 -0.51 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 2afa h LEU 277 Cb 0.08 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.85 2afa h LEU 277 CO -0.01 1.29 -0.11 -0.33 -0.34 0.00 0.00 178.44 178.95 2afa h GLU 278 N 0.58 -0.30 0.00 1.25 5.08 -1.33 -1.64 114.58 118.23 2afa h GLU 278 Ca -0.01 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2afa h GLU 278 Cb 1.22 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.53 2afa h GLU 278 CO 0.13 -0.19 -0.10 -0.44 -1.00 0.00 0.00 179.01 177.40 2afa h ASP 279 N -0.32 0.00 0.09 1.42 3.32 -0.90 -1.06 116.42 118.98 2afa h ASP 279 Ca -0.03 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 2afa h ASP 279 Cb 0.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2afa h ASP 279 CO 0.05 0.10 -0.04 0.00 -1.72 0.00 0.00 179.24 177.63 2afa h ALA 280 N 1.90 -0.12 -0.70 3.45 0.00 -0.86 -0.65 119.26 122.26 2afa h ALA 280 Ca -0.00 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.73 2afa h ALA 280 Cb 0.47 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2afa h ALA 280 CO 0.01 -0.37 0.45 0.87 0.00 0.00 0.00 179.25 180.22 2afa h LYS 281 N -0.52 0.88 -0.22 0.00 1.57 -1.00 -1.57 116.57 115.71 2afa h LYS 281 Ca -0.01 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.75 2afa h LYS 281 Cb 0.43 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.51 2afa h LYS 281 CO 0.02 0.58 0.00 0.78 -0.57 0.00 0.00 179.45 180.27 2afa h GLY 282 N 0.91 0.22 1.59 3.86 0.00 -1.09 -0.67 103.07 107.89 2afa h GLY 282 Ca 0.27 0.02 -0.07 0.00 0.00 0.00 0.00 47.33 47.55 2afa h GLY 282 CO -0.08 -0.04 -0.12 1.41 0.00 0.00 0.00 176.54 177.71 2afa h LEU 283 N 0.07 0.48 0.40 3.11 3.38 -0.82 -1.26 115.31 120.68 2afa h LEU 283 Ca 0.11 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2afa h LEU 283 Cb 0.13 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2afa h LEU 283 CO -0.18 0.64 -0.19 0.15 0.09 0.00 0.00 178.44 178.95 2afa h PHE 284 N 0.46 -0.50 -0.28 1.13 3.57 -0.78 -1.87 116.94 118.67 2afa h PHE 284 Ca 0.09 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.61 2afa h PHE 284 Cb 0.49 0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.36 2afa h PHE 284 CO 0.02 -0.22 0.07 1.25 -2.23 0.00 0.00 178.31 177.20 2afa h HIS 285 N -0.72 0.12 -0.64 0.41 2.76 -1.02 -2.27 115.15 113.78 2afa h HIS 285 Ca -0.06 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.18 2afa h HIS 285 Cb 0.51 -0.01 -0.04 0.00 1.55 0.00 0.00 27.41 29.42 2afa h HIS 285 CO -0.01 0.04 0.43 0.00 -1.30 0.00 0.00 177.93 177.09 2afa h ALA 286 N 1.20 1.72 -0.44 5.26 0.00 -1.21 0.18 119.26 125.98 2afa h ALA 286 Ca 0.13 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 2afa h ALA 286 Cb 0.12 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2afa h ALA 286 CO -0.16 0.19 -0.12 1.15 0.00 0.00 0.00 179.25 180.31 2afa h THR 287 N 0.69 1.27 -0.15 0.00 2.02 -0.77 -2.06 112.91 113.93 2afa h THR 287 Ca 0.27 -1.24 -0.08 0.00 0.77 0.00 0.00 66.41 66.13 2afa h THR 287 Cb 0.19 1.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2afa h THR 287 CO -0.08 0.42 -0.23 0.40 0.37 0.00 0.00 175.52 176.40 2afa h ILE 288 N 0.68 1.36 -0.21 3.11 2.04 -1.03 0.38 117.51 123.85 2afa h ILE 288 Ca 0.11 -1.47 0.04 0.00 1.00 0.00 0.00 64.86 64.54 2afa h ILE 288 Cb 0.66 1.97 -0.07 0.00 -0.74 0.00 0.00 36.82 38.64 2afa h ILE 288 CO 0.05 0.43 -0.49 -0.09 0.00 0.00 0.00 178.15 178.05 2afa h ARG 289 N 0.03 -0.48 0.00 2.37 2.43 -0.57 -1.64 114.38 116.52 2afa h ARG 289 Ca 0.01 0.03 -0.18 0.00 -0.81 0.00 0.00 59.98 59.03 2afa h ARG 289 Cb 0.81 0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 30.43 2afa h ARG 289 CO 0.05 -0.32 -1.43 -0.44 -1.51 0.00 0.00 179.97 176.32 2afa h ASP 290 N -0.50 0.00 0.00 -3.80 3.32 -1.47 -3.43 116.42 110.54 2afa h ASP 290 Ca 0.07 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 2afa h ASP 290 Cb 0.64 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 2afa h ASP 290 CO -0.47 0.62 -1.65 0.00 -1.72 0.00 0.00 179.24 176.02 2afa n ALA 291 N -2.41 2.38 -2.63 3.45 0.00 0.11 -4.72 120.51 116.70 2afa n ALA 291 Ca -0.10 -0.39 -0.42 0.00 0.00 0.00 0.00 53.44 52.53 2afa n ALA 291 Cb 0.86 -0.40 -0.05 0.00 0.00 0.00 0.00 19.45 19.87 2afa n ALA 291 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2afa s TRP 292 N -2.84 3.26 -1.22 0.00 -0.11 -0.62 -1.98 118.94 115.43 2afa s TRP 292 Ca -0.05 1.00 -0.35 0.00 1.22 0.00 0.00 56.10 57.92 2afa s TRP 292 Cb 0.08 -3.12 0.05 0.00 -1.50 0.00 0.00 33.47 28.98 2afa s TRP 292 CO 0.55 -0.47 0.68 0.00 -4.62 0.00 0.00 176.95 173.10 2afa n ALA 293 N 6.09 -2.62 1.11 5.86 0.00 0.24 -4.88 120.51 126.32 2afa n ALA 293 Ca 0.05 -0.60 0.12 0.00 0.00 0.00 0.00 53.44 53.01 2afa n ALA 293 Cb 0.48 -2.61 0.18 0.00 0.00 0.00 0.00 19.45 17.51 2afa n ALA 293 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2afa n PRO 294 N -5.09 0.73 -2.15 0.00 -0.04 -1.26 -4.46 135.00 122.74 2afa n PRO 294 Ca -0.11 -0.51 -0.21 0.00 -0.04 0.00 0.00 63.50 62.62 2afa n PRO 294 Cb 0.56 -1.49 0.02 0.00 -0.04 0.00 0.00 33.50 32.55 2afa n PRO 294 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2afa n ASP 295 N -0.69 4.51 0.00 3.54 5.68 -1.26 -4.95 116.55 123.38 2afa n ASP 295 Ca 0.09 -3.55 0.00 0.00 -0.50 0.00 0.00 54.79 50.84 2afa n ASP 295 Cb 0.38 -0.37 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 2afa n ASP 295 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2afa n GLY 296 N -0.68 0.69 3.11 6.12 0.00 -1.26 -5.01 105.19 108.17 2afa n GLY 296 Ca 0.39 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.30 2afa n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2afa s ALA 297 N -2.88 -0.31 0.83 4.61 0.00 -1.26 -5.15 121.76 117.58 2afa s ALA 297 Ca 0.00 -0.16 -0.11 0.00 0.00 0.00 0.00 51.96 51.69 2afa s ALA 297 Cb 0.00 0.13 0.09 0.00 0.00 0.00 0.00 23.12 23.34 2afa s ALA 297 CO 0.00 -0.22 1.10 -0.51 0.00 0.00 0.00 175.76 176.13 2afa s ASP 298 N -1.46 3.94 0.00 0.00 1.01 -1.26 -4.03 116.67 114.87 2afa s ASP 298 Ca -0.14 1.85 0.00 0.00 0.71 0.00 0.00 52.55 54.97 2afa s ASP 298 Cb -0.07 -2.48 0.00 0.00 1.01 0.00 0.00 42.92 41.38 2afa s ASP 298 CO 0.01 -2.40 0.00 0.61 0.21 0.00 0.00 175.17 173.60 2afa n GLY 299 N -0.85 2.53 3.68 0.21 0.00 -1.26 -4.79 105.19 104.71 2afa n GLY 299 Ca 0.09 -2.03 -0.35 0.00 0.00 0.00 0.00 46.02 43.73 2afa n GLY 299 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2afa s PHE 300 N -2.47 3.34 0.69 1.61 0.40 -1.26 -0.59 117.98 119.70 2afa s PHE 300 Ca 0.00 0.22 -0.12 0.00 -0.60 0.00 0.00 56.93 56.44 2afa s PHE 300 Cb 0.00 -2.17 0.00 0.00 0.51 0.00 0.00 43.02 41.36 2afa s PHE 300 CO 0.00 0.18 1.06 0.14 0.70 0.00 0.00 175.22 177.30 2afa s VAL 301 N 0.59 3.94 -0.10 -0.44 -7.23 -0.84 -4.39 120.40 111.93 2afa s VAL 301 Ca 0.07 0.67 -0.14 0.00 -1.81 0.00 0.00 61.98 60.77 2afa s VAL 301 Cb -0.12 -3.36 -0.12 0.00 0.56 0.00 0.00 36.38 33.34 2afa s VAL 301 CO 0.00 -0.78 0.42 0.22 -0.31 0.00 0.00 175.10 174.65 2afa h TYR 302 N -0.57 -0.05 -2.69 2.82 3.20 -1.14 -3.45 116.97 115.09 2afa h TYR 302 Ca -0.44 -0.00 -0.60 0.00 3.14 0.00 0.00 58.73 60.83 2afa h TYR 302 Cb 1.21 0.02 -0.16 0.00 1.54 0.00 0.00 36.73 39.34 2afa h TYR 302 CO 0.61 0.38 -0.78 -1.54 -1.64 0.00 0.00 178.16 175.19 2afa s SER 303 N -5.75 3.33 0.04 -2.11 1.04 -1.03 -3.81 113.70 105.40 2afa s SER 303 Ca -0.09 -0.96 -0.08 0.00 0.48 0.00 0.00 55.95 55.30 2afa s SER 303 Cb -0.01 -0.25 -0.00 0.00 0.10 0.00 0.00 66.02 65.86 2afa s SER 303 CO 0.32 0.03 0.15 0.54 0.98 0.00 0.00 173.24 175.27 2afa s VAL 304 N -2.26 0.12 0.70 5.02 0.11 0.18 -1.17 120.40 123.08 2afa s VAL 304 Ca 0.25 -0.96 0.00 0.00 -2.93 0.00 0.00 61.98 58.34 2afa s VAL 304 Cb -0.05 -0.87 0.12 0.00 -1.53 0.00 0.00 36.38 34.04 2afa s VAL 304 CO 0.12 -0.53 0.96 1.51 -3.33 0.00 0.00 175.10 173.83 2afa s ASP 306 N -2.05 4.48 0.00 3.54 1.47 -0.23 0.39 116.67 124.27 2afa s ASP 306 Ca -0.06 -0.36 0.03 0.00 1.18 0.00 0.00 52.55 53.35 2afa s ASP 306 Cb -0.02 -0.08 0.15 0.00 -0.34 0.00 0.00 42.92 42.64 2afa s ASP 306 CO -0.04 -1.76 0.93 0.79 0.68 0.00 0.00 175.17 175.77 2afa n TRP 307 N -2.75 0.00 1.00 2.11 5.03 -1.26 -0.12 117.44 121.44 2afa n TRP 307 Ca 0.14 0.00 0.10 0.00 3.03 0.00 0.00 57.50 60.78 2afa n TRP 307 Cb 0.61 -0.30 -0.08 0.00 -1.03 0.00 0.00 31.31 30.50 2afa n TRP 307 CO 0.00 0.00 0.00 -0.25 -0.03 0.00 0.00 177.69 177.41 2afa n ASP 308 N -1.30 1.32 0.00 -0.99 8.00 -1.26 -4.96 116.55 117.36 2afa n ASP 308 Ca 0.01 -1.16 0.00 0.00 0.71 0.00 0.00 54.79 54.36 2afa n ASP 308 Cb 0.03 0.84 0.00 0.00 -0.02 0.00 0.00 41.12 41.97 2afa n ASP 308 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2afa n GLY 309 N 1.47 0.78 3.76 0.44 0.00 0.82 -5.06 105.19 107.41 2afa n GLY 309 Ca 0.06 -0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2afa n GLY 309 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2afa s LYS 310 N -0.61 4.36 0.51 1.61 2.20 -1.26 -4.72 119.74 121.84 2afa s LYS 310 Ca 0.00 0.82 -0.23 0.00 -0.36 0.00 0.00 55.97 56.21 2afa s LYS 310 Cb 0.00 -3.34 -0.07 0.00 -1.51 0.00 0.00 37.83 32.91 2afa s LYS 310 CO 0.00 0.35 1.29 -2.30 -0.36 0.00 0.00 175.35 174.33 2afa n PRO 311 N 2.72 1.71 0.00 4.03 -0.02 -1.26 -1.07 135.00 141.11 2afa n PRO 311 Ca -0.06 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2afa n PRO 311 Cb 0.51 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 2afa n PRO 311 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2afa n ILE 312 N -0.79 0.00 -3.02 4.25 5.41 -0.32 -4.80 119.36 120.08 2afa n ILE 312 Ca 0.09 0.03 -0.42 0.00 1.00 0.00 0.00 62.75 63.46 2afa n ILE 312 Cb 0.43 -0.78 -0.06 0.00 -0.71 0.00 0.00 39.64 38.52 2afa n ILE 312 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2afa s VAL 313 N -0.41 4.82 -2.56 1.39 1.01 -1.22 -4.92 120.40 118.51 2afa s VAL 313 Ca 0.00 0.84 0.25 0.00 0.00 0.00 0.00 61.98 63.07 2afa s VAL 313 Cb 0.00 -4.13 0.43 0.00 0.00 0.00 0.00 36.38 32.68 2afa s VAL 313 CO 0.00 -0.32 1.55 0.54 0.00 0.00 0.00 175.10 176.86 2afa n ARG 314 N 6.19 1.93 -1.96 2.72 1.74 -1.26 -1.51 116.66 124.51 2afa n ARG 314 Ca 0.01 -1.37 -0.39 0.00 -0.77 0.00 0.00 57.85 55.34 2afa n ARG 314 Cb 0.48 -1.46 0.01 0.00 -1.02 0.00 0.00 32.46 30.48 2afa n ARG 314 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2afa s GLU 315 N -1.89 3.60 -0.63 5.56 8.01 -1.26 -4.23 118.70 127.85 2afa s GLU 315 Ca 0.34 2.15 -0.20 0.00 0.01 0.00 0.00 54.97 57.28 2afa s GLU 315 Cb 0.20 -2.50 0.10 0.00 -4.31 0.00 0.00 34.13 27.62 2afa s GLU 315 CO 0.31 -0.80 0.79 1.03 0.01 0.00 0.00 175.26 176.60 2afa s ARG 316 N -2.60 3.10 0.34 1.61 3.00 -0.77 -2.92 118.95 120.72 2afa s ARG 316 Ca 0.64 -1.27 -0.16 0.00 0.00 0.00 0.00 55.73 54.95 2afa s ARG 316 Cb -0.38 -4.30 -0.09 0.00 0.00 0.00 0.00 34.95 30.18 2afa s ARG 316 CO 0.47 -1.61 0.77 0.08 0.00 0.00 0.00 175.30 175.01 2afa s VAL 317 N 2.93 4.64 0.04 3.52 1.01 -1.26 0.22 120.40 131.50 2afa s VAL 317 Ca 0.15 1.01 -0.28 0.00 0.00 0.00 0.00 61.98 62.86 2afa s VAL 317 Cb -0.21 -3.62 -0.16 0.00 0.00 0.00 0.00 36.38 32.40 2afa s VAL 317 CO 0.06 -0.23 1.32 -0.09 0.00 0.00 0.00 175.10 176.16 2afa h ARG 318 N 2.13 -0.97 -0.99 2.72 2.43 -1.11 -3.33 114.38 115.26 2afa h ARG 318 Ca -0.48 0.07 0.25 0.00 -0.81 0.00 0.00 59.98 59.01 2afa h ARG 318 Cb 1.18 0.22 -0.07 0.00 -0.42 0.00 0.00 29.97 30.87 2afa h ARG 318 CO 0.65 -0.65 0.66 0.11 -1.51 0.00 0.00 179.97 179.22 2afa h TRP 319 N -1.10 0.51 -0.11 2.20 5.08 -1.93 -2.83 115.95 117.76 2afa h TRP 319 Ca -0.10 0.02 0.03 0.00 1.08 0.00 0.00 58.89 59.92 2afa h TRP 319 Cb 0.78 -0.15 -0.03 0.00 -3.00 0.00 0.00 29.16 26.75 2afa h TRP 319 CO 0.04 0.08 -0.09 -1.35 -1.28 0.00 0.00 178.44 175.84 2afa h PRO 320 N 0.34 -0.10 -0.05 0.12 0.11 -1.92 0.72 132.00 131.21 2afa h PRO 320 Ca 0.53 0.01 -0.10 0.00 0.11 0.00 0.00 66.00 66.54 2afa h PRO 320 Cb 1.46 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.58 2afa h PRO 320 CO -0.20 -0.07 -0.45 0.97 -0.21 0.00 0.00 178.00 178.04 2afa h ILE 321 N -0.11 1.33 -0.44 4.15 2.10 -1.70 -0.79 117.51 122.06 2afa h ILE 321 Ca 0.08 -1.58 -0.01 0.00 1.08 0.00 0.00 64.86 64.43 2afa h ILE 321 Cb 0.22 1.79 -0.02 0.00 -1.09 0.00 0.00 36.82 37.72 2afa h ILE 321 CO -0.18 0.46 0.25 0.58 -1.08 0.00 0.00 178.15 178.18 2afa h VAL 322 N 0.09 1.15 -0.54 2.19 2.07 -1.27 -2.40 116.25 117.53 2afa h VAL 322 Ca 0.00 -0.36 -0.11 0.00 0.82 0.00 0.00 66.70 67.05 2afa h VAL 322 Cb 0.83 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 2afa h VAL 322 CO 0.06 0.15 -0.11 -0.33 0.02 0.00 0.00 177.57 177.37 2afa h GLU 323 N 0.57 1.03 -1.04 1.57 4.39 -0.57 -2.55 114.58 117.99 2afa h GLU 323 Ca 0.16 -0.38 0.00 0.00 0.34 0.00 0.00 59.36 59.47 2afa h GLU 323 Cb 0.02 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 2afa h GLU 323 CO -0.03 1.08 0.00 0.00 -1.16 0.00 0.00 179.01 178.90 2afa n ALA 324 N -2.50 1.00 0.00 3.43 0.00 -0.33 -0.63 120.51 121.49 2afa n ALA 324 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2afa n ALA 324 Cb 0.40 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.08 2afa n ALA 324 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2afa n GLY 326 N 0.68 0.00 0.24 0.00 0.00 -0.96 -0.54 105.19 104.61 2afa n GLY 326 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 2afa n GLY 326 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2afa h THR 327 N 0.00 1.25 -0.50 2.61 2.02 -1.17 -2.02 112.91 115.11 2afa h THR 327 Ca 0.00 -1.16 0.04 0.00 0.77 0.00 0.00 66.41 66.06 2afa h THR 327 Cb 0.00 1.27 -0.04 0.00 -1.74 0.00 0.00 68.15 67.63 2afa h THR 327 CO 0.00 0.37 0.25 0.00 0.37 0.00 0.00 175.52 176.51 2afa h ALA 328 N 1.36 0.63 -0.15 6.16 0.00 -1.06 -1.02 119.26 125.18 2afa h ALA 328 Ca 0.07 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2afa h ALA 328 Cb 0.59 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2afa h ALA 328 CO 0.04 -0.10 0.10 -0.92 0.00 0.00 0.00 179.25 178.37 2afa h TYR 329 N 0.48 0.20 -0.36 0.00 3.20 -1.69 -0.89 116.97 117.91 2afa h TYR 329 Ca 0.22 0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.12 2afa h TYR 329 Cb 0.13 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.30 2afa h TYR 329 CO -0.10 0.15 0.16 0.00 -1.64 0.00 0.00 178.16 176.73 2afa h ALA 330 N 1.03 0.44 -0.46 1.82 0.00 -0.86 -0.19 119.26 121.04 2afa h ALA 330 Ca 0.06 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2afa h ALA 330 Cb 0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2afa h ALA 330 CO -0.01 -0.22 0.01 -0.07 0.00 0.00 0.00 179.25 178.95 2afa h LEU 331 N 0.33 0.71 -0.10 0.00 3.38 -1.11 -2.34 115.31 116.18 2afa h LEU 331 Ca 0.16 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2afa h LEU 331 Cb 0.10 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 2afa h LEU 331 CO -0.13 0.77 0.06 0.22 0.09 0.00 0.00 178.44 179.45 2afa h TYR 332 N 0.70 0.12 -0.62 1.13 3.20 -0.39 0.17 116.97 121.29 2afa h TYR 332 Ca 0.14 0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.08 2afa h TYR 332 Cb 0.42 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.61 2afa h TYR 332 CO 0.02 0.10 0.41 1.15 -1.64 0.00 0.00 178.16 178.20 2afa h THR 333 N 0.11 0.98 0.00 1.81 2.02 -0.68 0.79 112.91 117.95 2afa h THR 333 Ca 0.03 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.02 2afa h THR 333 Cb 0.01 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 2afa h THR 333 CO -0.01 0.10 -1.15 0.18 0.37 0.00 0.00 175.52 175.01 2afa n LEU 334 N -4.48 0.65 -0.01 2.58 4.77 -0.92 -4.52 117.00 115.07 2afa n LEU 334 Ca 0.09 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 2afa n LEU 334 Cb 0.26 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.28 2afa n LEU 334 CO 0.34 0.12 -0.56 0.35 -1.33 0.00 0.00 177.39 176.31 2afa n THR 335 N -1.80 0.10 -1.01 -5.08 -2.24 0.03 -4.99 114.28 99.29 2afa n THR 335 Ca 0.02 -0.10 -0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2afa n THR 335 Cb 0.41 -0.25 -0.00 0.00 -2.10 0.00 0.00 70.33 68.39 2afa n THR 335 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2afa n ASP 336 N -1.86 -5.14 -4.66 3.42 4.64 0.27 -4.94 116.55 108.29 2afa n ASP 336 Ca -0.03 0.01 -0.43 0.00 -1.38 0.00 0.00 54.79 52.97 2afa n ASP 336 Cb 0.34 -2.68 -0.02 0.00 -1.04 0.00 0.00 41.12 37.72 2afa n ASP 336 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 2afa s ASP 337 N -2.02 7.01 0.61 1.67 -1.08 -1.26 -4.94 116.67 116.66 2afa s ASP 337 Ca 0.00 1.59 0.33 0.00 -0.52 0.00 0.00 52.55 53.95 2afa s ASP 337 Cb 0.00 -2.54 1.91 0.00 -1.46 0.00 0.00 42.92 40.83 2afa s ASP 337 CO 0.00 -0.72 2.21 0.28 0.52 0.00 0.00 175.17 177.47 2afa h SER 338 N 7.89 0.00 -0.69 -0.34 0.02 -1.95 -2.77 113.55 115.72 2afa h SER 338 Ca -0.24 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 60.76 2afa h SER 338 Cb 1.09 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.59 2afa h SER 338 CO 0.97 0.00 0.45 0.06 -1.14 0.00 0.00 176.83 177.17 2afa h GLN 339 N 0.00 0.70 -0.61 3.45 3.07 -2.00 -1.15 115.11 118.58 2afa h GLN 339 Ca 0.03 -0.04 -0.07 0.00 0.09 0.00 0.00 58.65 58.65 2afa h GLN 339 Cb 0.20 -0.16 -0.02 0.00 0.08 0.00 0.00 27.48 27.57 2afa h GLN 339 CO -0.00 0.47 0.08 1.88 0.09 0.00 0.00 178.83 181.35 2afa h TYR 340 N 0.72 1.05 -0.23 0.06 -1.99 -1.81 -1.86 116.97 112.91 2afa h TYR 340 Ca 0.29 -0.14 -0.14 0.00 2.00 0.00 0.00 58.73 60.75 2afa h TYR 340 Cb 0.23 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 38.66 2afa h TYR 340 CO -0.00 0.90 -0.42 1.49 -0.00 0.00 0.00 178.16 180.13 2afa h GLU 341 N 0.93 0.56 -0.66 4.88 4.81 -1.46 -2.01 114.58 121.64 2afa h GLU 341 Ca 0.19 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 2afa h GLU 341 Cb 0.43 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 2afa h GLU 341 CO 0.01 0.88 0.41 0.93 -0.73 0.00 0.00 179.01 180.51 2afa h GLU 342 N 0.46 0.88 -0.36 1.92 5.08 -0.78 -1.59 114.58 120.19 2afa h GLU 342 Ca 0.04 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 2afa h GLU 342 Cb 0.93 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 2afa h GLU 342 CO 0.08 0.61 0.09 -1.49 -1.00 0.00 0.00 179.01 177.31 2afa h TRP 343 N 0.89 0.61 -0.24 4.33 4.06 -1.17 0.53 115.95 124.96 2afa h TRP 343 Ca 0.24 -0.07 0.05 0.00 2.06 0.00 0.00 58.89 61.17 2afa h TRP 343 Cb -0.06 -0.17 -0.05 0.00 -1.00 0.00 0.00 29.16 27.88 2afa h TRP 343 CO -0.02 0.60 -0.11 -0.92 -3.56 0.00 0.00 178.44 174.43 2afa h TYR 344 N 0.44 -0.27 -0.43 0.49 3.20 -1.03 0.48 116.97 119.84 2afa h TYR 344 Ca 0.11 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.96 2afa h TYR 344 Cb 0.30 0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.71 2afa h TYR 344 CO 0.02 -0.17 0.06 1.96 -1.64 0.00 0.00 178.16 178.38 2afa h GLN 345 N -0.08 0.73 -0.54 1.82 4.20 -1.20 -0.59 115.11 119.45 2afa h GLN 345 Ca 0.13 -0.20 0.08 0.00 0.06 0.00 0.00 58.65 58.71 2afa h GLN 345 Cb 0.27 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 27.91 2afa h GLN 345 CO -0.29 0.77 0.19 -0.22 -0.67 0.00 0.00 178.83 178.61 2afa h LYS 346 N 0.58 0.36 -0.09 1.46 3.64 -0.09 -1.27 116.57 121.16 2afa h LYS 346 Ca 0.13 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.38 2afa h LYS 346 Cb 0.40 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2afa h LYS 346 CO 0.01 0.24 -0.41 -1.49 -2.27 0.00 0.00 179.45 175.53 2afa h TRP 347 N 0.37 0.24 -0.53 1.91 6.55 0.23 -2.66 115.95 122.07 2afa h TRP 347 Ca 0.26 -0.06 -0.06 0.00 0.95 0.00 0.00 58.89 59.98 2afa h TRP 347 Cb 0.30 -0.05 -0.02 0.00 -0.86 0.00 0.00 29.16 28.52 2afa h TRP 347 CO -0.17 0.59 0.10 -1.49 -1.05 0.00 0.00 178.44 176.41 2afa h TRP 348 N 0.17 0.92 -0.76 0.49 4.06 -0.15 -0.56 115.95 120.12 2afa h TRP 348 Ca 0.02 -0.12 0.01 0.00 2.06 0.00 0.00 58.89 60.85 2afa h TRP 348 Cb 0.80 -0.25 -0.04 0.00 -1.00 0.00 0.00 29.16 28.67 2afa h TRP 348 CO 0.01 0.82 0.50 -0.44 -3.56 0.00 0.00 178.44 175.77 2afa h ASP 349 N 0.75 0.87 -0.26 -3.49 3.32 -1.08 -1.68 116.42 114.86 2afa h ASP 349 Ca 0.16 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 2afa h ASP 349 Cb 0.39 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2afa h ASP 349 CO 0.01 0.64 0.16 0.22 -1.72 0.00 0.00 179.24 178.54 2afa h TYR 350 N 1.03 0.35 -0.18 4.55 3.20 -1.20 -2.15 116.97 122.57 2afa h TYR 350 Ca 0.28 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.18 2afa h TYR 350 Cb -0.11 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.01 2afa h TYR 350 CO -0.02 0.26 -0.02 0.00 -1.64 0.00 0.00 178.16 176.75 2afa h ILE 352 N 0.03 0.99 0.01 0.00 2.10 -1.30 0.20 117.51 119.55 2afa h ILE 352 Ca 0.09 -1.29 -0.25 0.00 1.08 0.00 0.00 64.86 64.48 2afa h ILE 352 Cb 0.12 1.75 0.01 0.00 -1.09 0.00 0.00 36.82 37.61 2afa h ILE 352 CO -0.16 0.34 -1.02 0.50 -1.08 0.00 0.00 178.15 176.73 2afa h LYS 353 N 0.00 0.56 0.00 2.19 3.64 -0.89 -3.41 116.57 118.66 2afa h LYS 353 Ca -0.00 -0.62 0.00 0.00 -1.27 0.00 0.00 60.65 58.76 2afa h LYS 353 Cb 0.72 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 2afa h LYS 353 CO 0.04 1.23 -0.95 0.66 -2.27 0.00 0.00 179.45 178.17 2afa n TYR 354 N -3.80 0.00 -2.36 1.91 4.02 -0.03 -5.10 117.16 111.80 2afa n TYR 354 Ca -0.09 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.40 2afa n TYR 354 Cb 0.87 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 40.21 2afa n TYR 354 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2afa n LEU 355 N -1.65 7.43 -2.82 7.72 4.77 0.70 -4.87 117.00 128.27 2afa n LEU 355 Ca 0.00 -5.17 0.01 0.00 -0.03 0.00 0.00 56.01 50.82 2afa n LEU 355 Cb 0.22 -1.15 0.01 0.00 -2.33 0.00 0.00 43.42 40.17 2afa n LEU 355 CO 0.00 1.96 0.40 -0.62 -1.33 0.00 0.00 177.39 177.79 2afa s ASP 357 N -1.13 -0.55 0.50 -1.43 -1.08 -0.26 -0.37 116.67 112.35 2afa s ASP 357 Ca 0.44 -0.36 0.29 0.00 -0.52 0.00 0.00 52.55 52.41 2afa s ASP 357 Cb 0.27 0.71 1.05 0.00 -1.46 0.00 0.00 42.92 43.50 2afa s ASP 357 CO -0.22 -0.05 1.87 1.88 0.52 0.00 0.00 175.17 179.17 2afa h TYR 358 N 5.44 0.00 0.20 -5.34 -1.99 -1.87 0.32 116.97 113.73 2afa h TYR 358 Ca -0.01 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.71 2afa h TYR 358 Cb 1.21 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.94 2afa h TYR 358 CO -0.06 0.06 -0.10 1.49 -0.00 0.00 0.00 178.16 179.55 2afa h GLU 359 N 0.00 -0.26 -0.01 4.88 4.57 -2.02 -3.37 114.58 118.36 2afa h GLU 359 Ca -0.00 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 2afa h GLU 359 Cb 0.67 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 2afa h GLU 359 CO 0.01 0.12 -0.51 0.09 -1.18 0.00 0.00 179.01 177.54 2afa n ASN 360 N -4.97 1.76 0.00 1.04 3.02 -1.24 -5.09 115.26 109.78 2afa n ASN 360 Ca -0.08 -1.38 0.00 0.00 -0.03 0.00 0.00 54.58 53.09 2afa n ASN 360 Cb 0.26 0.56 0.00 0.00 -0.61 0.00 0.00 39.78 39.98 2afa n ASN 360 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2afa n GLY 361 N 1.36 2.45 7.00 7.41 0.00 0.10 -4.38 105.19 119.13 2afa n GLY 361 Ca 0.08 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.30 2afa n GLY 361 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2afa n SER 362 N 0.00 0.00 -4.40 1.61 2.88 -1.24 -4.55 113.62 107.91 2afa n SER 362 Ca 0.00 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.33 2afa n SER 362 Cb 0.00 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.36 2afa n SER 362 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 2afa s TRP 363 N 0.00 1.99 0.54 0.66 0.52 -1.26 -1.10 118.94 120.29 2afa s TRP 363 Ca 0.00 -0.45 -0.19 0.00 0.02 0.00 0.00 56.10 55.48 2afa s TRP 363 Cb 0.00 -0.90 -0.06 0.00 -1.15 0.00 0.00 33.47 31.36 2afa s TRP 363 CO 0.00 0.53 1.07 -1.58 0.02 0.00 0.00 176.95 176.98 2afa s TRP 364 N -2.68 2.89 -0.02 -1.98 0.52 0.50 -4.86 118.94 113.31 2afa s TRP 364 Ca 0.25 1.55 0.08 0.00 0.02 0.00 0.00 56.10 58.01 2afa s TRP 364 Cb -0.03 -3.11 -0.23 0.00 -1.15 0.00 0.00 33.47 28.94 2afa s TRP 364 CO 0.11 -1.14 0.75 0.37 0.02 0.00 0.00 176.95 177.06 2afa h GLN 365 N 1.08 0.05 -2.54 4.98 5.75 -1.90 -3.42 115.11 119.10 2afa h GLN 365 Ca -0.49 -0.08 -0.09 0.00 -0.15 0.00 0.00 58.65 57.83 2afa h GLN 365 Cb 1.23 0.03 -0.22 0.00 1.07 0.00 0.00 27.48 29.59 2afa h GLN 365 CO 0.58 0.70 -0.10 -2.00 -2.65 0.00 0.00 178.83 175.35 2afa s GLU 366 N -2.61 0.68 0.42 1.69 2.12 -1.26 -0.59 118.70 119.14 2afa s GLU 366 Ca -0.06 0.45 0.04 0.00 0.36 0.00 0.00 54.97 55.76 2afa s GLU 366 Cb 0.08 0.32 -0.04 0.00 0.26 0.00 0.00 34.13 34.75 2afa s GLU 366 CO 0.82 -0.13 0.04 -0.51 -0.54 0.00 0.00 175.26 174.94 2afa s LEU 367 N -0.29 2.35 1.19 2.70 1.43 0.13 -3.89 118.68 122.31 2afa s LEU 367 Ca -0.05 -1.52 -0.18 0.00 -1.03 0.00 0.00 54.13 51.35 2afa s LEU 367 Cb -0.03 -0.56 0.28 0.00 0.03 0.00 0.00 46.19 45.91 2afa s LEU 367 CO 0.03 -0.71 1.06 -1.81 0.23 0.00 0.00 176.35 175.15 2afa s ASP 368 N -3.69 0.94 0.29 2.29 -0.00 0.35 -1.85 116.67 115.01 2afa s ASP 368 Ca 0.24 0.89 0.26 0.00 -0.00 0.00 0.00 52.55 53.94 2afa s ASP 368 Cb 0.06 -1.32 0.91 0.00 -0.00 0.00 0.00 42.92 42.57 2afa s ASP 368 CO 0.12 -4.14 1.76 0.00 -0.00 0.00 0.00 175.17 172.91 2afa h ALA 369 N -2.59 1.00 -0.45 5.23 0.00 -1.89 -1.64 119.26 118.93 2afa h ALA 369 Ca -0.49 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 2afa h ALA 369 Cb 1.32 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 2afa h ALA 369 CO 0.41 0.00 0.03 -0.25 0.00 0.00 0.00 179.25 179.44 2afa n ASP 370 N -2.43 4.68 -3.28 0.00 8.00 -1.26 -4.82 116.55 117.44 2afa n ASP 370 Ca 0.03 -3.05 -0.24 0.00 0.71 0.00 0.00 54.79 52.25 2afa n ASP 370 Cb 0.34 -0.63 0.05 0.00 -0.02 0.00 0.00 41.12 40.86 2afa n ASP 370 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2afa n ASN 371 N -0.06 -6.00 -4.63 -2.24 3.02 -0.62 -5.00 115.26 99.74 2afa n ASN 371 Ca 0.27 -0.41 -0.34 0.00 -0.03 0.00 0.00 54.58 54.07 2afa n ASN 371 Cb 1.08 -4.80 -0.10 0.00 -0.61 0.00 0.00 39.78 35.35 2afa n ASN 371 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2afa s LYS 372 N -5.98 2.82 0.06 3.52 1.02 -1.26 -4.72 119.74 115.21 2afa s LYS 372 Ca 0.42 -0.52 -0.31 0.00 0.02 0.00 0.00 55.97 55.59 2afa s LYS 372 Cb -0.19 -2.67 -0.08 0.00 -0.52 0.00 0.00 37.83 34.37 2afa s LYS 372 CO 0.53 0.67 1.59 0.14 -0.92 0.00 0.00 175.35 177.35 2afa s VAL 373 N -0.88 3.15 -0.26 3.17 -7.23 -1.26 0.13 120.40 117.22 2afa s VAL 373 Ca 0.14 0.62 -0.15 0.00 -1.81 0.00 0.00 61.98 60.78 2afa s VAL 373 Cb -0.11 -3.40 0.07 0.00 0.56 0.00 0.00 36.38 33.50 2afa s VAL 373 CO 0.03 0.00 0.63 -0.89 -0.31 0.00 0.00 175.10 174.57 2afa s THR 374 N 2.43 -0.01 0.00 5.32 2.01 -1.25 -4.88 115.64 119.26 2afa s THR 374 Ca 0.71 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.73 2afa s THR 374 Cb -0.38 -0.91 0.00 0.00 0.01 0.00 0.00 72.50 71.21 2afa s THR 374 CO 0.31 0.01 0.00 0.41 -0.69 0.00 0.00 174.62 174.66 2afa n THR 375 N 4.24 0.00 0.00 -0.82 -1.04 -1.26 -4.62 114.28 110.77 2afa n THR 375 Ca -0.20 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.81 2afa n THR 375 Cb 0.58 -0.41 0.00 0.00 -1.82 0.00 0.00 70.33 68.68 2afa n THR 375 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2afa n GLY 380 N 1.42 0.90 2.59 3.41 0.00 -1.22 -4.91 105.19 107.38 2afa n GLY 380 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2afa n GLY 380 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2afa n LYS 381 N 0.00 1.17 0.07 1.61 5.02 -0.59 -4.16 118.16 121.29 2afa n LYS 381 Ca 0.00 -3.30 0.10 0.00 -2.02 0.00 0.00 58.31 53.09 2afa n LYS 381 Cb 0.00 -1.33 0.43 0.00 -0.02 0.00 0.00 35.03 34.11 2afa n LYS 381 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2afa n GLN 382 N -0.02 0.12 -4.35 1.97 0.00 -1.02 -4.55 117.38 109.52 2afa n GLN 382 Ca 0.12 0.32 -0.29 0.00 0.00 0.00 0.00 57.00 57.14 2afa n GLN 382 Cb 0.79 -1.71 -0.12 0.00 0.00 0.00 0.00 30.24 29.21 2afa n GLN 382 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2afa s ASP 383 N -3.73 3.59 0.00 2.61 2.15 -1.26 -4.66 116.67 115.37 2afa s ASP 383 Ca 0.06 -0.67 0.00 0.00 0.43 0.00 0.00 52.55 52.37 2afa s ASP 383 Cb 0.10 -0.37 0.00 0.00 -0.30 0.00 0.00 42.92 42.35 2afa s ASP 383 CO 0.37 0.17 0.00 2.30 -0.17 0.00 0.00 175.17 177.84 2afa n ILE 384 N 0.78 0.00 -0.22 4.11 -5.35 -1.26 -4.89 119.36 112.53 2afa n ILE 384 Ca -0.16 0.00 -0.06 0.00 -0.27 0.00 0.00 62.75 62.25 2afa n ILE 384 Cb 0.53 1.01 0.04 0.00 -1.74 0.00 0.00 39.64 39.48 2afa n ILE 384 CO 0.00 0.00 0.00 0.22 -1.76 0.00 0.00 176.55 175.01 2afa h TYR 385 N 0.00 0.83 -0.43 4.28 3.20 -1.92 -3.02 116.97 119.91 2afa h TYR 385 Ca 0.00 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 2afa h TYR 385 Cb 0.15 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.13 2afa h TYR 385 CO 0.00 0.58 0.26 0.45 -1.64 0.00 0.00 178.16 177.82 2afa h HIS 386 N 0.84 0.56 -1.03 -3.82 3.86 -1.99 -3.05 115.15 110.52 2afa h HIS 386 Ca 0.22 0.00 0.30 0.00 -1.16 0.00 0.00 60.37 59.73 2afa h HIS 386 Cb 0.01 -0.18 -0.04 0.00 1.06 0.00 0.00 27.41 28.25 2afa h HIS 386 CO -0.01 0.39 0.81 -0.07 0.86 0.00 0.00 177.93 179.91 2afa h LEU 387 N 0.57 0.00 -2.05 2.43 3.38 -1.89 0.40 115.31 118.15 2afa h LEU 387 Ca 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2afa h LEU 387 Cb -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 2afa h LEU 387 CO -0.03 0.00 -0.06 -0.07 0.09 0.00 0.00 178.44 178.37 2afa h LEU 388 N 0.00 0.00 -1.26 1.67 3.38 -1.64 -0.46 115.31 117.01 2afa h LEU 388 Ca 0.49 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.44 2afa h LEU 388 Cb 2.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.86 2afa h LEU 388 CO -0.01 0.06 -0.09 0.45 0.09 0.00 0.00 178.44 178.95 2afa h HIS 389 N 0.00 0.00 -0.00 1.13 3.86 -0.37 0.11 115.15 119.88 2afa h HIS 389 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2afa h HIS 389 Cb 0.31 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.78 2afa h HIS 389 CO 0.00 0.09 -0.24 0.00 0.86 0.00 0.00 177.93 178.64 2afa n LEU 391 N -0.86 1.23 -0.06 0.00 4.77 -0.27 -4.68 117.00 117.12 2afa n LEU 391 Ca 0.02 -0.04 -0.09 0.00 -0.03 0.00 0.00 56.01 55.87 2afa n LEU 391 Cb 0.11 -0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.09 2afa n LEU 391 CO 0.11 0.51 -0.92 0.52 -1.33 0.00 0.00 177.39 176.28 2afa n VAL 392 N -2.69 0.72 -0.33 4.08 0.31 0.28 -4.64 118.33 116.06 2afa n VAL 392 Ca -0.25 -0.26 0.10 0.00 -0.01 0.00 0.00 64.34 63.92 2afa n VAL 392 Cb 0.88 -1.04 0.31 0.00 -0.91 0.00 0.00 33.84 33.08 2afa n VAL 392 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2afa h ILE 393 N -0.06 0.85 0.00 2.52 2.04 -1.44 0.43 117.51 121.85 2afa h ILE 393 Ca -0.29 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2afa h ILE 393 Cb 1.42 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2afa h ILE 393 CO -0.06 0.15 0.00 -2.65 0.00 0.00 0.00 178.15 175.59 2afa n PRO 394 N -4.62 0.05 -0.07 2.37 -0.02 -1.26 -1.45 135.00 130.01 2afa n PRO 394 Ca 0.19 0.28 0.11 0.00 -2.02 0.00 0.00 63.50 62.06 2afa n PRO 394 Cb 0.44 -1.50 0.13 0.00 -0.02 0.00 0.00 33.50 32.55 2afa n PRO 394 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2afa n ARG 395 N -1.42 2.16 -4.31 -0.52 1.74 0.14 -4.59 116.66 109.86 2afa n ARG 395 Ca 0.03 -1.95 -0.19 0.00 -0.77 0.00 0.00 57.85 54.98 2afa n ARG 395 Cb 0.10 -1.44 -0.11 0.00 -1.02 0.00 0.00 32.46 30.00 2afa n ARG 395 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2afa s LEU 396 N -1.66 2.49 0.98 0.55 1.43 -0.53 -0.74 118.68 121.20 2afa s LEU 396 Ca 0.29 -0.94 -0.13 0.00 -1.03 0.00 0.00 54.13 52.32 2afa s LEU 396 Cb 0.19 -0.64 0.18 0.00 0.03 0.00 0.00 46.19 45.95 2afa s LEU 396 CO 0.28 -0.15 1.14 -2.16 0.23 0.00 0.00 176.35 175.68 2afa s PRO 397 N -3.24 0.61 0.27 1.29 0.04 -1.26 -4.95 135.00 127.76 2afa s PRO 397 Ca 0.17 0.24 0.25 0.00 0.04 0.00 0.00 61.00 61.71 2afa s PRO 397 Cb -0.02 -1.78 0.63 0.00 0.04 0.00 0.00 34.50 33.37 2afa s PRO 397 CO 0.05 -2.55 1.69 -0.07 0.04 0.00 0.00 177.00 176.16 2afa h LEU 398 N -1.75 0.00 -7.64 -3.56 3.38 -1.94 -3.44 115.31 100.36 2afa h LEU 398 Ca -0.51 -0.01 -0.32 0.00 0.09 0.00 0.00 57.88 57.13 2afa h LEU 398 Cb 1.32 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 41.74 2afa h LEU 398 CO 0.56 0.01 -0.74 0.00 0.09 0.00 0.00 178.44 178.35 2afa s ALA 399 N -3.14 0.24 1.06 1.53 0.00 -1.26 -4.35 121.76 115.83 2afa s ALA 399 Ca 0.09 0.14 -0.16 0.00 0.00 0.00 0.00 51.96 52.03 2afa s ALA 399 Cb 0.10 -0.24 0.22 0.00 0.00 0.00 0.00 23.12 23.19 2afa s ALA 399 CO 0.63 -0.05 1.12 -0.35 0.00 0.00 0.00 175.76 177.11 2afa n PRO 400 N 3.89 -1.59 -0.40 0.00 -0.04 -1.26 -5.03 135.00 130.58 2afa n PRO 400 Ca -0.24 -1.74 -0.29 0.00 -0.04 0.00 0.00 63.50 61.20 2afa n PRO 400 Cb 0.52 -1.26 0.26 0.00 -0.04 0.00 0.00 33.50 32.98 2afa n PRO 400 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2afa n GLY 401 N -2.95 -2.86 0.00 0.55 0.00 -1.26 -4.33 105.19 94.33 2afa n GLY 401 Ca 0.14 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.84 2afa n GLY 401 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2afa n LEU 402 N -4.71 0.00 -0.04 0.99 7.94 -1.26 -0.15 117.00 119.78 2afa n LEU 402 Ca 0.06 0.75 -0.08 0.00 -1.11 0.00 0.00 56.01 55.63 2afa n LEU 402 Cb 0.56 -0.25 -0.02 0.00 0.53 0.00 0.00 43.42 44.23 2afa n LEU 402 CO 0.49 -0.25 0.80 0.00 -1.11 0.00 0.00 177.39 177.31 2afa h ALA 403 N -1.53 0.08 -0.45 1.96 0.00 -1.94 -2.26 119.26 115.12 2afa h ALA 403 Ca 0.00 0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.07 2afa h ALA 403 Cb 0.00 0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.94 2afa h ALA 403 CO 0.00 -0.52 0.04 -1.35 0.00 0.00 0.00 179.25 177.42 2afa h PRO 404 N -0.07 0.15 -0.41 0.00 0.11 -1.87 -1.25 132.00 128.66 2afa h PRO 404 Ca 0.11 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.23 2afa h PRO 404 Cb 0.23 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.27 2afa h PRO 404 CO -0.24 0.10 0.24 0.00 -0.21 0.00 0.00 178.00 177.89 2afa h ALA 405 N 1.37 0.52 -0.11 -0.75 0.00 -0.23 0.88 119.26 120.95 2afa h ALA 405 Ca 0.22 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2afa h ALA 405 Cb 0.31 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2afa h ALA 405 CO -0.34 -0.09 0.06 0.28 0.00 0.00 0.00 179.25 179.17 2afa h VAL 406 N 0.49 1.07 0.00 0.00 2.07 -1.04 -1.42 116.25 117.41 2afa h VAL 406 Ca 0.17 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 2afa h VAL 406 Cb 0.01 0.99 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 2afa h VAL 406 CO -0.08 0.06 -0.05 0.00 0.02 0.00 0.00 177.57 177.53 2afa h ALA 407 N 0.99 1.60 -0.01 1.67 0.00 -0.92 -0.15 119.26 122.44 2afa h ALA 407 Ca 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2afa h ALA 407 Cb 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2afa h ALA 407 CO -0.01 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.30 2afa n ALA 408 N -2.38 2.64 -1.89 0.00 0.00 0.28 -4.91 120.51 114.25 2afa n ALA 408 Ca -0.03 -0.27 -0.06 0.00 0.00 0.00 0.00 53.44 53.08 2afa n ALA 408 Cb 0.13 -1.38 -0.01 0.00 0.00 0.00 0.00 19.45 18.20 2afa n ALA 408 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2afa n GLY 409 N 1.03 0.30 0.58 0.00 0.00 -0.07 -4.95 105.19 102.07 2afa n GLY 409 Ca 0.21 -0.67 0.11 0.00 0.00 0.00 0.00 46.02 45.67 2afa n GLY 409 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2afa n LEU 410 N -0.83 1.74 -4.71 0.99 4.77 -0.63 -4.83 117.00 113.51 2afa n LEU 410 Ca -0.07 -0.70 -0.42 0.00 -0.03 0.00 0.00 56.01 54.79 2afa n LEU 410 Cb 0.47 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.44 2afa n LEU 410 CO 0.09 0.35 1.43 -0.11 -1.33 0.00 0.00 177.39 177.81 2afa n LEU 411 N 0.37 4.06 -0.26 2.23 7.94 -1.26 -1.31 117.00 128.77 2afa n LEU 411 Ca 0.17 1.03 -0.03 0.00 -1.11 0.00 0.00 56.01 56.06 2afa n LEU 411 Cb 0.35 -1.57 -0.01 0.00 0.53 0.00 0.00 43.42 42.72 2afa n LEU 411 CO 0.14 0.20 -0.03 0.47 -1.11 0.00 0.00 177.39 177.06 2afa n ASP 412 N 4.75 -5.52 -0.34 1.96 8.00 0.08 -4.88 116.55 120.59 2afa n ASP 412 Ca 0.17 0.08 0.13 0.00 0.71 0.00 0.00 54.79 55.88 2afa n ASP 412 Cb 0.36 -3.32 0.31 0.00 -0.02 0.00 0.00 41.12 38.45 2afa n ASP 412 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2afa h ILE 413 N 0.00 0.66 -0.01 0.53 2.10 -1.36 -0.17 117.51 119.26 2afa h ILE 413 Ca -0.07 -0.23 0.00 0.00 1.08 0.00 0.00 64.86 65.64 2afa h ILE 413 Cb 0.93 -0.08 0.00 0.00 -1.09 0.00 0.00 36.82 36.58 2afa h ILE 413 CO 0.10 0.12 -0.10 0.59 -1.08 0.00 0.00 178.15 177.78 2afa n ASN 414 N -4.83 0.67 -0.17 2.19 3.02 -1.26 -5.17 115.26 109.71 2afa n ASN 414 Ca 0.23 -0.82 0.15 0.00 -0.03 0.00 0.00 54.58 54.11 2afa n ASN 414 Cb 0.58 -0.02 0.80 0.00 -0.61 0.00 0.00 39.78 40.53 2afa n ASN 414 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64